A0A077Z1Z8_TRITR Loading...

Low density lipoprotein receptor protein

AlphaFold DB , UniProt , Accession A0A077Z1Z8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 837 aa.

						>A0A077Z1Z8_TRITR|A0A077Z1Z8
MPKQQNSKRSSELPSEGRAKKTKSKSKGCGKNKYRCLNGGGCISRTKLCNGQPDCPDGSDELDCRRSSRAAVEQNCPKDHFRCSEKNTECIPISWVCDGKKDCLGGEDESSCHLTAPCPPDHFSCRNKRCIDQRFVCNDLDDCGDGSDEERCPLTGYHKCNADEYKCYKGPCIPIEAVCDGIKECPHEDDEWNCTAVVHCLPGEFQCNGSSVCMPESWKCDGVGDCQDNSDEFDCPSRISIYKSCGADMFACDNGRCISRVQMCDGRKDCLDGSDEHKWCGAETYHGVECLCKNEWRLASTNDNDCEDEAVCKNGQHRCSHFCHRESGGYQCSCAEGYRLEHDGESCKLLDQQAGRLLFSVDQQVRSVSLNWKEEGADYSVILDTSSTRILSLDHVSRERRSYYTRESTVYSFDEKGENCLFGDFINFANIAVDWIIGNIYYADEGRGKIGFCSSDGRYCTVFEQIHFGMPRGIALYPKLGYLFVTDWGKNASISRIAMDGSSMTFVHKEKLAWPNAVAIDYVRDRLYWVDARYLLIESSRLDGTDRQVLFSSAILHPFDMVVFDDYVFWSDWRLKAVMKVNVRNVTDVGPVQNFNGQAYGVAIDHPVYQNTSWKNLCSSKGCSHLCAVGPKDLSSAELRHSCLCPNGYELKDDKKTCQARLEKRSMPIRWCLQSFKKNCEQGTACKNNGSCHYEYDRQERLRRIYCELVDKDIHQLICTNGYSGLYCEVAPVVGRSSGKWSSPLIGLFLSITFAVLVCILWSSLRKLKFSEPLLGNMATKLRRLSRGNVSQDCVRLTTGDRSNGGVVNPLYEEKHCFIRTTPVESYDSGATSTFEA
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.4	Very low	30.6	Very low	231 Å²	231	162.2 Å²	162.2	100%	1.138	83%	0.826	S	S	*	*				0	145.1	0	-78.5	-76.3	-174	0	0	108.4
2	P	46.5	Very low	30.1	Very low	105 Å²	105	163.4 Å²	163.4	68%	0.682	83%	0.826	S	S	*	*			cis	-135.3	161.4	-27.5	38.5	-21.8	0	0	0	114.5
3	K	31.5	Very low	29.6	Very low	172 Å²	172	162 Å²	162	75%	0.748	82%	0.821	S	S	*	*			trans	36.4	127.4	131.8	-60	-179.7	176.7	-179.4	0	121.2
4	Q	34.5	Very low	29.3	Very low	203 Å²	203	159.4 Å²	159.4	95%	0.949	82%	0.82	S	S	*	*				-129.2	126.5	123.9	-81.2	-165.9	-16.4	0	0	110.7
5	Q	27.4	Very low	28.9	Very low	156 Å²	156	155.5 Å²	155.5	73%	0.729	81%	0.813	S	S	*	*			trans	-108.7	136.4	171.6	-79.4	178.8	-53.6	0	0	108.6
6	N	30.6	Very low	28.9	Very low	167 Å²	167	158.1 Å²	158.1	89%	0.893	82%	0.819	S	S	*	*			trans	175.7	145.9	146.7	-96.6	-20.8	0	0	0	106.4
7	S	29.5	Very low	28.8	Very low	79 Å²	79	153.1 Å²	153.1	55%	0.552	82%	0.816	S	S	*	*			cis	174.7	131.8	-8.6	175.5	0	0	0	0	105.6
8	K	27	Very low	28.5	Very low	198 Å²	198	158.8 Å²	158.8	86%	0.861	82%	0.824	S	S	*	*			trans	60.3	138.2	151.4	-62.1	171	-176.3	-178.9	0	117.2
9	R	28.9	Very low	28.6	Very low	240 Å²	240	155.2 Å²	155.2	91%	0.906	82%	0.82	S	S	*	*			cis	-170.2	143.1	44.3	-175.3	174.3	-176.9	-174.3	0.3	109
10	S	23.5	Very low	28.5	Very low	112 Å²	112	157.6 Å²	157.6	78%	0.783	82%	0.823	S	S	*	*			trans	-66.6	146.2	176.3	-42	0	0	0	0	114.1
11	S	30.4	Very low	28.5	Very low	121 Å²	121	159.7 Å²	159.7	85%	0.846	83%	0.826	S	S	*	*			trans	-150.5	117.1	148.5	54.6	0	0	0	0	108.4
12	E	24.2	Very low	28.4	Very low	177 Å²	177	155.2 Å²	155.2	83%	0.827	81%	0.812	S	S	*	*			trans	-77.7	146.2	-179.3	-71.9	167.5	135.1	0	0	112.6
13	L	24	Very low	27.5	Very low	145 Å²	145	159.9 Å²	159.9	76%	0.759	82%	0.821	S	S	*	*			trans	49.5	137.2	139.6	-71.3	160.6	0	0	0	119.5
14	P	25.1	Very low	27.5	Very low	125 Å²	125	157 Å²	157	81%	0.812	82%	0.822	S	S	*	*				-145.5	157.1	64.2	35.1	-14.4	0	0	0	117.3
15	S	23.9	Very low	27.4	Very low	101 Å²	101	156.3 Å²	156.3	71%	0.706	82%	0.816	S	S	*	*			trans	-82.7	119.7	166.2	52.9	0	0	0	0	111.1
16	E	27.5	Very low	27.9	Very low	197 Å²	197	154.1 Å²	154.1	92%	0.921	82%	0.818	S	S	*	*			trans	-147.7	148	157.6	-84.1	-164.9	156.4	0	0	110.5
17	G	28	Very low	28.7	Very low	73 Å²	73	155 Å²	155	75%	0.753	81%	0.814	S	S	*	*			trans	97.4	77.5	149.9	0	0	0	0	0	117.3	A19	G17-A19 PolarHBondContact O-N 2.83Å
18	R	23.9	Very low	30.2	Very low	256 Å²	256	154.1 Å²	154.1	97%	0.966	82%	0.818	S	S	*	*			trans	-61.7	87.9	164.1	-170	179.8	-170.6	178.8	2.9	110.8
19	A	29.3	Very low	32.6	Very low	91 Å²	91	146.1 Å²	146.1	75%	0.752	79%	0.786	S	S	*	*			trans	-85.7	123.2	165.6	0	0	0	0	0	109.9	G17 K21	G17-A19 PolarHBondContact O-N 2.83Å; A19-K21 PolarHBondContact O-N 3.17Å
20	K	27.4	Very low	34.9	Very low	202 Å²	202	137 Å²	137	88%	0.878	77%	0.767	S	S	*	*			trans	-51.8	109.1	179.5	-69	171.4	178	174	0	110.1	T22	K20-T22 PolarHBondContact O-N 3.5Å
21	K	27.8	Very low	36.9	Very low	203 Å²	203	141.8 Å²	141.8	88%	0.883	77%	0.774	S	S	*	*			trans	-61.2	102.3	162.9	-76.9	-177	177.7	179.3	0	107.6	A19 K23	A19-K21 PolarHBondContact O-N 3.17Å; K21-K23 PolarHBondContact O-N 2.79Å
22	T	26.6	Very low	39	Very low	137 Å²	137	141.4 Å²	141.4	84%	0.84	76%	0.762	S	S	*	*			trans	-52.9	113.7	158.4	10.2	0	0	0	0	106.7	K20 S24	K20-T22 PolarHBondContact O-N 3.5Å; T22-S24 PolarHBondContact O-N 3.27Å
23	K	26.9	Very low	41.8	Very low	203 Å²	203	138.9 Å²	138.9	88%	0.883	75%	0.748	S	S	*	*			trans	-59.7	86.5	167.5	-74.4	178.5	174.3	178.4	0	107.6	K21 K25	K21-K23 PolarHBondContact O-N 2.79Å; K23-K25 PolarHBondContact O-N 3.1Å; K23-K25 VanDerWaalsContact O-N 3.09Å
24	S	31.5	Very low	44.5	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	72%	0.722	S	S	*	*			trans	-66.3	106.5	155.5	-178.2	0	0	0	0	105.2	T22 S26	T22-S24 PolarHBondContact O-N 3.27Å; S24-S26 PolarHBondContact O-N 3.09Å
25	K	32.1	Very low	47.2	Very low	190 Å²	190	134.6 Å²	134.6	83%	0.826	71%	0.706	S	S	*	*			trans	-50.6	107.3	169.3	-75.2	178.4	175.3	178.1	0	106.4	K23 K27	K23-K25 PolarHBondContact O-N 3.1Å; K23-K25 VanDerWaalsContact O-N 3.09Å; K25-K27 PolarHBondContact O-N 2.82Å
26	S	37.6	Very low	50.1	Low	109 Å²	109	129.9 Å²	129.9	76%	0.762	67%	0.673	S	S	*	*			trans	-58.9	109.8	167.9	47.3	0	0	0	0	106.5	S24 G28	S24-S26 PolarHBondContact O-N 3.09Å; S26-G28 VanDerWaalsContact C-N 3.28Å; S26-G28 PolarHBondContact O-N 3.14Å
27	K	47.9	Very low	52.6	Low	186 Å²	186	126.4 Å²	126.4	81%	0.809	66%	0.66	S	S	*	*			trans	-62	95.5	169.1	-78.4	-175.1	176.1	-178.9	0	106.9	K25 R35	K25-K27 PolarHBondContact O-N 2.82Å; K27-R35 PolarHBondContact O-NH2 3.37Å
28	G	61.8	Low	54.8	Low	61 Å²	61	129.9 Å²	129.9	63%	0.629	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-58.6	147.7	164.6	0	0	0	0	0	109.4	S26	S26-G28 VanDerWaalsContact C-N 3.28Å; S26-G28 PolarHBondContact O-N 3.14Å
29	C	77.1	Confident	57	Low	29 Å²	29	120.7 Å²	120.7	20%	0.196	65%	0.647	C	S	.	*	P	Polyproline II helix	trans	-65.3	139.1	168.6	-60.5	0	0	0	0	108.4	K33 R35 C42	C29-K33 HydrophobicContact CB-CB 3.93Å; C29-K33 WeakPolarHBondContact CB-O 3.44Å; C29-R35 HydrophobicContact CB-CB 4.46Å; C29-R35 VanDerWaalsContact SG-CA 3.6Å; C29-R35 WeakPolarHBondContact SG-CB 3.34Å; C29-C42 VanDerWaalsContact CA-SG 3.51Å; C29-C42 HydrophobicContact CB-CB 3.74Å; C29-C42 WeakPolarHBondContact CB-SG 3.43Å; C29-C42 WeakPolarHBondContact SG-CB 3.36Å; C29-C42 CovalentContact SG-SG 2.01Å; C29-C42 PolarHBondContact SG-SG 3.43Å
30	G	76.2	Confident	58.9	Low	49 Å²	49	118 Å²	118	51%	0.505	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-61.9	171.1	-178.5	0	0	0	0	0	113.3	N32 K33	G30-N32 PolarHBondContact O-N 2.96Å; G30-K33 PolarHBondContact O-N 3.03Å
31	K	66.6	Low	61.6	Low	212 Å²	212	110.3 Å²	110.3	92%	0.922	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-12.9	-167	-75.7	-175.2	174.6	-178.3	0	117.5
32	N	74.2	Confident	64.3	Low	114 Å²	114	103.2 Å²	103.2	61%	0.61	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	26.3	175.8	-78.7	-18.9	0	0	0	113.3	G30 R45	G30-N32 PolarHBondContact O-N 2.96Å; N32-R45 PolarHBondContact O-N 2.78Å
33	K	81.6	Confident	67	Low	123 Å²	123	97.8 Å²	97.8	54%	0.535	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.9	179.4	-65.7	-166.2	179.8	-167.5	0	112.1	C29 G30 C42 I43	C29-K33 HydrophobicContact CB-CB 3.93Å; C29-K33 WeakPolarHBondContact CB-O 3.44Å; G30-K33 PolarHBondContact O-N 3.03Å; K33-C42 HydrophobicContact CB-CB 4.11Å; K33-C42 HydrophobicContact CD-CB 4.12Å; K33-I43 CarbonylContact C-O 3.48Å; K33-I43 VanDerWaalsContact C-O 3.31Å; K33-I43 WeakPolarHBondContact CA-O 3.25Å; K33-I43 WeakPolarHBondContact CB-O 3.46Å
34	Y	82.3	Confident	69.6	Low	51 Å²	51	90.3 Å²	90.3	20%	0.2	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	141.3	172	177.4	-99.2	0	0	0	110.4	C42 I43 L48 S59 D60	Y34-C42 CarbonylContact O-C 3.58Å; Y34-C42 VanDerWaalsContact O-CA 3.23Å; Y34-C42 WeakPolarHBondContact O-CA 3.43Å; Y34-I43 HydrophobicContact CD1-CD1 4.18Å; Y34-I43 HydrophobicContact CD1-CG1 4.08Å; Y34-I43 PolarHBondContact N-O 2.84Å; Y34-I43 PolarHBondContact O-N 3.04Å; Y34-L48 HydrophobicContact CD1-CD1 3.73Å; Y34-L48 HydrophobicContact CD2-CD1 3.52Å; Y34-L48 HydrophobicContact CD2-CD2 4.26Å; Y34-L48 HydrophobicContact CE1-CD1 3.83Å; Y34-L48 HydrophobicContact CE2-CD1 3.6Å; Y34-L48 HydrophobicContact CG-CD1 3.58Å; Y34-S59 PolarHBondContact OH-O 3.12Å; Y34-D60 HydrophobicContact CD1-CB 4.29Å; Y34-D60 HydrophobicContact CE1-CB 4.22Å
35	R	81.2	Confident	71.9	Confident	129 Å²	129	90.9 Å²	90.9	49%	0.487	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.8	178.2	-178.7	178.3	-102.1	-94	0.6	109.1	K27 C29	K27-R35 PolarHBondContact O-NH2 3.37Å; C29-R35 HydrophobicContact CB-CB 4.46Å; C29-R35 VanDerWaalsContact SG-CA 3.6Å; C29-R35 WeakPolarHBondContact SG-CB 3.34Å
36	C	85.4	Confident	74.1	Confident	2 Å²	2	87.4 Å²	87.4	1%	0.014	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-63.5	137.3	174	-50	0	0	0	0	110.9	N38 G41 C55 S59	C36-N38 PolarHBondContact O-N 3.16Å; C36-G41 PolarHBondContact N-O 3.29Å; C36-C55 VanDerWaalsContact CA-SG 3.53Å; C36-C55 HydrophobicContact CB-CB 3.75Å; C36-C55 WeakPolarHBondContact CB-SG 3.38Å; C36-C55 WeakPolarHBondContact SG-CB 3.31Å; C36-C55 CovalentContact SG-SG 2.03Å; C36-C55 PolarHBondContact SG-SG 2.96Å; C36-S59 VanDerWaalsContact CA-OG 3.25Å; C36-S59 WeakPolarHBondContact CA-OG 3.23Å
37	L	79.8	Confident	76.2	Confident	124 Å²	124	86.1 Å²	86.1	65%	0.649	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-43	-167.9	-72.1	170.1	0	0	0	113.3	D57 S59	L37-D57 PolarHBondContact N-OD2 3.29Å; L37-S59 PolarHBondContact N-OG 3.09Å
38	N	74.6	Confident	77.8	Confident	146 Å²	146	79.3 Å²	79.3	78%	0.781	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	28.3	-176.2	-71	-33.7	0	0	0	114.2	C36 D57	C36-N38 PolarHBondContact O-N 3.16Å; N38-D57 HydrophobicContact CB-CB 4.28Å; N38-D57 WeakPolarHBondContact CB-OD2 3.49Å; N38-D57 PolarHBondContact N-OD2 3.14Å
39	G	68.8	Low	78.7	Confident	63 Å²	63	79 Å²	79	65%	0.649	44%	0.441	S	S	*	.	S	Bend	trans	93.9	25.3	165.9	0	0	0	0	0	116.7	G41	G39-G41 PolarHBondContact O-N 3.46Å
40	G	69.5	Low	78.7	Confident	36 Å²	36	80.9 Å²	80.9	37%	0.371	45%	0.449	S	S	.	.			trans	-83.9	9.7	178.4	0	0	0	0	0	117.1
41	G	83.3	Confident	78.7	Confident	40 Å²	40	81.7 Å²	81.7	41%	0.412	46%	0.457	S	S	.	.			trans	92.5	-150.7	-176.3	0	0	0	0	0	114	C36 G39	C36-G41 PolarHBondContact N-O 3.29Å; G39-G41 PolarHBondContact O-N 3.46Å
42	C	85.6	Confident	79	Confident	54 Å²	54	77.7 Å²	77.7	37%	0.365	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	120.4	-175.3	-57.1	0	0	0	0	110.8	C29 K33 Y34	C29-C42 VanDerWaalsContact CA-SG 3.51Å; C29-C42 HydrophobicContact CB-CB 3.74Å; C29-C42 WeakPolarHBondContact CB-SG 3.43Å; C29-C42 WeakPolarHBondContact SG-CB 3.36Å; C29-C42 CovalentContact SG-SG 2.01Å; C29-C42 PolarHBondContact SG-SG 3.43Å; K33-C42 HydrophobicContact CB-CB 4.11Å; K33-C42 HydrophobicContact CD-CB 4.12Å; Y34-C42 CarbonylContact O-C 3.58Å; Y34-C42 VanDerWaalsContact O-CA 3.23Å; Y34-C42 WeakPolarHBondContact O-CA 3.43Å
43	I	83.8	Confident	79.4	Confident	23 Å²	23	77 Å²	77	12%	0.118	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	166.7	173.5	63.7	167.2	0	0	0	110.9	K33 Y34 K47 D54 D60	K33-I43 CarbonylContact C-O 3.48Å; K33-I43 VanDerWaalsContact C-O 3.31Å; K33-I43 WeakPolarHBondContact CA-O 3.25Å; K33-I43 WeakPolarHBondContact CB-O 3.46Å; Y34-I43 HydrophobicContact CD1-CD1 4.18Å; Y34-I43 HydrophobicContact CD1-CG1 4.08Å; Y34-I43 PolarHBondContact N-O 2.84Å; Y34-I43 PolarHBondContact O-N 3.04Å; I43-K47 HydrophobicContact CD1-CB 3.99Å; I43-D54 HydrophobicContact CD1-CB 4.04Å; I43-D54 HydrophobicContact CG2-CB 4.37Å; I43-D60 HydrophobicContact CD1-CB 3.4Å; I43-D60 VanDerWaalsContact CD1-CB 3.4Å; I43-D60 WeakPolarHBondContact CD1-OD2 3.26Å
44	S	80.5	Confident	79.6	Confident	46 Å²	46	73.3 Å²	73.3	32%	0.322	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	145.5	172.7	-178.7	0	0	0	0	110.7	T46 K47	S44-T46 WeakPolarHBondContact CB-OG1 3.12Å; S44-T46 PolarHBondContact O-N 3.23Å; S44-T46 PolarHBondContact OG-N 2.73Å; S44-T46 PolarHBondContact OG-OG1 2.87Å; S44-K47 WeakPolarHBondContact O-CB 3.32Å; S44-K47 PolarHBondContact O-N 3.1Å
45	R	80.4	Confident	79.7	Confident	122 Å²	122	71 Å²	71	46%	0.46	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-67.4	-18.6	175.2	-163.1	154.6	71.2	101	-1.7	113.2	N32 K47 L48	N32-R45 PolarHBondContact O-N 2.78Å; R45-K47 PolarHBondContact O-N 2.85Å; R45-L48 WeakPolarHBondContact O-CB 3.02Å; R45-L48 PolarHBondContact O-N 3.17Å
46	T	77.4	Confident	79.6	Confident	116 Å²	116	70.1 Å²	70.1	71%	0.712	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-72.7	-12.1	170.7	57.2	0	0	0	0	113.5	S44	S44-T46 WeakPolarHBondContact CB-OG1 3.12Å; S44-T46 PolarHBondContact O-N 3.23Å; S44-T46 PolarHBondContact OG-N 2.73Å; S44-T46 PolarHBondContact OG-OG1 2.87Å
47	K	82.3	Confident	79.4	Confident	83 Å²	83	72.4 Å²	72.4	36%	0.361	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-97.6	12.4	176	-70.2	179.1	160.4	-117.4	0	112.5	I43 S44 R45 D54	I43-K47 HydrophobicContact CD1-CB 3.99Å; S44-K47 WeakPolarHBondContact O-CB 3.32Å; S44-K47 PolarHBondContact O-N 3.1Å; R45-K47 PolarHBondContact O-N 2.85Å; K47-D54 HydrophobicContact CB-CB 4.15Å; K47-D54 VanDerWaalsContact CB-OD2 3.26Å; K47-D54 WeakPolarHBondContact CB-OD2 3.14Å; K47-D54 HydrophobicContact CD-CB 4.15Å; K47-D54 WeakPolarHBondContact CD-OD2 3.42Å; K47-D54 VanDerWaalsContact CG-OD2 3.26Å; K47-D54 WeakPolarHBondContact CG-OD2 3.36Å; K47-D54 VanDerWaalsContact NZ-CG 3.34Å; K47-D54 IonicContact NZ-OD1 2.76Å; K47-D54 PolarHBondContact NZ-OD1 3.39Å; K47-D54 IonicContact NZ-OD2 3.61Å; K47-D54 PolarHBondContact NZ-OD2 3.17Å
48	L	81.8	Confident	79.5	Confident	43 Å²	43	67.4 Å²	67.4	23%	0.225	42%	0.422	C	S	.	.	S	Bend	trans	-91.1	124.8	174.4	-167.6	77.3	0	0	0	108.2	Y34 R45 N50 D60	Y34-L48 HydrophobicContact CD1-CD1 3.73Å; Y34-L48 HydrophobicContact CD2-CD1 3.52Å; Y34-L48 HydrophobicContact CD2-CD2 4.26Å; Y34-L48 HydrophobicContact CE1-CD1 3.83Å; Y34-L48 HydrophobicContact CE2-CD1 3.6Å; Y34-L48 HydrophobicContact CG-CD1 3.58Å; R45-L48 WeakPolarHBondContact O-CB 3.02Å; R45-L48 PolarHBondContact O-N 3.17Å; L48-N50 VanDerWaalsContact C-N 3.33Å; L48-N50 PolarHBondContact O-N 2.81Å; L48-D60 HydrophobicContact CD1-CB 3.99Å; L48-D60 VanDerWaalsContact CD1-O 3.3Å; L48-D60 WeakPolarHBondContact CD1-O 3.19Å
49	C	80.6	Confident	79.9	Confident	53 Å²	53	60.5 Å²	60.5	36%	0.358	39%	0.386	S	S	.	.	S	Bend	trans	58.6	39.7	178.6	-57.7	0	0	0	0	113.8	D60 E61 C64	C49-D60 PolarHBondContact N-O 2.84Å; C49-E61 VanDerWaalsContact C-OE1 3.29Å; C49-E61 WeakPolarHBondContact CA-OE1 3.45Å; C49-E61 WeakPolarHBondContact CA-OE2 3.48Å; C49-E61 PolarHBondContact N-OE1 3.09Å; C49-C64 HydrophobicContact CB-CB 3.99Å; C49-C64 WeakPolarHBondContact CB-SG 3.41Å; C49-C64 VanDerWaalsContact SG-CA 3.58Å; C49-C64 WeakPolarHBondContact SG-CB 3.39Å; C49-C64 CovalentContact SG-SG 2.04Å; C49-C64 PolarHBondContact SG-SG 2.86Å
50	N	77.3	Confident	80.6	Confident	70 Å²	70	57.5 Å²	57.5	37%	0.374	36%	0.355	S	S	.	.	S	Bend	trans	-93.7	2.7	176.2	70.4	1.4	0	0	0	112.8	L48 Q52 D54 E61	L48-N50 VanDerWaalsContact C-N 3.33Å; L48-N50 PolarHBondContact O-N 2.81Å; N50-Q52 VanDerWaalsContact C-N 3.32Å; N50-Q52 WeakPolarHBondContact OD1-CA 3.32Å; N50-Q52 PolarHBondContact OD1-N 3.11Å; N50-Q52 PolarHBondContact OD1-O 2.93Å; N50-D54 PolarHBondContact ND2-OD2 3.12Å; N50-E61 PolarHBondContact N-OE1 2.8Å; N50-E61 PolarHBondContact OD1-OE1 3.33Å
51	G	75.2	Confident	81.3	Confident	65 Å²	65	58.3 Å²	58.3	67%	0.67	35%	0.349	S	S	*	.	S	Bend	trans	83.4	1.9	-178.1	0	0	0	0	0	114.5	E61	G51-E61 WeakPolarHBondContact CA-OE2 3.38Å; G51-E61 VanDerWaalsContact N-CD 3.34Å; G51-E61 PolarHBondContact N-OE1 3.27Å; G51-E61 PolarHBondContact N-OE2 2.89Å
52	Q	73.5	Confident	81	Confident	128 Å²	128	61.9 Å²	61.9	60%	0.598	36%	0.358	S	S	*	.	S	Bend	trans	-120.3	128.4	175.5	-69.2	-173.5	-16	0	0	110.2	N50 D54	N50-Q52 VanDerWaalsContact C-N 3.32Å; N50-Q52 WeakPolarHBondContact OD1-CA 3.32Å; N50-Q52 PolarHBondContact OD1-N 3.11Å; N50-Q52 PolarHBondContact OD1-O 2.93Å; Q52-D54 PolarHBondContact O-N 2.93Å
53	P	82.4	Confident	80.1	Confident	100 Å²	100	63.3 Å²	63.3	65%	0.649	36%	0.362	S	S	*	.			trans	-71.4	94.8	175.3	28.7	-32.3	0	0	0	110.2
54	D	85.1	Confident	79.6	Confident	45 Å²	45	64.9 Å²	64.9	24%	0.241	37%	0.374	C	S	.	.			trans	-87.2	-24	175.1	-77.9	-67.1	0	0	0	111.7	I43 K47 N50 Q52 D60	I43-D54 HydrophobicContact CD1-CB 4.04Å; I43-D54 HydrophobicContact CG2-CB 4.37Å; K47-D54 HydrophobicContact CB-CB 4.15Å; K47-D54 VanDerWaalsContact CB-OD2 3.26Å; K47-D54 WeakPolarHBondContact CB-OD2 3.14Å; K47-D54 HydrophobicContact CD-CB 4.15Å; K47-D54 WeakPolarHBondContact CD-OD2 3.42Å; K47-D54 VanDerWaalsContact CG-OD2 3.26Å; K47-D54 WeakPolarHBondContact CG-OD2 3.36Å; K47-D54 VanDerWaalsContact NZ-CG 3.34Å; K47-D54 IonicContact NZ-OD1 2.76Å; K47-D54 PolarHBondContact NZ-OD1 3.39Å; K47-D54 IonicContact NZ-OD2 3.61Å; K47-D54 PolarHBondContact NZ-OD2 3.17Å; N50-D54 PolarHBondContact ND2-OD2 3.12Å; Q52-D54 PolarHBondContact O-N 2.93Å; D54-D60 VanDerWaalsContact CA-OD2 3.25Å; D54-D60 WeakPolarHBondContact CA-OD2 2.97Å; D54-D60 WeakPolarHBondContact CB-OD2 3.09Å; D54-D60 PolarHBondContact N-OD2 2.83Å
55	C	84.2	Confident	78.6	Confident	4 Å²	4	73.3 Å²	73.3	3%	0.027	40%	0.399	C	S	.	.	S	Bend	trans	-80.4	137.3	166.9	-80.6	0	0	0	0	111.2	C36 D57 G58 D60	C36-C55 VanDerWaalsContact CA-SG 3.53Å; C36-C55 HydrophobicContact CB-CB 3.75Å; C36-C55 WeakPolarHBondContact CB-SG 3.38Å; C36-C55 WeakPolarHBondContact SG-CB 3.31Å; C36-C55 CovalentContact SG-SG 2.03Å; C36-C55 PolarHBondContact SG-SG 2.96Å; C55-D57 VanDerWaalsContact CB-OD1 3.29Å; C55-D57 WeakPolarHBondContact CB-OD1 3.45Å; C55-D57 PolarHBondContact O-N 3.35Å; C55-G58 PolarHBondContact O-N 2.9Å; C55-D60 HydrophobicContact CB-CB 4.15Å; C55-D60 VanDerWaalsContact CB-OD1 3.28Å; C55-D60 WeakPolarHBondContact CB-OD1 3.31Å; C55-D60 VanDerWaalsContact N-CG 3.29Å; C55-D60 PolarHBondContact N-OD1 2.97Å; C55-D60 PolarHBondContact N-OD2 3.38Å
56	P	80.2	Confident	77	Confident	110 Å²	110	77.2 Å²	77.2	71%	0.714	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-23.9	177.8	-23.6	31.5	0	0	0	114.7
57	D	80.3	Confident	75.3	Confident	50 Å²	50	75.5 Å²	75.5	27%	0.267	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	4.1	176.8	66.9	-17.4	0	0	0	113.4	L37 N38 C55 S59	L37-D57 PolarHBondContact N-OD2 3.29Å; N38-D57 HydrophobicContact CB-CB 4.28Å; N38-D57 WeakPolarHBondContact CB-OD2 3.49Å; N38-D57 PolarHBondContact N-OD2 3.14Å; C55-D57 VanDerWaalsContact CB-OD1 3.29Å; C55-D57 WeakPolarHBondContact CB-OD1 3.45Å; C55-D57 PolarHBondContact O-N 3.35Å; D57-S59 VanDerWaalsContact CG-OG 3.23Å; D57-S59 PolarHBondContact O-N 3.37Å; D57-S59 VanDerWaalsContact OD1-CB 3.29Å; D57-S59 WeakPolarHBondContact OD1-CB 3.4Å; D57-S59 PolarHBondContact OD1-N 3.18Å; D57-S59 PolarHBondContact OD1-OG 2.9Å; D57-S59 WeakPolarHBondContact OD2-CB 3.43Å; D57-S59 PolarHBondContact OD2-OG 3.32Å
58	G	82	Confident	73.6	Confident	19 Å²	19	76.1 Å²	76.1	20%	0.196	42%	0.421	C	S	.	.	S	Bend	trans	64.2	15.4	-176.3	0	0	0	0	0	114.6	C55 D60 E61 L62	C55-G58 PolarHBondContact O-N 2.9Å; G58-D60 VanDerWaalsContact C-OD1 3.32Å; G58-D60 PolarHBondContact O-N 3.26Å; G58-E61 PolarHBondContact O-N 3.45Å; G58-L62 WeakPolarHBondContact O-CG 3.37Å; G58-L62 PolarHBondContact O-N 3.49Å
59	S	84.1	Confident	71.4	Confident	1 Å²	1	85.6 Å²	85.6	1%	0.007	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.1	-175.1	53.5	0	0	0	0	115	Y34 C36 L37 D57 E61 L62	Y34-S59 PolarHBondContact OH-O 3.12Å; C36-S59 VanDerWaalsContact CA-OG 3.25Å; C36-S59 WeakPolarHBondContact CA-OG 3.23Å; L37-S59 PolarHBondContact N-OG 3.09Å; D57-S59 VanDerWaalsContact CG-OG 3.23Å; D57-S59 PolarHBondContact O-N 3.37Å; D57-S59 VanDerWaalsContact OD1-CB 3.29Å; D57-S59 WeakPolarHBondContact OD1-CB 3.4Å; D57-S59 PolarHBondContact OD1-N 3.18Å; D57-S59 PolarHBondContact OD1-OG 2.9Å; D57-S59 WeakPolarHBondContact OD2-CB 3.43Å; D57-S59 PolarHBondContact OD2-OG 3.32Å; S59-E61 VanDerWaalsContact C-N 3.34Å; S59-L62 PolarHBondContact O-N 2.92Å
60	D	82.9	Confident	69.2	Low	0 Å²	0	87.1 Å²	87.1	0%	0	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-22.9	176.6	56.4	-34	0	0	0	114.5	Y34 I43 L48 C49 D54 C55 G58	Y34-D60 HydrophobicContact CD1-CB 4.29Å; Y34-D60 HydrophobicContact CE1-CB 4.22Å; I43-D60 HydrophobicContact CD1-CB 3.4Å; I43-D60 VanDerWaalsContact CD1-CB 3.4Å; I43-D60 WeakPolarHBondContact CD1-OD2 3.26Å; L48-D60 HydrophobicContact CD1-CB 3.99Å; L48-D60 VanDerWaalsContact CD1-O 3.3Å; L48-D60 WeakPolarHBondContact CD1-O 3.19Å; C49-D60 PolarHBondContact N-O 2.84Å; D54-D60 VanDerWaalsContact CA-OD2 3.25Å; D54-D60 WeakPolarHBondContact CA-OD2 2.97Å; D54-D60 WeakPolarHBondContact CB-OD2 3.09Å; D54-D60 PolarHBondContact N-OD2 2.83Å; C55-D60 HydrophobicContact CB-CB 4.15Å; C55-D60 VanDerWaalsContact CB-OD1 3.28Å; C55-D60 WeakPolarHBondContact CB-OD1 3.31Å; C55-D60 VanDerWaalsContact N-CG 3.29Å; C55-D60 PolarHBondContact N-OD1 2.97Å; C55-D60 PolarHBondContact N-OD2 3.38Å; G58-D60 VanDerWaalsContact C-OD1 3.32Å; G58-D60 PolarHBondContact O-N 3.26Å
61	E	84	Confident	67.1	Low	53 Å²	53	87 Å²	87	25%	0.248	48%	0.479	C	S	.	.	S	Bend	trans	-102.2	0.8	174.3	-61.7	-60.5	129.8	0	0	112.3	C49 N50 G51 G58 S59	C49-E61 VanDerWaalsContact C-OE1 3.29Å; C49-E61 WeakPolarHBondContact CA-OE1 3.45Å; C49-E61 WeakPolarHBondContact CA-OE2 3.48Å; C49-E61 PolarHBondContact N-OE1 3.09Å; N50-E61 PolarHBondContact N-OE1 2.8Å; N50-E61 PolarHBondContact OD1-OE1 3.33Å; G51-E61 WeakPolarHBondContact CA-OE2 3.38Å; G51-E61 VanDerWaalsContact N-CD 3.34Å; G51-E61 PolarHBondContact N-OE1 3.27Å; G51-E61 PolarHBondContact N-OE2 2.89Å; G58-E61 PolarHBondContact O-N 3.45Å; S59-E61 VanDerWaalsContact C-N 3.34Å
62	L	77.3	Confident	65.3	Low	115 Å²	115	88.5 Å²	88.5	60%	0.602	48%	0.475	S	S	*	.	S	Bend	trans	-91.4	129.6	-178.9	-75.6	171.3	0	0	0	112	G58 S59	G58-L62 WeakPolarHBondContact O-CG 3.37Å; G58-L62 PolarHBondContact O-N 3.49Å; S59-L62 PolarHBondContact O-N 2.92Å
63	D	67.1	Low	63.4	Low	83 Å²	83	91.4 Å²	91.4	44%	0.444	49%	0.488	S	S	.	.			trans	59	43.7	177.1	-157.9	16.8	0	0	0	115.3	R65 R66	D63-R65 PolarHBondContact O-N 2.03Å; D63-R66 PolarHBondContact O-N 2.03Å; D63-R66 VanDerWaalsContact O-N 3.13Å; D63-R66 VanDerWaalsContact OD2-CD 3.31Å; D63-R66 WeakPolarHBondContact OD2-CD 2.97Å; D63-R66 IonicContact OD2-NE 3.95Å; D63-R66 IonicContact OD2-NH1 2.67Å
64	C	71.9	Confident	61.7	Low	57 Å²	57	93.3 Å²	93.3	39%	0.385	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-11.7	169.9	-59.9	0	0	0	0	114	C49	C49-C64 HydrophobicContact CB-CB 3.99Å; C49-C64 WeakPolarHBondContact CB-SG 3.41Å; C49-C64 VanDerWaalsContact SG-CA 3.58Å; C49-C64 WeakPolarHBondContact SG-CB 3.39Å; C49-C64 CovalentContact SG-SG 2.04Å; C49-C64 PolarHBondContact SG-SG 2.86Å
65	R	61	Low	60	Low	222 Å²	222	97.8 Å²	97.8	84%	0.838	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-29.5	177.1	-64.3	-172.5	-179.7	-163.5	0.3	113.2	D63 S68	D63-R65 PolarHBondContact O-N 2.03Å; R65-S68 PolarHBondContact O-OG 3.31Å
66	R	45.6	Very low	59.4	Low	205 Å²	205	98.7 Å²	98.7	77%	0.774	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-17	-172.7	-78	-165.8	-178.1	147.4	-5.2	116	D63 S68	D63-R66 PolarHBondContact O-N 2.03Å; D63-R66 VanDerWaalsContact O-N 3.13Å; D63-R66 VanDerWaalsContact OD2-CD 3.31Å; D63-R66 WeakPolarHBondContact OD2-CD 2.97Å; D63-R66 IonicContact OD2-NE 3.95Å; D63-R66 IonicContact OD2-NH1 2.67Å; R66-S68 PolarHBondContact O-N 2.02Å
67	S	43.3	Very low	59	Low	79 Å²	79	97.3 Å²	97.3	55%	0.552	51%	0.51	S	S	*	.	S	Bend	trans	-77.7	6.4	174.1	-82.4	0	0	0	0	113.9	R69	S67-R69 PolarHBondContact O-N 3.36Å; S67-R69 VanDerWaalsContact O-N 3.15Å
68	S	45.7	Very low	58.1	Low	96 Å²	96	104.1 Å²	104.1	67%	0.671	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	12.5	-179.1	55.3	0	0	0	0	115.8	R65 R66	R65-S68 PolarHBondContact O-OG 3.31Å; R66-S68 PolarHBondContact O-N 2.02Å
69	R	35	Very low	57.2	Low	243 Å²	243	108.8 Å²	108.8	92%	0.917	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	-1.8	-176.4	-113.4	-176.6	174.4	118.2	0.2	117.4	S67	S67-R69 PolarHBondContact O-N 3.36Å; S67-R69 VanDerWaalsContact O-N 3.15Å
70	A	34.3	Very low	56.9	Low	85 Å²	85	112 Å²	112	70%	0.702	57%	0.572	S	S	*	*	S	Bend	trans	-148.8	101.7	175.6	0	0	0	0	0	111.9
71	A	33.8	Very low	56.5	Low	67 Å²	67	115.5 Å²	115.5	55%	0.554	59%	0.587	S	S	*	*	S	Bend	trans	83	115.5	-171.6	0	0	0	0	0	112
72	V	38.1	Very low	56	Low	96 Å²	96	118.4 Å²	118.4	58%	0.582	60%	0.596	S	S	*	*			cis	-144.5	128	33.4	-179.2	0	0	0	0	107.7	Q74	V72-Q74 HydrophobicContact CB-CB 4.12Å; V72-Q74 HydrophobicContact CB-CG 4.3Å; V72-Q74 HydrophobicContact CG1-CB 3.75Å; V72-Q74 HydrophobicContact CG1-CG 3.77Å; V72-Q74 PolarHBondContact O-N 3.3Å
73	E	32.6	Very low	56.1	Low	189 Å²	189	113 Å²	113	88%	0.883	57%	0.568	S	S	*	*			trans	-61.5	77.9	154.2	-162.4	160.6	-156.2	0	0	105.9	N75	E73-N75 PolarHBondContact O-N 3.33Å
74	Q	46.5	Very low	56.4	Low	140 Å²	140	112.8 Å²	112.8	65%	0.654	57%	0.573	S	S	*	*			trans	-90.2	92.4	-170	-143.3	162.4	5.7	0	0	106.1	V72 C76	V72-Q74 HydrophobicContact CB-CB 4.12Å; V72-Q74 HydrophobicContact CB-CG 4.3Å; V72-Q74 HydrophobicContact CG1-CB 3.75Å; V72-Q74 HydrophobicContact CG1-CG 3.77Å; V72-Q74 PolarHBondContact O-N 3.3Å; Q74-C76 PolarHBondContact O-N 3.22Å
75	N	49.2	Very low	55.6	Low	139 Å²	139	118.6 Å²	118.6	74%	0.743	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-62.2	130.5	165.8	-75.9	-5.1	0	0	0	107.9	E73	E73-N75 PolarHBondContact O-N 3.33Å
76	C	71.9	Confident	55.4	Low	24 Å²	24	118.3 Å²	118.3	16%	0.162	60%	0.599	C	S	.	*	P	Polyproline II helix	trans	-58.7	152	164.9	-68.9	0	0	0	0	109.2	Q74 H80 R82 C90	Q74-C76 PolarHBondContact O-N 3.22Å; C76-H80 HydrophobicContact CB-CB 4.08Å; C76-R82 VanDerWaalsContact SG-CB 3.53Å; C76-C90 VanDerWaalsContact CA-SG 3.58Å; C76-C90 HydrophobicContact CB-CB 3.91Å; C76-C90 WeakPolarHBondContact CB-SG 3.06Å; C76-C90 WeakPolarHBondContact SG-CB 2.98Å; C76-C90 CovalentContact SG-SG 2.04Å; C76-C90 PolarHBondContact SG-SG 2.8Å
77	P	72.9	Confident	55.8	Low	80 Å²	80	109.7 Å²	109.7	52%	0.519	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-50.1	152.4	168	-23.3	33.2	0	0	0	110.9	D79 H80	P77-D79 PolarHBondContact O-N 3.35Å; P77-H80 PolarHBondContact O-N 2.64Å
78	K	60	Low	56.6	Low	193 Å²	193	111.2 Å²	111.2	84%	0.839	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.1	-29.1	-174.4	-76.9	-174.9	176.4	-178.6	0	114.2	I93	K78-I93 VanDerWaalsContact O-CD1 3.31Å; K78-I93 WeakPolarHBondContact O-CD1 3.31Å
79	D	63.6	Low	57.9	Low	117 Å²	117	111.5 Å²	111.5	63%	0.626	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	14	-172.9	-41.6	-45.3	0	0	0	112.8	P77 I93	P77-D79 PolarHBondContact O-N 3.35Å; D79-I93 WeakPolarHBondContact O-CG1 3.22Å; D79-I93 PolarHBondContact O-N 2.69Å
80	H	77.1	Confident	60.1	Low	70 Å²	70	102.5 Å²	102.5	32%	0.324	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.7	-178.7	-69.8	54.4	0	0	0	112.3	C76 P77 C90 I91	C76-H80 HydrophobicContact CB-CB 4.08Å; P77-H80 PolarHBondContact O-N 2.64Å; H80-C90 HydrophobicContact CB-CB 3.96Å; H80-I91 CarbonylContact C-O 3.57Å; H80-I91 VanDerWaalsContact C-O 3.31Å; H80-I91 WeakPolarHBondContact CA-O 2.95Å; H80-I91 VanDerWaalsContact CB-O 3.26Å; H80-I91 WeakPolarHBondContact CB-O 2.93Å
81	F	75	Confident	62.2	Low	72 Å²	72	98.9 Å²	98.9	32%	0.316	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.8	171.8	179.3	-98	0	0	0	110.7	C90 I91 V96 E107 D108	F81-C90 WeakPolarHBondContact O-CA 3.49Å; F81-I91 HydrophobicContact CB-CG1 4.03Å; F81-I91 HydrophobicContact CD1-CD1 4.07Å; F81-I91 HydrophobicContact CD1-CG1 4.08Å; F81-I91 PolarHBondContact N-O 3.16Å; F81-I91 PolarHBondContact O-N 3.01Å; F81-V96 HydrophobicContact CB-CG2 3.41Å; F81-V96 VanDerWaalsContact CB-CG2 3.41Å; F81-V96 HydrophobicContact CD1-CG2 3.92Å; F81-V96 HydrophobicContact CD2-CG2 3.79Å; F81-V96 HydrophobicContact CG-CG2 3.44Å; F81-V96 VanDerWaalsContact CG-CG2 3.44Å; F81-E107 HydrophobicContact CE1-CG 4.13Å; F81-D108 HydrophobicContact CE1-CB 4.47Å
82	R	73.4	Confident	64.2	Low	115 Å²	115	97.4 Å²	97.4	43%	0.434	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	116.6	178.7	-179.1	168.7	174.3	-167	-2.4	109.6	C76	C76-R82 VanDerWaalsContact SG-CB 3.53Å
83	C	80.7	Confident	66	Low	0 Å²	0	95.8 Å²	95.8	0%	0	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-61.2	144.4	165.8	-54.9	0	0	0	0	109.4	N87 E89 C103 E107	C83-N87 CarbonylContact C-O 3.49Å; C83-N87 HydrophobicContact CB-CB 4.06Å; C83-N87 WeakPolarHBondContact CB-O 3.38Å; C83-E89 PolarHBondContact N-O 2.99Å; C83-E89 VanDerWaalsContact N-O 3.11Å; C83-C103 HydrophobicContact CB-CB 3.99Å; C83-C103 WeakPolarHBondContact CB-SG 3.15Å; C83-C103 WeakPolarHBondContact SG-CB 3.1Å; C83-C103 CovalentContact SG-SG 2.05Å; C83-C103 PolarHBondContact SG-SG 3.46Å; C83-E107 VanDerWaalsContact CA-OE1 3.28Å; C83-E107 WeakPolarHBondContact CA-OE1 3.46Å; C83-E107 VanDerWaalsContact CB-OE1 3.28Å; C83-E107 WeakPolarHBondContact CB-OE1 3.05Å
84	S	72.8	Confident	67.7	Low	80 Å²	80	89.7 Å²	89.7	56%	0.559	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-56.6	162.9	-175.2	-86.8	0	0	0	0	112.7	K86 N87 E107	S84-K86 PolarHBondContact O-N 3.11Å; S84-N87 CarbonylContact O-C 3.52Å; S84-N87 PolarHBondContact O-N 2.75Å; S84-N87 VanDerWaalsContact O-O 3.1Å; S84-E107 PolarHBondContact N-OE1 3.39Å
85	E	55.9	Low	69.2	Low	178 Å²	178	88.5 Å²	88.5	83%	0.832	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45	-18.7	-167.8	-67	-167.6	169.2	0	0	118.3
86	K	56.2	Low	70.6	Confident	217 Å²	217	84 Å²	84	94%	0.943	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-22.3	174	-66.4	-173.5	-179.3	177.1	0	113.4	S84	S84-K86 PolarHBondContact O-N 3.11Å
87	N	54.1	Low	70.6	Confident	24 Å²	24	85 Å²	85	13%	0.128	43%	0.432	C	S	.	.			trans	-133.1	106.5	178.6	-162.8	25.9	0	0	0	109.3	C83 S84 E89	C83-N87 CarbonylContact C-O 3.49Å; C83-N87 HydrophobicContact CB-CB 4.06Å; C83-N87 WeakPolarHBondContact CB-O 3.38Å; S84-N87 CarbonylContact O-C 3.52Å; S84-N87 PolarHBondContact O-N 2.75Å; S84-N87 VanDerWaalsContact O-O 3.1Å; N87-E89 PolarHBondContact ND2-OE2 3.35Å; N87-E89 PolarHBondContact O-N 2.8Å; N87-E89 VanDerWaalsContact O-N 3.09Å; N87-E89 PolarHBondContact OD1-OE2 3.05Å
88	T	59.5	Low	70.4	Confident	111 Å²	111	83.8 Å²	83.8	68%	0.681	42%	0.421	S	S	*	.			trans	-80.9	24.9	178.4	52.5	0	0	0	0	112.9
89	E	72.7	Confident	70.8	Confident	101 Å²	101	77.5 Å²	77.5	47%	0.472	41%	0.412	S	S	.	.			trans	-79.3	135.1	176.1	-73.7	178.3	157	0	0	110.5	C83 N87	C83-E89 PolarHBondContact N-O 2.99Å; C83-E89 VanDerWaalsContact N-O 3.11Å; N87-E89 PolarHBondContact ND2-OE2 3.35Å; N87-E89 PolarHBondContact O-N 2.8Å; N87-E89 VanDerWaalsContact O-N 3.09Å; N87-E89 PolarHBondContact OD1-OE2 3.05Å
90	C	80.9	Confident	71.2	Confident	54 Å²	54	78.6 Å²	78.6	37%	0.365	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.4	172.2	-62.2	0	0	0	0	107.3	C76 H80 F81	C76-C90 VanDerWaalsContact CA-SG 3.58Å; C76-C90 HydrophobicContact CB-CB 3.91Å; C76-C90 WeakPolarHBondContact CB-SG 3.06Å; C76-C90 WeakPolarHBondContact SG-CB 2.98Å; C76-C90 CovalentContact SG-SG 2.04Å; C76-C90 PolarHBondContact SG-SG 2.8Å; H80-C90 HydrophobicContact CB-CB 3.96Å; F81-C90 WeakPolarHBondContact O-CA 3.49Å
91	I	78.6	Confident	71.3	Confident	10 Å²	10	83.2 Å²	83.2	5%	0.051	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	150.9	171.9	61.2	172.7	0	0	0	109.1	H80 F81 W95 D102 D108	H80-I91 CarbonylContact C-O 3.57Å; H80-I91 VanDerWaalsContact C-O 3.31Å; H80-I91 WeakPolarHBondContact CA-O 2.95Å; H80-I91 VanDerWaalsContact CB-O 3.26Å; H80-I91 WeakPolarHBondContact CB-O 2.93Å; F81-I91 HydrophobicContact CB-CG1 4.03Å; F81-I91 HydrophobicContact CD1-CD1 4.07Å; F81-I91 HydrophobicContact CD1-CG1 4.08Å; F81-I91 PolarHBondContact N-O 3.16Å; F81-I91 PolarHBondContact O-N 3.01Å; I91-W95 HydrophobicContact CB-CB 4.46Å; I91-W95 HydrophobicContact CB-CE3 4.02Å; I91-W95 HydrophobicContact CD1-CB 4.09Å; I91-W95 HydrophobicContact CG2-CE3 4.16Å; I91-D102 HydrophobicContact CD1-CB 4.18Å; I91-D102 HydrophobicContact CG2-CB 4.37Å; I91-D108 HydrophobicContact CD1-CB 3.82Å
92	P	77.3	Confident	71.5	Confident	36 Å²	36	82.3 Å²	82.3	23%	0.234	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	143.9	170.8	-26.2	35.4	0	0	0	111.7	S94 W95	P92-S94 WeakPolarHBondContact CB-OG 3.17Å; P92-S94 PolarHBondContact O-N 2.82Å; P92-S94 VanDerWaalsContact O-N 3.15Å; P92-W95 HydrophobicContact CB-CG 4.3Å; P92-W95 HydrophobicContact CG-CD2 4.15Å; P92-W95 HydrophobicContact CG-CG 4.4Å; P92-W95 HydrophobicContact CG-CZ2 4.46Å; P92-W95 WeakPolarHBondContact O-CB 3.4Å; P92-W95 PolarHBondContact O-N 2.89Å
93	I	75	Confident	71.9	Confident	61 Å²	61	77 Å²	77	31%	0.313	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-58.3	-28.3	175.4	-73.2	171.7	0	0	0	111.5	K78 D79 W95 V96 P119	K78-I93 VanDerWaalsContact O-CD1 3.31Å; K78-I93 WeakPolarHBondContact O-CD1 3.31Å; D79-I93 WeakPolarHBondContact O-CG1 3.22Å; D79-I93 PolarHBondContact O-N 2.69Å; I93-W95 PolarHBondContact O-N 3.34Å; I93-W95 VanDerWaalsContact O-N 3.1Å; I93-V96 PolarHBondContact O-N 3.08Å; I93-V96 VanDerWaalsContact O-N 3.1Å; I93-P119 HydrophobicContact CG2-CB 4.2Å; I93-P119 HydrophobicContact CG2-CG 3.61Å
94	S	69.4	Low	71.6	Confident	62 Å²	62	83.9 Å²	83.9	43%	0.434	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-63.6	-10.7	175.8	55.6	0	0	0	0	114.4	P92	P92-S94 WeakPolarHBondContact CB-OG 3.17Å; P92-S94 PolarHBondContact O-N 2.82Å; P92-S94 VanDerWaalsContact O-N 3.15Å
95	W	76.9	Confident	71.5	Confident	114 Å²	114	83.1 Å²	83.1	43%	0.432	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-99.9	5.8	177.9	-64.9	7.4	0	0	0	112.5	I91 P92 I93 D102	I91-W95 HydrophobicContact CB-CB 4.46Å; I91-W95 HydrophobicContact CB-CE3 4.02Å; I91-W95 HydrophobicContact CD1-CB 4.09Å; I91-W95 HydrophobicContact CG2-CE3 4.16Å; P92-W95 HydrophobicContact CB-CG 4.3Å; P92-W95 HydrophobicContact CG-CD2 4.15Å; P92-W95 HydrophobicContact CG-CG 4.4Å; P92-W95 HydrophobicContact CG-CZ2 4.46Å; P92-W95 WeakPolarHBondContact O-CB 3.4Å; P92-W95 PolarHBondContact O-N 2.89Å; I93-W95 PolarHBondContact O-N 3.34Å; I93-W95 VanDerWaalsContact O-N 3.1Å; W95-D102 HydrophobicContact CB-CB 4.44Å; W95-D102 WeakPolarHBondContact CB-OD2 3.25Å; W95-D102 HydrophobicContact CE3-CB 3.73Å; W95-D102 HydrophobicContact CZ3-CB 4.41Å
96	V	77.8	Confident	72.5	Confident	46 Å²	46	75.2 Å²	75.2	28%	0.279	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	123.1	172.1	-178.4	0	0	0	0	108.6	F81 I93 D98	F81-V96 HydrophobicContact CB-CG2 3.41Å; F81-V96 VanDerWaalsContact CB-CG2 3.41Å; F81-V96 HydrophobicContact CD1-CG2 3.92Å; F81-V96 HydrophobicContact CD2-CG2 3.79Å; F81-V96 HydrophobicContact CG-CG2 3.44Å; F81-V96 VanDerWaalsContact CG-CG2 3.44Å; I93-V96 PolarHBondContact O-N 3.08Å; I93-V96 VanDerWaalsContact O-N 3.1Å; V96-D98 VanDerWaalsContact C-N 3.26Å; V96-D98 PolarHBondContact O-N 3.26Å
97	C	72.9	Confident	73.5	Confident	44 Å²	44	66.5 Å²	66.5	30%	0.297	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	33.2	-177.7	-58.8	0	0	0	0	113.6	D108 E109 C112	C97-D108 PolarHBondContact N-O 3.17Å; C97-E109 VanDerWaalsContact C-OE1 3.31Å; C97-E109 WeakPolarHBondContact CA-OE1 3.07Å; C97-E109 PolarHBondContact N-OE1 3.1Å; C97-E109 VanDerWaalsContact N-OE1 3.16Å; C97-C112 HydrophobicContact CB-CB 4.09Å; C97-C112 WeakPolarHBondContact CB-SG 3.09Å; C97-C112 VanDerWaalsContact SG-CA 3.58Å; C97-C112 WeakPolarHBondContact SG-CB 3.45Å; C97-C112 CovalentContact SG-SG 2.04Å; C97-C112 PolarHBondContact SG-SG 2.71Å
98	D	69.4	Low	74.7	Confident	54 Å²	54	65.4 Å²	65.4	29%	0.289	37%	0.373	S	S	.	.	S	Bend	trans	-83.6	-4.1	173.9	89.1	-30.4	0	0	0	112	V96 K100 E109	V96-D98 VanDerWaalsContact C-N 3.26Å; V96-D98 PolarHBondContact O-N 3.26Å; D98-K100 WeakPolarHBondContact OD1-CA 3.19Å; D98-K100 WeakPolarHBondContact OD1-CB 3.34Å; D98-K100 PolarHBondContact OD1-N 2.86Å; D98-E109 PolarHBondContact N-OE1 3.12Å
99	G	68.1	Low	75.7	Confident	62 Å²	62	62.4 Å²	62.4	64%	0.639	35%	0.351	S	S	*	.	S	Bend	trans	92.4	1.8	-179.1	0	0	0	0	0	113.8	E109	G99-E109 VanDerWaalsContact CA-OE2 3.27Å; G99-E109 WeakPolarHBondContact CA-OE2 3.05Å; G99-E109 PolarHBondContact N-OE1 3.25Å; G99-E109 PolarHBondContact N-OE2 3.25Å
100	K	71.3	Confident	75.7	Confident	139 Å²	139	61.1 Å²	61.1	60%	0.604	35%	0.353	S	S	*	.	S	Bend	trans	-118.1	146.9	177.6	-61.8	175.2	-174.4	163	0	110	D98 D102 E109	D98-K100 WeakPolarHBondContact OD1-CA 3.19Å; D98-K100 WeakPolarHBondContact OD1-CB 3.34Å; D98-K100 PolarHBondContact OD1-N 2.86Å; K100-D102 PolarHBondContact O-N 2.9Å; K100-E109 WeakPolarHBondContact O-CG 3.34Å
101	K	78.7	Confident	74.8	Confident	168 Å²	168	62.3 Å²	62.3	73%	0.73	36%	0.362	S	S	*	.			trans	-88.5	95	175.9	-66.1	180	-178.8	177.1	0	109.1	E109	K101-E109 HydrophobicContact CG-CG 4.26Å
102	D	79.2	Confident	74.3	Confident	52 Å²	52	64.7 Å²	64.7	28%	0.278	38%	0.379	S	S	.	.			trans	-93.8	-29.2	176.2	-64.8	-45.4	0	0	0	112	I91 W95 K100 D108	I91-D102 HydrophobicContact CD1-CB 4.18Å; I91-D102 HydrophobicContact CG2-CB 4.37Å; W95-D102 HydrophobicContact CB-CB 4.44Å; W95-D102 WeakPolarHBondContact CB-OD2 3.25Å; W95-D102 HydrophobicContact CE3-CB 3.73Å; W95-D102 HydrophobicContact CZ3-CB 4.41Å; K100-D102 PolarHBondContact O-N 2.9Å; D102-D108 WeakPolarHBondContact CA-OD2 3.38Å; D102-D108 WeakPolarHBondContact CB-OD2 3.27Å; D102-D108 PolarHBondContact N-OD2 3Å
103	C	82.1	Confident	73.4	Confident	4 Å²	4	71.4 Å²	71.4	3%	0.027	41%	0.407	C	S	.	.	S	Bend	trans	-78.2	136.5	164.5	-72.4	0	0	0	0	111.1	C83 G105 G106 E107 D108	C83-C103 HydrophobicContact CB-CB 3.99Å; C83-C103 WeakPolarHBondContact CB-SG 3.15Å; C83-C103 WeakPolarHBondContact SG-CB 3.1Å; C83-C103 CovalentContact SG-SG 2.05Å; C83-C103 PolarHBondContact SG-SG 3.46Å; C103-G105 PolarHBondContact O-N 3.24Å; C103-G105 VanDerWaalsContact O-N 3.08Å; C103-G106 PolarHBondContact O-N 2.67Å; C103-E107 HydrophobicContact CB-CG 3.96Å; C103-D108 HydrophobicContact CB-CB 4.24Å; C103-D108 WeakPolarHBondContact CB-OD1 3.35Å; C103-D108 PolarHBondContact N-OD2 3.4Å
104	L	74.5	Confident	72.2	Confident	145 Å²	145	75.1 Å²	75.1	76%	0.759	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-28.4	175.2	-88.9	163	0	0	0	114.3
105	G	72	Confident	71	Confident	64 Å²	64	78.8 Å²	78.8	66%	0.66	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-5	175.5	0	0	0	0	0	114.6	C103 E107	C103-G105 PolarHBondContact O-N 3.24Å; C103-G105 VanDerWaalsContact O-N 3.08Å; G105-E107 WeakPolarHBondContact CA-OE2 3.49Å; G105-E107 PolarHBondContact N-OE2 3.42Å; G105-E107 PolarHBondContact O-N 2.74Å
106	G	75.5	Confident	69.7	Low	11 Å²	11	77.3 Å²	77.3	11%	0.113	46%	0.459	C	S	.	.			trans	64.8	20.8	-174.2	0	0	0	0	0	113.6	C103 D108 E109 S110	C103-G106 PolarHBondContact O-N 2.67Å; G106-D108 VanDerWaalsContact C-N 3.31Å; G106-D108 WeakPolarHBondContact CA-OD1 2.98Å; G106-E109 PolarHBondContact O-N 2.91Å; G106-S110 WeakPolarHBondContact O-CB 3.27Å; G106-S110 PolarHBondContact O-N 3.05Å; G106-S110 VanDerWaalsContact O-N 3.12Å
107	E	78.6	Confident	68.7	Low	35 Å²	35	80.9 Å²	80.9	16%	0.164	48%	0.483	C	S	.	.	H	α-helix	trans	-67.5	-31.8	-179.1	57.1	-96.7	-136.3	0	0	113.6	F81 C83 S84 C103 G105 E109 S110	F81-E107 HydrophobicContact CE1-CG 4.13Å; C83-E107 VanDerWaalsContact CA-OE1 3.28Å; C83-E107 WeakPolarHBondContact CA-OE1 3.46Å; C83-E107 VanDerWaalsContact CB-OE1 3.28Å; C83-E107 WeakPolarHBondContact CB-OE1 3.05Å; S84-E107 PolarHBondContact N-OE1 3.39Å; C103-E107 HydrophobicContact CB-CG 3.96Å; G105-E107 WeakPolarHBondContact CA-OE2 3.49Å; G105-E107 PolarHBondContact N-OE2 3.42Å; G105-E107 PolarHBondContact O-N 2.74Å; E107-E109 PolarHBondContact O-N 2.04Å; E107-S110 VanDerWaalsContact CA-OG 3.29Å; E107-S110 WeakPolarHBondContact CA-OG 3.07Å; E107-S110 PolarHBondContact O-N 2.8Å; E107-S110 VanDerWaalsContact O-N 3.1Å; E107-S110 PolarHBondContact O-OG 3.48Å
108	D	77.9	Confident	68.7	Low	1 Å²	1	80 Å²	80	1%	0.005	48%	0.476	C	S	.	.	H	α-helix	trans	-53.4	-30.2	170.2	54.5	-29.9	0	0	0	112.7	F81 I91 C97 D102 C103 G106	F81-D108 HydrophobicContact CE1-CB 4.47Å; I91-D108 HydrophobicContact CD1-CB 3.82Å; C97-D108 PolarHBondContact N-O 3.17Å; D102-D108 WeakPolarHBondContact CA-OD2 3.38Å; D102-D108 WeakPolarHBondContact CB-OD2 3.27Å; D102-D108 PolarHBondContact N-OD2 3Å; C103-D108 HydrophobicContact CB-CB 4.24Å; C103-D108 WeakPolarHBondContact CB-OD1 3.35Å; C103-D108 PolarHBondContact N-OD2 3.4Å; G106-D108 VanDerWaalsContact C-N 3.31Å; G106-D108 WeakPolarHBondContact CA-OD1 2.98Å
109	E	81.3	Confident	68.8	Low	48 Å²	48	79.2 Å²	79.2	22%	0.224	47%	0.474	C	S	.	.	H	α-helix	trans	-105	-8.6	177.7	-66.5	-64.5	127.4	0	0	113.5	C97 D98 G99 K100 K101 G106 E107	C97-E109 VanDerWaalsContact C-OE1 3.31Å; C97-E109 WeakPolarHBondContact CA-OE1 3.07Å; C97-E109 PolarHBondContact N-OE1 3.1Å; C97-E109 VanDerWaalsContact N-OE1 3.16Å; D98-E109 PolarHBondContact N-OE1 3.12Å; G99-E109 VanDerWaalsContact CA-OE2 3.27Å; G99-E109 WeakPolarHBondContact CA-OE2 3.05Å; G99-E109 PolarHBondContact N-OE1 3.25Å; G99-E109 PolarHBondContact N-OE2 3.25Å; K100-E109 WeakPolarHBondContact O-CG 3.34Å; K101-E109 HydrophobicContact CG-CG 4.26Å; G106-E109 PolarHBondContact O-N 2.91Å; E107-E109 PolarHBondContact O-N 2.04Å
110	S	72	Confident	68.4	Low	74 Å²	74	82 Å²	82	52%	0.517	48%	0.481	S	S	.	.	H	α-helix	trans	-81.3	-27	-167.3	70.4	0	0	0	0	115	G106 E107	G106-S110 WeakPolarHBondContact O-CB 3.27Å; G106-S110 PolarHBondContact O-N 3.05Å; G106-S110 VanDerWaalsContact O-N 3.12Å; E107-S110 VanDerWaalsContact CA-OG 3.29Å; E107-S110 WeakPolarHBondContact CA-OG 3.07Å; E107-S110 PolarHBondContact O-N 2.8Å; E107-S110 VanDerWaalsContact O-N 3.1Å; E107-S110 PolarHBondContact O-OG 3.48Å
111	S	62.5	Low	68.2	Low	79 Å²	79	81.6 Å²	81.6	55%	0.552	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	25.6	-171.4	-63.3	0	0	0	0	114	H113	S111-H113 PolarHBondContact O-N 2.77Å
112	C	67.4	Low	68.1	Low	59 Å²	59	75.9 Å²	75.9	40%	0.399	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.9	179.9	-51.1	0	0	0	0	114	C97	C97-C112 HydrophobicContact CB-CB 4.09Å; C97-C112 WeakPolarHBondContact CB-SG 3.09Å; C97-C112 VanDerWaalsContact SG-CA 3.58Å; C97-C112 WeakPolarHBondContact SG-CB 3.45Å; C97-C112 CovalentContact SG-SG 2.04Å; C97-C112 PolarHBondContact SG-SG 2.71Å
113	H	58.6	Low	68.1	Low	178 Å²	178	76 Å²	76	82%	0.824	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-25.8	-178.9	-75.5	-58.1	0	0	0	114.9	S111 T115	S111-H113 PolarHBondContact O-N 2.77Å; H113-T115 PolarHBondContact O-N 2.96Å; H113-T115 VanDerWaalsContact O-N 3.12Å
114	L	50	Low	68	Low	139 Å²	139	79.2 Å²	79.2	73%	0.728	48%	0.482	S	S	*	.	S	Bend	trans	-89.1	72.5	-176.4	-77.9	162.2	0	0	0	110.4	A116	L114-A116 PolarHBondContact O-N 2.77Å
115	T	43.7	Very low	68.4	Low	138 Å²	138	72.4 Å²	72.4	85%	0.847	45%	0.447	S	S	*	.			trans	25.9	55.9	160	45.1	0	0	0	0	115.5	H113	H113-T115 PolarHBondContact O-N 2.96Å; H113-T115 VanDerWaalsContact O-N 3.12Å
116	A	50	Low	68.6	Low	84 Å²	84	76.8 Å²	76.8	69%	0.694	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-90.3	120	170.2	0	0	0	0	0	106.7	L114	L114-A116 PolarHBondContact O-N 2.77Å
117	P	58.1	Low	68.7	Low	121 Å²	121	80 Å²	80	79%	0.786	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-59.4	145	170	23.6	-29.9	0	0	0	109.7
118	C	71.9	Confident	68.4	Low	24 Å²	24	86.6 Å²	86.6	16%	0.162	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-51	153.2	172.6	-69.3	0	0	0	0	110.3	H122 S124 C130	C118-H122 HydrophobicContact CB-CB 4.02Å; C118-S124 VanDerWaalsContact SG-CA 3.51Å; C118-S124 WeakPolarHBondContact SG-CB 3.21Å; C118-C130 HydrophobicContact CB-CB 4.03Å; C118-C130 WeakPolarHBondContact CB-SG 3.12Å; C118-C130 WeakPolarHBondContact SG-CB 3.29Å; C118-C130 CovalentContact SG-SG 2.06Å; C118-C130 PolarHBondContact SG-SG 3.38Å
119	P	71.8	Confident	68.4	Low	38 Å²	38	92.4 Å²	92.4	25%	0.247	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-47.7	146.3	174	-26.1	33.3	0	0	0	111.5	I93 D121 H122	I93-P119 HydrophobicContact CG2-CB 4.2Å; I93-P119 HydrophobicContact CG2-CG 3.61Å; P119-D121 PolarHBondContact O-N 3.41Å; P119-D121 VanDerWaalsContact O-N 3.16Å; P119-H122 HydrophobicContact CB-CB 4.46Å; P119-H122 PolarHBondContact O-N 3.49Å
120	P	58.7	Low	68.4	Low	121 Å²	121	92.3 Å²	92.3	79%	0.786	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	126	168	24.4	-29.7	0	0	0	107.3
121	D	68.6	Low	68.7	Low	130 Å²	130	89.2 Å²	89.2	70%	0.695	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	12.2	-171.5	-44	-34.4	0	0	0	116.6	P119 Q133	P119-D121 PolarHBondContact O-N 3.41Å; P119-D121 VanDerWaalsContact O-N 3.16Å; D121-Q133 WeakPolarHBondContact O-CB 3.25Å; D121-Q133 PolarHBondContact O-N 2.8Å
122	H	76.9	Confident	69.5	Low	49 Å²	49	87.3 Å²	87.3	23%	0.227	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.2	168.1	-75.3	49.4	0	0	0	111.6	C118 P119 C130 I131	C118-H122 HydrophobicContact CB-CB 4.02Å; P119-H122 HydrophobicContact CB-CB 4.46Å; P119-H122 PolarHBondContact O-N 3.49Å; H122-C130 HydrophobicContact CB-CB 4.27Å; H122-I131 CarbonylContact C-O 3.5Å; H122-I131 WeakPolarHBondContact CA-O 3.19Å; H122-I131 VanDerWaalsContact CB-O 3.32Å; H122-I131 WeakPolarHBondContact CB-O 3.4Å
123	F	79	Confident	70	Confident	55 Å²	55	89 Å²	89	24%	0.241	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.7	175.8	178.1	-100.8	0	0	0	111	C125 C130 I131 V136 S147 D148	F123-C125 PolarHBondContact O-N 2.96Å; F123-C130 WeakPolarHBondContact O-CA 3.28Å; F123-I131 HydrophobicContact CB-CG1 4.1Å; F123-I131 HydrophobicContact CD1-CD1 4.25Å; F123-I131 HydrophobicContact CD1-CG1 4.15Å; F123-I131 PolarHBondContact N-O 3.38Å; F123-I131 PolarHBondContact O-N 2.72Å; F123-V136 HydrophobicContact CB-CG2 3.24Å; F123-V136 HydrophobicContact CD1-CG2 3.89Å; F123-V136 HydrophobicContact CD2-CG1 4.36Å; F123-V136 HydrophobicContact CD2-CG2 3.88Å; F123-V136 HydrophobicContact CG-CG2 3.41Å; F123-V136 VanDerWaalsContact CG-CG2 3.41Å; F123-S147 WeakPolarHBondContact CZ-O 3.26Å; F123-D148 HydrophobicContact CD1-CB 4.47Å; F123-D148 HydrophobicContact CE1-CB 4.28Å
124	S	78.9	Confident	70.7	Confident	70 Å²	70	87 Å²	87	49%	0.49	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	105.9	173.9	-166.4	0	0	0	0	109.6	C118	C118-S124 VanDerWaalsContact SG-CA 3.51Å; C118-S124 WeakPolarHBondContact SG-CB 3.21Å
125	C	82.3	Confident	72.1	Confident	3 Å²	3	83.6 Å²	83.6	2%	0.02	44%	0.44	C	S	.	.			trans	-60.4	158.1	169.9	-59.2	0	0	0	0	110.8	F123 N127 K128 R129 C143	F123-C125 PolarHBondContact O-N 2.96Å; C125-N127 VanDerWaalsContact C-N 3.29Å; C125-N127 WeakPolarHBondContact CB-OD1 3.42Å; C125-N127 PolarHBondContact O-N 3.36Å; C125-K128 WeakPolarHBondContact O-CA 3.41Å; C125-K128 PolarHBondContact O-N 2.81Å; C125-R129 HydrophobicContact CB-CB 4.18Å; C125-R129 WeakPolarHBondContact CB-O 3.28Å; C125-R129 PolarHBondContact N-O 2.95Å; C125-R129 PolarHBondContact SG-O 2.82Å; C125-R129 VanDerWaalsContact SG-O 3.33Å; C125-C143 HydrophobicContact CB-CB 3.76Å; C125-C143 WeakPolarHBondContact CB-SG 3.19Å; C125-C143 VanDerWaalsContact SG-CA 3.51Å; C125-C143 WeakPolarHBondContact SG-CB 3.07Å; C125-C143 CovalentContact SG-SG 2.03Å; C125-C143 PolarHBondContact SG-SG 2.76Å
126	R	77.9	Confident	73.8	Confident	156 Å²	156	77.9 Å²	77.9	59%	0.589	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-33.1	178.1	-174.7	-168.6	-54	-170.3	-4	112.1	K128 D145 S147 E150	R126-K128 PolarHBondContact O-N 3.04Å; R126-K128 VanDerWaalsContact O-N 3.17Å; R126-D145 WeakPolarHBondContact CB-OD2 3.26Å; R126-D145 PolarHBondContact N-OD2 3.32Å; R126-S147 WeakPolarHBondContact CB-OG 3.28Å; R126-S147 PolarHBondContact N-OG 2.94Å; R126-S147 PolarHBondContact NE-OG 2.91Å; R126-E150 IonicContact CZ-OE1 3.45Å; R126-E150 IonicContact CZ-OE2 3.87Å; R126-E150 IonicContact NH1-OE1 2.84Å; R126-E150 IonicContact NH2-OE1 2.65Å; R126-E150 PolarHBondContact NH2-OE1 2.03Å; R126-E150 IonicContact NH2-OE2 2.9Å; R126-E150 PolarHBondContact NH2-OE2 2.89Å
127	N	77.4	Confident	75	Confident	77 Å²	77	76 Å²	76	41%	0.412	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	4	169.9	68	12.2	0	0	0	113.8	C125 R129 C143 D145	C125-N127 VanDerWaalsContact C-N 3.29Å; C125-N127 WeakPolarHBondContact CB-OD1 3.42Å; C125-N127 PolarHBondContact O-N 3.36Å; N127-R129 VanDerWaalsContact C-N 3.26Å; N127-R129 PolarHBondContact O-N 3.41Å; N127-R129 WeakPolarHBondContact OD1-CB 3.01Å; N127-R129 PolarHBondContact OD1-N 2.71Å; N127-C143 PolarHBondContact ND2-O 3.47Å; N127-D145 VanDerWaalsContact CB-OD2 3.27Å; N127-D145 WeakPolarHBondContact CB-OD2 3.17Å; N127-D145 PolarHBondContact N-OD2 2.89Å
128	K	72.5	Confident	75.7	Confident	174 Å²	174	72.5 Å²	72.5	76%	0.757	36%	0.36	S	S	*	.	S	Bend	trans	69.8	10	-179.9	-50.6	-171.1	177.9	-173.7	0	115.7	C125 R126	C125-K128 WeakPolarHBondContact O-CA 3.41Å; C125-K128 PolarHBondContact O-N 2.81Å; R126-K128 PolarHBondContact O-N 3.04Å; R126-K128 VanDerWaalsContact O-N 3.17Å
129	R	77.4	Confident	75.5	Confident	124 Å²	124	78.1 Å²	78.1	47%	0.468	39%	0.389	S	S	.	.			trans	-69.4	139.4	166.1	-171	175.7	178.5	-156.2	-9.4	109.3	C125 N127 I131 D142	C125-R129 HydrophobicContact CB-CB 4.18Å; C125-R129 WeakPolarHBondContact CB-O 3.28Å; C125-R129 PolarHBondContact N-O 2.95Å; C125-R129 PolarHBondContact SG-O 2.82Å; C125-R129 VanDerWaalsContact SG-O 3.33Å; N127-R129 VanDerWaalsContact C-N 3.26Å; N127-R129 PolarHBondContact O-N 3.41Å; N127-R129 WeakPolarHBondContact OD1-CB 3.01Å; N127-R129 PolarHBondContact OD1-N 2.71Å; R129-I131 HydrophobicContact CG-CG2 4.46Å; R129-D142 PolarHBondContact NH1-O 3.02Å
130	C	80.5	Confident	75.3	Confident	46 Å²	46	81.3 Å²	81.3	31%	0.311	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.9	168.9	-61.8	0	0	0	0	108.3	C118 H122 F123	C118-C130 HydrophobicContact CB-CB 4.03Å; C118-C130 WeakPolarHBondContact CB-SG 3.12Å; C118-C130 WeakPolarHBondContact SG-CB 3.29Å; C118-C130 CovalentContact SG-SG 2.06Å; C118-C130 PolarHBondContact SG-SG 3.38Å; H122-C130 HydrophobicContact CB-CB 4.27Å; F123-C130 WeakPolarHBondContact O-CA 3.28Å
131	I	78.9	Confident	76.2	Confident	8 Å²	8	79.8 Å²	79.8	4%	0.041	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	154	168.8	62.5	171.6	0	0	0	108.7	H122 F123 R129 F135 V136 D142 D148	H122-I131 CarbonylContact C-O 3.5Å; H122-I131 WeakPolarHBondContact CA-O 3.19Å; H122-I131 VanDerWaalsContact CB-O 3.32Å; H122-I131 WeakPolarHBondContact CB-O 3.4Å; F123-I131 HydrophobicContact CB-CG1 4.1Å; F123-I131 HydrophobicContact CD1-CD1 4.25Å; F123-I131 HydrophobicContact CD1-CG1 4.15Å; F123-I131 PolarHBondContact N-O 3.38Å; F123-I131 PolarHBondContact O-N 2.72Å; R129-I131 HydrophobicContact CG-CG2 4.46Å; I131-F135 HydrophobicContact CB-CB 4.39Å; I131-F135 HydrophobicContact CD1-CB 3.87Å; I131-F135 HydrophobicContact CG1-CB 4.42Å; I131-V136 HydrophobicContact CD1-CG2 4.4Å; I131-D142 HydrophobicContact CD1-CB 4.09Å; I131-D148 HydrophobicContact CD1-CB 3.67Å
132	D	78.1	Confident	76.8	Confident	39 Å²	39	75.9 Å²	75.9	21%	0.209	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	140.3	174	-173.8	-55	0	0	0	109.6	R134 F135	D132-R134 HydrophobicContact CB-CG 4Å; D132-R134 PolarHBondContact O-N 2.79Å; D132-R134 WeakPolarHBondContact OD1-CB 3.21Å; D132-R134 WeakPolarHBondContact OD1-CD 3.19Å; D132-R134 WeakPolarHBondContact OD1-CG 3.36Å; D132-R134 PolarHBondContact OD1-N 3.49Å; D132-R134 IonicContact OD2-CZ 2.6Å; D132-R134 IonicContact OD2-NE 3.45Å; D132-R134 IonicContact OD2-NH1 3.93Å; D132-R134 PolarHBondContact OD2-NH1 3.2Å; D132-F135 HydrophobicContact CB-CD2 3.67Å; D132-F135 HydrophobicContact CB-CE2 3.92Å; D132-F135 WeakPolarHBondContact O-CB 3.48Å; D132-F135 PolarHBondContact O-N 3.49Å
133	Q	77.9	Confident	77.1	Confident	96 Å²	96	73.6 Å²	73.6	45%	0.449	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-53.5	-24.2	179.4	-172.8	65.1	49.7	0	0	112.7	D121 F135 V136	D121-Q133 WeakPolarHBondContact O-CB 3.25Å; D121-Q133 PolarHBondContact O-N 2.8Å; Q133-F135 PolarHBondContact O-N 3.06Å; Q133-V136 PolarHBondContact O-N 2.78Å
134	R	74	Confident	77.1	Confident	135 Å²	135	73.6 Å²	73.6	51%	0.509	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-67.7	-18.3	175.2	79.4	-164.5	177.7	-147.1	10.1	114.6	D132 V136 H158	D132-R134 HydrophobicContact CB-CG 4Å; D132-R134 PolarHBondContact O-N 2.79Å; D132-R134 WeakPolarHBondContact OD1-CB 3.21Å; D132-R134 WeakPolarHBondContact OD1-CD 3.19Å; D132-R134 WeakPolarHBondContact OD1-CG 3.36Å; D132-R134 PolarHBondContact OD1-N 3.49Å; D132-R134 IonicContact OD2-CZ 2.6Å; D132-R134 IonicContact OD2-NE 3.45Å; D132-R134 IonicContact OD2-NH1 3.93Å; D132-R134 PolarHBondContact OD2-NH1 3.2Å; R134-V136 VanDerWaalsContact C-N 3.33Å; R134-H158 WeakPolarHBondContact CA-NE2 3.14Å; R134-H158 PolarHBondContact O-NE2 2.06Å
135	F	79.8	Confident	77.1	Confident	67 Å²	67	72.9 Å²	72.9	29%	0.294	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-95.2	10.5	178.7	-63.4	-52.9	0	0	0	112.3	I131 D132 Q133 D142	I131-F135 HydrophobicContact CB-CB 4.39Å; I131-F135 HydrophobicContact CD1-CB 3.87Å; I131-F135 HydrophobicContact CG1-CB 4.42Å; D132-F135 HydrophobicContact CB-CD2 3.67Å; D132-F135 HydrophobicContact CB-CE2 3.92Å; D132-F135 WeakPolarHBondContact O-CB 3.48Å; D132-F135 PolarHBondContact O-N 3.49Å; Q133-F135 PolarHBondContact O-N 3.06Å; F135-D142 HydrophobicContact CB-CB 3.94Å; F135-D142 WeakPolarHBondContact CB-OD2 3.37Å; F135-D142 WeakPolarHBondContact CD1-OD2 3.35Å; F135-D142 HydrophobicContact CG-CB 4.49Å
136	V	79	Confident	77	Confident	18 Å²	18	74 Å²	74	11%	0.109	38%	0.375	C	S	.	.	S	Bend	trans	-95.2	126.6	173.2	-174.2	0	0	0	0	108.7	F123 I131 Q133 R134 D148	F123-V136 HydrophobicContact CB-CG2 3.24Å; F123-V136 HydrophobicContact CD1-CG2 3.89Å; F123-V136 HydrophobicContact CD2-CG1 4.36Å; F123-V136 HydrophobicContact CD2-CG2 3.88Å; F123-V136 HydrophobicContact CG-CG2 3.41Å; F123-V136 VanDerWaalsContact CG-CG2 3.41Å; I131-V136 HydrophobicContact CD1-CG2 4.4Å; Q133-V136 PolarHBondContact O-N 2.78Å; R134-V136 VanDerWaalsContact C-N 3.33Å; V136-D148 WeakPolarHBondContact CG1-O 3.46Å
137	C	76.2	Confident	77.3	Confident	45 Å²	45	67.1 Å²	67.1	30%	0.304	35%	0.351	S	S	.	.	S	Bend	trans	64.4	44.2	178.5	-58.4	0	0	0	0	113.7	D148 E149 C152	C137-D148 PolarHBondContact N-O 2.89Å; C137-E149 WeakPolarHBondContact CA-OE1 3.21Å; C137-E149 WeakPolarHBondContact CA-OE2 3.35Å; C137-E149 PolarHBondContact N-OE1 3.34Å; C137-C152 WeakPolarHBondContact CA-SG 3.38Å; C137-C152 HydrophobicContact CB-CB 3.83Å; C137-C152 WeakPolarHBondContact CB-SG 3.04Å; C137-C152 WeakPolarHBondContact SG-CA 2.94Å; C137-C152 WeakPolarHBondContact SG-CB 3.29Å; C137-C152 CovalentContact SG-SG 2.02Å; C137-C152 PolarHBondContact SG-SG 3.4Å
138	N	72.4	Confident	77.5	Confident	47 Å²	47	63.5 Å²	63.5	25%	0.251	33%	0.332	S	S	.	.	S	Bend	trans	-110	15.9	178	69.5	-10.6	0	0	0	112.9	L140 D142 E149	N138-L140 PolarHBondContact O-N 3.15Å; N138-L140 WeakPolarHBondContact OD1-CB 3.22Å; N138-L140 PolarHBondContact OD1-N 2.81Å; N138-L140 VanDerWaalsContact OD1-N 3.08Å; N138-L140 PolarHBondContact OD1-O 2.82Å; N138-D142 PolarHBondContact ND2-OD2 2.8Å; N138-D142 PolarHBondContact OD1-OD2 2.89Å; N138-E149 PolarHBondContact N-OE1 3.16Å; N138-E149 PolarHBondContact N-OE2 2.84Å; N138-E149 PolarHBondContact OD1-OE1 2.86Å
139	D	66.8	Low	78.2	Confident	143 Å²	143	57.4 Å²	57.4	77%	0.765	31%	0.307	S	S	*	.	S	Bend	trans	61.8	18	-176	-65.4	-48.5	0	0	0	114	E149	D139-E149 WeakPolarHBondContact CA-OE2 3.44Å; D139-E149 PolarHBondContact N-OE2 2.52Å
140	L	69	Low	78.1	Confident	104 Å²	104	56.8 Å²	56.8	55%	0.545	31%	0.309	S	S	.	.	S	Bend	trans	-124.4	136.3	175.1	-60.5	174.4	0	0	0	110.1	N138 D142 E149	N138-L140 PolarHBondContact O-N 3.15Å; N138-L140 WeakPolarHBondContact OD1-CB 3.22Å; N138-L140 PolarHBondContact OD1-N 2.81Å; N138-L140 VanDerWaalsContact OD1-N 3.08Å; N138-L140 PolarHBondContact OD1-O 2.82Å; L140-D142 VanDerWaalsContact C-N 3.29Å; L140-D142 PolarHBondContact O-N 3.32Å; L140-E149 WeakPolarHBondContact O-CG 3.36Å
141	D	76.7	Confident	77.7	Confident	90 Å²	90	64.7 Å²	64.7	48%	0.481	33%	0.332	S	S	.	.			trans	-80.5	76.1	174.9	-179.5	17.1	0	0	0	110.1	C143 G144 D145 G146	D141-C143 VanDerWaalsContact C-N 3.35Å; D141-G144 PolarHBondContact O-N 2.88Å; D141-G144 WeakPolarHBondContact OD1-CA 3.05Å; D141-G144 PolarHBondContact OD1-N 3.34Å; D141-G144 WeakPolarHBondContact OD2-CA 3.42Å; D141-D145 PolarHBondContact OD1-N 3.39Å; D141-D145 VanDerWaalsContact OD1-N 3.11Å; D141-G146 WeakPolarHBondContact OD1-CA 3.1Å; D141-G146 PolarHBondContact OD1-N 3.3Å
142	D	80.9	Confident	77.3	Confident	47 Å²	47	66.8 Å²	66.8	25%	0.251	35%	0.347	S	S	.	.	S	Bend	trans	-73.7	-29.4	178.4	-76.6	-56	0	0	0	111.5	R129 I131 F135 N138 L140 G144 D148	R129-D142 PolarHBondContact NH1-O 3.02Å; I131-D142 HydrophobicContact CD1-CB 4.09Å; F135-D142 HydrophobicContact CB-CB 3.94Å; F135-D142 WeakPolarHBondContact CB-OD2 3.37Å; F135-D142 WeakPolarHBondContact CD1-OD2 3.35Å; F135-D142 HydrophobicContact CG-CB 4.49Å; N138-D142 PolarHBondContact ND2-OD2 2.8Å; N138-D142 PolarHBondContact OD1-OD2 2.89Å; L140-D142 VanDerWaalsContact C-N 3.29Å; L140-D142 PolarHBondContact O-N 3.32Å; D142-G144 VanDerWaalsContact C-N 3.35Å; D142-D148 WeakPolarHBondContact CA-OD2 3.23Å; D142-D148 WeakPolarHBondContact CB-OD2 3.39Å; D142-D148 PolarHBondContact N-OD2 3.44Å
143	C	83.1	Confident	76.4	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.007	36%	0.36	C	S	.	.	S	Bend	trans	-66.6	-32.2	171.9	-79	0	0	0	0	112.9	C125 N127 D141 D145 D148	C125-C143 HydrophobicContact CB-CB 3.76Å; C125-C143 WeakPolarHBondContact CB-SG 3.19Å; C125-C143 VanDerWaalsContact SG-CA 3.51Å; C125-C143 WeakPolarHBondContact SG-CB 3.07Å; C125-C143 CovalentContact SG-SG 2.03Å; C125-C143 PolarHBondContact SG-SG 2.76Å; N127-C143 PolarHBondContact ND2-O 3.47Å; D141-C143 VanDerWaalsContact C-N 3.35Å; C143-D145 VanDerWaalsContact CB-OD1 3.25Å; C143-D145 WeakPolarHBondContact CB-OD1 3.18Å; C143-D148 HydrophobicContact CB-CB 4.41Å; C143-D148 PolarHBondContact N-OD2 3Å; C143-D148 VanDerWaalsContact SG-CG 3.6Å
144	G	78.5	Confident	75.1	Confident	56 Å²	56	72.8 Å²	72.8	58%	0.577	39%	0.385	S	S	*	.	S	Bend	trans	76.8	4	-171	0	0	0	0	0	114.3	D141 D142	D141-G144 PolarHBondContact O-N 2.88Å; D141-G144 WeakPolarHBondContact OD1-CA 3.05Å; D141-G144 PolarHBondContact OD1-N 3.34Å; D141-G144 WeakPolarHBondContact OD2-CA 3.42Å; D142-G144 VanDerWaalsContact C-N 3.35Å
145	D	80.8	Confident	73.9	Confident	54 Å²	54	72.2 Å²	72.2	29%	0.289	40%	0.397	S	S	.	.	S	Bend	trans	-129.3	6	175.6	72.4	4.7	0	0	0	113.1	R126 N127 D141 C143 S147	R126-D145 WeakPolarHBondContact CB-OD2 3.26Å; R126-D145 PolarHBondContact N-OD2 3.32Å; N127-D145 VanDerWaalsContact CB-OD2 3.27Å; N127-D145 WeakPolarHBondContact CB-OD2 3.17Å; N127-D145 PolarHBondContact N-OD2 2.89Å; D141-D145 PolarHBondContact OD1-N 3.39Å; D141-D145 VanDerWaalsContact OD1-N 3.11Å; C143-D145 VanDerWaalsContact CB-OD1 3.25Å; C143-D145 WeakPolarHBondContact CB-OD1 3.18Å; D145-S147 VanDerWaalsContact C-N 3.26Å; D145-S147 PolarHBondContact O-N 2.6Å; D145-S147 WeakPolarHBondContact OD1-CB 3.36Å; D145-S147 PolarHBondContact OD1-N 3.1Å; D145-S147 PolarHBondContact OD1-OG 2.01Å; D145-S147 PolarHBondContact OD2-OG 3.29Å
146	G	79.4	Confident	72.4	Confident	26 Å²	26	71.5 Å²	71.5	27%	0.268	41%	0.408	S	S	.	.	S	Bend	trans	68.1	12.1	-179.3	0	0	0	0	0	115.7	D141 E149 E150	D141-G146 WeakPolarHBondContact OD1-CA 3.1Å; D141-G146 PolarHBondContact OD1-N 3.3Å; G146-E149 PolarHBondContact O-N 2.84Å; G146-E150 PolarHBondContact O-N 3Å; G146-E150 VanDerWaalsContact O-N 3.16Å
147	S	84.4	Confident	70.9	Confident	12 Å²	12	81.5 Å²	81.5	8%	0.084	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-27.2	-174.4	-59.9	0	0	0	0	114.5	F123 R126 D145 E149	F123-S147 WeakPolarHBondContact CZ-O 3.26Å; R126-S147 WeakPolarHBondContact CB-OG 3.28Å; R126-S147 PolarHBondContact N-OG 2.94Å; R126-S147 PolarHBondContact NE-OG 2.91Å; D145-S147 VanDerWaalsContact C-N 3.26Å; D145-S147 PolarHBondContact O-N 2.6Å; D145-S147 WeakPolarHBondContact OD1-CB 3.36Å; D145-S147 PolarHBondContact OD1-N 3.1Å; D145-S147 PolarHBondContact OD1-OG 2.01Å; D145-S147 PolarHBondContact OD2-OG 3.29Å; S147-E149 VanDerWaalsContact C-N 3.29Å
148	D	81.9	Confident	70	Confident	2 Å²	2	82.4 Å²	82.4	1%	0.011	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-31.3	171.1	44.7	-9.5	0	0	0	112.8	F123 I131 V136 C137 D142 C143	F123-D148 HydrophobicContact CD1-CB 4.47Å; F123-D148 HydrophobicContact CE1-CB 4.28Å; I131-D148 HydrophobicContact CD1-CB 3.67Å; V136-D148 WeakPolarHBondContact CG1-O 3.46Å; C137-D148 PolarHBondContact N-O 2.89Å; D142-D148 WeakPolarHBondContact CA-OD2 3.23Å; D142-D148 WeakPolarHBondContact CB-OD2 3.39Å; D142-D148 PolarHBondContact N-OD2 3.44Å; C143-D148 HydrophobicContact CB-CB 4.41Å; C143-D148 PolarHBondContact N-OD2 3Å; C143-D148 VanDerWaalsContact SG-CG 3.6Å
149	E	86	Confident	69.4	Low	46 Å²	46	89.5 Å²	89.5	22%	0.215	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-12.4	-177	-59.2	-56.1	123.5	0	0	114.2	C137 N138 D139 L140 G146 S147 R151 C152	C137-E149 WeakPolarHBondContact CA-OE1 3.21Å; C137-E149 WeakPolarHBondContact CA-OE2 3.35Å; C137-E149 PolarHBondContact N-OE1 3.34Å; N138-E149 PolarHBondContact N-OE1 3.16Å; N138-E149 PolarHBondContact N-OE2 2.84Å; N138-E149 PolarHBondContact OD1-OE1 2.86Å; D139-E149 WeakPolarHBondContact CA-OE2 3.44Å; D139-E149 PolarHBondContact N-OE2 2.52Å; L140-E149 WeakPolarHBondContact O-CG 3.36Å; G146-E149 PolarHBondContact O-N 2.84Å; S147-E149 VanDerWaalsContact C-N 3.29Å; E149-R151 PolarHBondContact O-N 3.45Å; E149-C152 PolarHBondContact O-SG 2.8Å
150	E	76.8	Confident	69.6	Low	111 Å²	111	84 Å²	84	52%	0.519	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-26	-171	-161.5	-167.1	-129.6	0	0	114.3	R126 G146	R126-E150 IonicContact CZ-OE1 3.45Å; R126-E150 IonicContact CZ-OE2 3.87Å; R126-E150 IonicContact NH1-OE1 2.84Å; R126-E150 IonicContact NH2-OE1 2.65Å; R126-E150 PolarHBondContact NH2-OE1 2.03Å; R126-E150 IonicContact NH2-OE2 2.9Å; R126-E150 PolarHBondContact NH2-OE2 2.89Å; G146-E150 PolarHBondContact O-N 3Å; G146-E150 VanDerWaalsContact O-N 3.16Å
151	R	70.8	Confident	69.8	Low	211 Å²	211	84.1 Å²	84.1	80%	0.796	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.1	51	-174.1	-74.5	-176.3	-169.7	164	5.9	113.8	E149 P153	E149-R151 PolarHBondContact O-N 3.45Å; R151-P153 VanDerWaalsContact O-CD 3.27Å; R151-P153 WeakPolarHBondContact O-CD 2.97Å
152	C	70.1	Confident	69.5	Low	53 Å²	53	84.3 Å²	84.3	36%	0.358	46%	0.461	S	S	.	.			trans	-79.5	115.1	174	-57.6	0	0	0	0	111.1	C137 E149 L154	C137-C152 WeakPolarHBondContact CA-SG 3.38Å; C137-C152 HydrophobicContact CB-CB 3.83Å; C137-C152 WeakPolarHBondContact CB-SG 3.04Å; C137-C152 WeakPolarHBondContact SG-CA 2.94Å; C137-C152 WeakPolarHBondContact SG-CB 3.29Å; C137-C152 CovalentContact SG-SG 2.02Å; C137-C152 PolarHBondContact SG-SG 3.4Å; E149-C152 PolarHBondContact O-SG 2.8Å; C152-L154 PolarHBondContact O-N 3.33Å
153	P	59.2	Low	68.8	Low	75 Å²	75	88.2 Å²	88.2	49%	0.487	48%	0.482	S	S	.	.			trans	-64.7	137.6	172.2	24.8	-30.4	0	0	0	109.8	R151 T155 G156	R151-P153 VanDerWaalsContact O-CD 3.27Å; R151-P153 WeakPolarHBondContact O-CD 2.97Å; P153-T155 CarbonylContact O-C 3.55Å; P153-T155 PolarHBondContact O-N 3.5Å; P153-G156 PolarHBondContact O-N 2.83Å
154	L	50.9	Low	68.6	Low	186 Å²	186	91.6 Å²	91.6	97%	0.974	50%	0.498	S	S	*	.	S	Bend	trans	-54.5	-11.8	-179.3	-68.2	169.7	0	0	0	114.5	C152	C152-L154 PolarHBondContact O-N 3.33Å
155	T	48.2	Very low	68.7	Low	122 Å²	122	92.5 Å²	92.5	75%	0.748	49%	0.485	S	S	*	.	S	Bend	trans	-116.9	86.8	170.4	51.4	0	0	0	0	108.2	P153	P153-T155 CarbonylContact O-C 3.55Å; P153-T155 PolarHBondContact O-N 3.5Å
156	G	50	Low	68.4	Low	52 Å²	52	95 Å²	95	54%	0.536	49%	0.493	S	S	.	.			trans	-60.8	139.8	-168.9	0	0	0	0	0	115.1	P153 H158	P153-G156 PolarHBondContact O-N 2.83Å; G156-H158 VanDerWaalsContact C-N 3.34Å; G156-H158 PolarHBondContact O-N 2.85Å
157	Y	47	Very low	68.5	Low	228 Å²	228	93.7 Å²	93.7	89%	0.894	48%	0.48	S	S	*	.			trans	-92.2	21.1	-175.8	-132.4	-93.1	0	0	0	114.1
158	H	57.4	Low	68.2	Low	65 Å²	65	100.1 Å²	100.1	30%	0.301	50%	0.503	S	S	.	.			trans	-87.7	112.8	177.5	-132.3	-62.2	0	0	0	110.3	R134 G156 K166	R134-H158 WeakPolarHBondContact CA-NE2 3.14Å; R134-H158 PolarHBondContact O-NE2 2.06Å; G156-H158 VanDerWaalsContact C-N 3.34Å; G156-H158 PolarHBondContact O-N 2.85Å; H158-K166 PolarHBondContact O-NZ 3.41Å
159	K	59.4	Low	67.3	Low	196 Å²	196	107.5 Å²	107.5	85%	0.852	54%	0.535	S	S	*	.			trans	-108.4	107.6	178.7	-159.3	178.2	-173.9	-175.2	0	106.3
160	C	72.2	Confident	66.7	Low	27 Å²	27	106.7 Å²	106.7	18%	0.182	54%	0.54	C	S	.	.			trans	-60.9	157	177.6	-54.3	0	0	0	0	111	E164 K166 C172	C160-E164 HydrophobicContact CB-CB 3.9Å; C160-K166 VanDerWaalsContact SG-CA 3.5Å; C160-K166 WeakPolarHBondContact SG-CB 3.36Å; C160-C172 WeakPolarHBondContact CA-SG 3.42Å; C160-C172 HydrophobicContact CB-CB 3.78Å; C160-C172 WeakPolarHBondContact CB-SG 3.48Å; C160-C172 WeakPolarHBondContact SG-CB 3.41Å; C160-C172 CovalentContact SG-SG 2.03Å; C160-C172 PolarHBondContact SG-SG 2.9Å
161	N	71.5	Confident	66.7	Low	107 Å²	107	105 Å²	105	57%	0.572	54%	0.539	S	S	*	.			trans	-64.9	166.4	172.6	-69.1	-41.9	0	0	0	111.1	D163 E164	N161-D163 PolarHBondContact O-N 3.1Å; N161-D163 VanDerWaalsContact O-N 3.16Å; N161-E164 HydrophobicContact CB-CG 4.25Å; N161-E164 WeakPolarHBondContact CB-OE2 3.37Å; N161-E164 PolarHBondContact N-OE2 3.11Å; N161-E164 PolarHBondContact ND2-OE2 2.8Å; N161-E164 PolarHBondContact O-N 2.05Å; N161-E164 VanDerWaalsContact O-N 3.17Å
162	A	71.9	Confident	67.2	Low	93 Å²	93	96.9 Å²	96.9	77%	0.769	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-21.5	-179.7	0	0	0	0	0	113.7	I175	A162-I175 VanDerWaalsContact O-CD1 3.29Å; A162-I175 WeakPolarHBondContact O-CD1 3.16Å
163	D	66.3	Low	67.5	Low	129 Å²	129	95 Å²	95	69%	0.69	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	8.1	-177	-46.6	-35.8	0	0	0	112.1	N161 I175	N161-D163 PolarHBondContact O-N 3.1Å; N161-D163 VanDerWaalsContact O-N 3.16Å; D163-I175 WeakPolarHBondContact O-CG1 3.13Å; D163-I175 PolarHBondContact O-N 2.78Å
164	E	78.9	Confident	68.3	Low	73 Å²	73	94.5 Å²	94.5	34%	0.341	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.8	-175.5	-68.2	168.9	171.6	0	0	111.9	C160 N161 C172 I173	C160-E164 HydrophobicContact CB-CB 3.9Å; N161-E164 HydrophobicContact CB-CG 4.25Å; N161-E164 WeakPolarHBondContact CB-OE2 3.37Å; N161-E164 PolarHBondContact N-OE2 3.11Å; N161-E164 PolarHBondContact ND2-OE2 2.8Å; N161-E164 PolarHBondContact O-N 2.05Å; N161-E164 VanDerWaalsContact O-N 3.17Å; E164-C172 HydrophobicContact CB-CB 4.14Å; E164-I173 CarbonylContact C-O 3.59Å; E164-I173 WeakPolarHBondContact CA-O 3.18Å
165	Y	79	Confident	69.6	Low	75 Å²	75	90.2 Å²	90.2	29%	0.294	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	132.9	171.2	178.9	-100	0	0	0	111.1	C167 C172 I173 V178 D189 D190	Y165-C167 PolarHBondContact O-N 2.7Å; Y165-C172 CarbonylContact O-C 3.54Å; Y165-C172 VanDerWaalsContact O-CA 3.28Å; Y165-C172 WeakPolarHBondContact O-CA 3.07Å; Y165-I173 HydrophobicContact CD1-CD1 3.99Å; Y165-I173 HydrophobicContact CD1-CG1 3.94Å; Y165-I173 HydrophobicContact CG-CG1 4.45Å; Y165-I173 PolarHBondContact N-O 2.84Å; Y165-I173 PolarHBondContact O-N 3.49Å; Y165-V178 VanDerWaalsContact CB-CG2 3.42Å; Y165-V178 HydrophobicContact CD1-CG2 3.86Å; Y165-V178 HydrophobicContact CD2-CG2 3.7Å; Y165-V178 HydrophobicContact CE2-CG2 4.42Å; Y165-V178 HydrophobicContact CG-CG2 3.37Å; Y165-D189 WeakPolarHBondContact CE1-OD2 3.19Å; Y165-D189 PolarHBondContact OH-OD2 3.43Å; Y165-D189 VanDerWaalsContact OH-OD2 3.1Å; Y165-D190 HydrophobicContact CE1-CB 4.44Å
166	K	75.4	Confident	70.6	Confident	105 Å²	105	92.3 Å²	92.3	46%	0.457	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	108.7	176.6	-174	171.8	178.6	166.5	0	110.3	H158 C160 Y168	H158-K166 PolarHBondContact O-NZ 3.41Å; C160-K166 VanDerWaalsContact SG-CA 3.5Å; C160-K166 WeakPolarHBondContact SG-CB 3.36Å; K166-Y168 PolarHBondContact O-N 2.81Å
167	C	81	Confident	71.8	Confident	0 Å²	0	90 Å²	90	0%	0	45%	0.451	C	S	.	.			trans	-59.8	140.2	170	-63.5	0	0	0	0	110.9	Y165 K169 G170 P171 C185 D189	Y165-C167 PolarHBondContact O-N 2.7Å; C167-K169 PolarHBondContact O-N 3.13Å; C167-G170 PolarHBondContact O-N 3.47Å; C167-G170 VanDerWaalsContact O-N 3.15Å; C167-P171 WeakPolarHBondContact CB-O 3.02Å; C167-P171 PolarHBondContact N-O 3.42Å; C167-P171 VanDerWaalsContact N-O 3.11Å; C167-P171 PolarHBondContact SG-O 2.93Å; C167-C185 VanDerWaalsContact CA-SG 3.53Å; C167-C185 HydrophobicContact CB-CB 3.71Å; C167-C185 WeakPolarHBondContact CB-SG 3.28Å; C167-C185 WeakPolarHBondContact SG-CA 3.32Å; C167-C185 WeakPolarHBondContact SG-CB 3.34Å; C167-C185 CovalentContact SG-SG 2.03Å; C167-C185 PolarHBondContact SG-SG 3.23Å; C167-D189 WeakPolarHBondContact CA-OD2 3.37Å
168	Y	78.3	Confident	73.3	Confident	146 Å²	146	81.4 Å²	81.4	57%	0.573	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	111.8	172.8	178.1	-106.2	0	0	0	109.6	K166 G170 H187 D189	K166-Y168 PolarHBondContact O-N 2.81Å; Y168-G170 VanDerWaalsContact C-N 3.25Å; Y168-G170 PolarHBondContact O-N 2.83Å; Y168-H187 HydrophobicContact CD1-CB 4.29Å; Y168-H187 PolarHBondContact O-CD2 2.88Å; Y168-D189 PolarHBondContact N-OD2 3Å
169	K	63.4	Low	73.9	Confident	157 Å²	157	80.5 Å²	80.5	68%	0.683	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	44.5	-172.2	-64.3	-175	173.8	-175.8	0	113	C167	C167-K169 PolarHBondContact O-N 3.13Å
170	G	72.1	Confident	74	Confident	30 Å²	30	72.8 Å²	72.8	31%	0.309	39%	0.39	S	S	.	.	S	Bend	trans	-147.8	-171.5	178.1	0	0	0	0	0	112.9	C167 Y168	C167-G170 PolarHBondContact O-N 3.47Å; C167-G170 VanDerWaalsContact O-N 3.15Å; Y168-G170 VanDerWaalsContact C-N 3.25Å; Y168-G170 PolarHBondContact O-N 2.83Å
171	P	77.6	Confident	73.6	Confident	76 Å²	76	74.4 Å²	74.4	49%	0.494	41%	0.412	S	S	.	.			trans	-67.1	167.5	178.1	30.4	-35.4	0	0	0	111.9	C167	C167-P171 WeakPolarHBondContact CB-O 3.02Å; C167-P171 PolarHBondContact N-O 3.42Å; C167-P171 VanDerWaalsContact N-O 3.11Å; C167-P171 PolarHBondContact SG-O 2.93Å
172	C	81.2	Confident	73.2	Confident	40 Å²	40	72.2 Å²	72.2	27%	0.27	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.1	163.4	-57.2	0	0	0	0	108.5	C160 E164 Y165	C160-C172 WeakPolarHBondContact CA-SG 3.42Å; C160-C172 HydrophobicContact CB-CB 3.78Å; C160-C172 WeakPolarHBondContact CB-SG 3.48Å; C160-C172 WeakPolarHBondContact SG-CB 3.41Å; C160-C172 CovalentContact SG-SG 2.03Å; C160-C172 PolarHBondContact SG-SG 2.9Å; E164-C172 HydrophobicContact CB-CB 4.14Å; Y165-C172 CarbonylContact O-C 3.54Å; Y165-C172 VanDerWaalsContact O-CA 3.28Å; Y165-C172 WeakPolarHBondContact O-CA 3.07Å
173	I	77.1	Confident	73.5	Confident	14 Å²	14	73.6 Å²	73.6	7%	0.072	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	157.2	174.1	63.4	174.6	0	0	0	109.6	E164 Y165 A177 E184 D190	E164-I173 CarbonylContact C-O 3.59Å; E164-I173 WeakPolarHBondContact CA-O 3.18Å; Y165-I173 HydrophobicContact CD1-CD1 3.99Å; Y165-I173 HydrophobicContact CD1-CG1 3.94Å; Y165-I173 HydrophobicContact CG-CG1 4.45Å; Y165-I173 PolarHBondContact N-O 2.84Å; Y165-I173 PolarHBondContact O-N 3.49Å; I173-A177 HydrophobicContact CB-CB 4.35Å; I173-A177 HydrophobicContact CD1-CB 3.85Å; I173-A177 HydrophobicContact CG1-CB 4.28Å; I173-E184 HydrophobicContact CD1-CB 4.47Å; I173-D190 HydrophobicContact CD1-CB 3.69Å
174	P	75.9	Confident	74	Confident	64 Å²	64	71.6 Å²	71.6	42%	0.416	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	146.3	173.3	-24	35.3	0	0	0	112.1	E176 A177	P174-E176 HydrophobicContact CB-CG 3.64Å; P174-E176 PolarHBondContact O-N 3.35Å; P174-A177 WeakPolarHBondContact O-CB 3.36Å; P174-A177 PolarHBondContact O-N 3.29Å
175	I	76.9	Confident	74.2	Confident	95 Å²	95	68.4 Å²	68.4	49%	0.487	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-58.5	-30.6	177.3	-73.7	171.1	0	0	0	112.4	A162 D163 A177 V178	A162-I175 VanDerWaalsContact O-CD1 3.29Å; A162-I175 WeakPolarHBondContact O-CD1 3.16Å; D163-I175 WeakPolarHBondContact O-CG1 3.13Å; D163-I175 PolarHBondContact O-N 2.78Å; I175-A177 PolarHBondContact O-N 2.78Å; I175-V178 PolarHBondContact O-N 3.23Å; I175-V178 VanDerWaalsContact O-N 3.11Å
176	E	69.4	Low	74	Confident	167 Å²	167	68.8 Å²	68.8	78%	0.78	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-63.7	-13.9	175.3	56.4	179.6	-170	0	0	114.3	P174	P174-E176 HydrophobicContact CB-CG 3.64Å; P174-E176 PolarHBondContact O-N 3.35Å
177	A	76.5	Confident	74.1	Confident	4 Å²	4	68.5 Å²	68.5	3%	0.033	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-89.5	-0.3	175.1	0	0	0	0	0	114	I173 P174 I175 D180 E184	I173-A177 HydrophobicContact CB-CB 4.35Å; I173-A177 HydrophobicContact CD1-CB 3.85Å; I173-A177 HydrophobicContact CG1-CB 4.28Å; P174-A177 WeakPolarHBondContact O-CB 3.36Å; P174-A177 PolarHBondContact O-N 3.29Å; I175-A177 PolarHBondContact O-N 2.78Å; A177-D180 WeakPolarHBondContact CA-OD2 3.44Å; A177-E184 WeakPolarHBondContact CB-OE2 3.29Å
178	V	78.1	Confident	74	Confident	47 Å²	47	72.6 Å²	72.6	29%	0.285	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	127	175.9	-177	0	0	0	0	109.3	Y165 I175 D180	Y165-V178 VanDerWaalsContact CB-CG2 3.42Å; Y165-V178 HydrophobicContact CD1-CG2 3.86Å; Y165-V178 HydrophobicContact CD2-CG2 3.7Å; Y165-V178 HydrophobicContact CE2-CG2 4.42Å; Y165-V178 HydrophobicContact CG-CG2 3.37Å; I175-V178 PolarHBondContact O-N 3.23Å; I175-V178 VanDerWaalsContact O-N 3.11Å; V178-D180 VanDerWaalsContact C-N 3.27Å; V178-D180 PolarHBondContact O-N 3.22Å
179	C	69.2	Low	74.1	Confident	46 Å²	46	66.8 Å²	66.8	31%	0.311	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	35.2	179.3	-65.9	0	0	0	0	114.2	G181 D190 E191 C194	C179-G181 VanDerWaalsContact C-N 3.33Å; C179-D190 PolarHBondContact N-O 3.28Å; C179-E191 WeakPolarHBondContact CA-OE1 3.15Å; C179-E191 PolarHBondContact N-OE1 2.9Å; C179-C194 WeakPolarHBondContact CA-SG 3.16Å; C179-C194 HydrophobicContact CB-CB 3.76Å; C179-C194 WeakPolarHBondContact CB-SG 3.4Å; C179-C194 VanDerWaalsContact SG-CA 3.59Å; C179-C194 WeakPolarHBondContact SG-CB 3.2Å; C179-C194 CovalentContact SG-SG 2.03Å; C179-C194 PolarHBondContact SG-SG 2.93Å
180	D	62.9	Low	74.9	Confident	34 Å²	34	59.3 Å²	59.3	18%	0.182	34%	0.337	C	S	.	.	S	Bend	trans	-92.5	1.3	176.8	74.7	17.1	0	0	0	112.8	A177 V178 I182 E191 R574	A177-D180 WeakPolarHBondContact CA-OD2 3.44Å; V178-D180 VanDerWaalsContact C-N 3.27Å; V178-D180 PolarHBondContact O-N 3.22Å; D180-I182 WeakPolarHBondContact OD1-CB 3.31Å; D180-I182 PolarHBondContact OD1-N 2.77Å; D180-E191 PolarHBondContact N-OE1 2.69Å; D180-R574 IonicContact OD1-NH2 3.55Å; D180-R574 PolarHBondContact OD1-NH2 2.81Å; D180-R574 IonicContact OD2-CZ 3.05Å; D180-R574 VanDerWaalsContact OD2-CZ 3.24Å; D180-R574 IonicContact OD2-NH1 3.44Å; D180-R574 PolarHBondContact OD2-NH1 3.08Å; D180-R574 IonicContact OD2-NH2 3.69Å; D180-R574 PolarHBondContact OD2-NH2 3.13Å
181	G	64.1	Low	75.3	Confident	61 Å²	61	59.9 Å²	59.9	63%	0.629	33%	0.332	S	S	*	.	S	Bend	trans	90.7	3.4	-179.4	0	0	0	0	0	114	C179 E191	C179-G181 VanDerWaalsContact C-N 3.33Å; G181-E191 WeakPolarHBondContact CA-OE2 3.39Å; G181-E191 VanDerWaalsContact N-CD 3.27Å; G181-E191 PolarHBondContact N-OE1 2.78Å; G181-E191 PolarHBondContact N-OE2 2.64Å; G181-E191 VanDerWaalsContact N-OE2 3.11Å
182	I	63	Low	75.2	Confident	60 Å²	60	65.8 Å²	65.8	31%	0.308	34%	0.344	S	S	.	.			trans	-122.6	131.9	-177.6	-54	-166.1	0	0	0	110.7	D180 E184 E191 R574	D180-I182 WeakPolarHBondContact OD1-CB 3.31Å; D180-I182 PolarHBondContact OD1-N 2.77Å; I182-E184 HydrophobicContact CG2-CG 4.06Å; I182-E184 PolarHBondContact O-N 3.05Å; I182-E191 VanDerWaalsContact C-CG 3.45Å; I182-E191 PolarHBondContact N-OE1 3.03Å; I182-E191 VanDerWaalsContact N-OE1 3.15Å; I182-E191 WeakPolarHBondContact O-CG 3.49Å; I182-R574 VanDerWaalsContact CG1-NH2 3.29Å
183	K	77.2	Confident	74.2	Confident	123 Å²	123	69.7 Å²	69.7	54%	0.535	36%	0.363	S	S	.	.			trans	-83.5	92.6	178.6	-61.2	165.5	167.8	-165	0	110.6	E188 E191	K183-E188 HydrophobicContact CB-CB 4.39Å; K183-E188 HydrophobicContact CB-CG 4.21Å; K183-E188 HydrophobicContact CD-CB 4.15Å; K183-E188 VanDerWaalsContact CD-CD 3.42Å; K183-E188 HydrophobicContact CD-CG 3.77Å; K183-E188 WeakPolarHBondContact CD-OE1 3.25Å; K183-E188 WeakPolarHBondContact CE-OE2 3.2Å; K183-E188 HydrophobicContact CG-CB 4.04Å; K183-E188 HydrophobicContact CG-CG 4.08Å; K183-E188 IonicContact NZ-OE1 3.77Å; K183-E188 PolarHBondContact NZ-OE1 2.88Å; K183-E188 IonicContact NZ-OE2 3.35Å; K183-E188 PolarHBondContact NZ-OE2 3.15Å; K183-E191 HydrophobicContact CG-CB 4.27Å; K183-E191 HydrophobicContact CG-CG 4.07Å
184	E	76.9	Confident	73.6	Confident	86 Å²	86	71.7 Å²	71.7	40%	0.402	38%	0.378	S	S	.	.			trans	-95.5	-27.3	176.5	-57.4	-171.2	169.4	0	0	112.1	I173 A177 I182 D190	I173-E184 HydrophobicContact CD1-CB 4.47Å; A177-E184 WeakPolarHBondContact CB-OE2 3.29Å; I182-E184 HydrophobicContact CG2-CG 4.06Å; I182-E184 PolarHBondContact O-N 3.05Å; E184-D190 VanDerWaalsContact CA-OD2 3.29Å; E184-D190 WeakPolarHBondContact CA-OD2 3.32Å; E184-D190 WeakPolarHBondContact CB-OD2 3.43Å; E184-D190 PolarHBondContact N-OD2 2.59Å
185	C	82.1	Confident	72.5	Confident	6 Å²	6	74.4 Å²	74.4	4%	0.041	39%	0.393	C	S	.	.	S	Bend	trans	-75.5	142.8	172	-71.1	0	0	0	0	112.3	C167 H187 E188 D189 D190	C167-C185 VanDerWaalsContact CA-SG 3.53Å; C167-C185 HydrophobicContact CB-CB 3.71Å; C167-C185 WeakPolarHBondContact CB-SG 3.28Å; C167-C185 WeakPolarHBondContact SG-CA 3.32Å; C167-C185 WeakPolarHBondContact SG-CB 3.34Å; C167-C185 CovalentContact SG-SG 2.03Å; C167-C185 PolarHBondContact SG-SG 3.23Å; C185-H187 PolarHBondContact O-N 2.91Å; C185-H187 VanDerWaalsContact O-N 3.08Å; C185-E188 PolarHBondContact O-N 2.79Å; C185-D189 WeakPolarHBondContact CB-OD1 3.19Å; C185-D190 HydrophobicContact CB-CB 4.21Å; C185-D190 WeakPolarHBondContact CB-OD1 3.35Å; C185-D190 PolarHBondContact N-OD1 2.86Å; C185-D190 PolarHBondContact N-OD2 2.65Å
186	P	75.4	Confident	70.7	Confident	84 Å²	84	73.7 Å²	73.7	55%	0.545	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.5	178.9	-22.8	31.8	0	0	0	114.1
187	H	78.7	Confident	69.5	Low	99 Å²	99	69.8 Å²	69.8	46%	0.458	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	11.1	-180	-71	-73.5	0	0	0	112.8	Y168 C185 D189	Y168-H187 HydrophobicContact CD1-CB 4.29Å; Y168-H187 PolarHBondContact O-CD2 2.88Å; C185-H187 PolarHBondContact O-N 2.91Å; C185-H187 VanDerWaalsContact O-N 3.08Å; H187-D189 PolarHBondContact O-N 3.45Å; H187-D189 VanDerWaalsContact O-N 3.14Å
188	E	78.6	Confident	68.4	Low	86 Å²	86	72.9 Å²	72.9	40%	0.402	41%	0.407	S	S	.	.	S	Bend	trans	57.9	23	177.6	-43.8	-177.7	157.1	0	0	113.4	K183 C185 D190 E191 W192	K183-E188 HydrophobicContact CB-CB 4.39Å; K183-E188 HydrophobicContact CB-CG 4.21Å; K183-E188 HydrophobicContact CD-CB 4.15Å; K183-E188 VanDerWaalsContact CD-CD 3.42Å; K183-E188 HydrophobicContact CD-CG 3.77Å; K183-E188 WeakPolarHBondContact CD-OE1 3.25Å; K183-E188 WeakPolarHBondContact CE-OE2 3.2Å; K183-E188 HydrophobicContact CG-CB 4.04Å; K183-E188 HydrophobicContact CG-CG 4.08Å; K183-E188 IonicContact NZ-OE1 3.77Å; K183-E188 PolarHBondContact NZ-OE1 2.88Å; K183-E188 IonicContact NZ-OE2 3.35Å; K183-E188 PolarHBondContact NZ-OE2 3.15Å; C185-E188 PolarHBondContact O-N 2.79Å; E188-D190 VanDerWaalsContact C-OD1 3.25Å; E188-D190 WeakPolarHBondContact CA-OD1 3.31Å; E188-E191 PolarHBondContact O-N 2.8Å; E188-W192 PolarHBondContact O-N 2.81Å
189	D	80.5	Confident	67.5	Low	24 Å²	24	78.9 Å²	78.9	13%	0.128	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-79.5	-20.9	-173.8	56	-71.1	0	0	0	113.7	Y165 C167 Y168 C185 H187 E191 W192	Y165-D189 WeakPolarHBondContact CE1-OD2 3.19Å; Y165-D189 PolarHBondContact OH-OD2 3.43Å; Y165-D189 VanDerWaalsContact OH-OD2 3.1Å; C167-D189 WeakPolarHBondContact CA-OD2 3.37Å; Y168-D189 PolarHBondContact N-OD2 3Å; C185-D189 WeakPolarHBondContact CB-OD1 3.19Å; H187-D189 PolarHBondContact O-N 3.45Å; H187-D189 VanDerWaalsContact O-N 3.14Å; D189-E191 PolarHBondContact O-N 3.35Å; D189-W192 PolarHBondContact O-N 2.71Å
190	D	78.7	Confident	67.5	Low	0 Å²	0	78.1 Å²	78.1	0%	0	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-60.7	-29.8	165.8	53.5	-24.8	0	0	0	113.1	Y165 I173 C179 E184 C185 E188	Y165-D190 HydrophobicContact CE1-CB 4.44Å; I173-D190 HydrophobicContact CD1-CB 3.69Å; C179-D190 PolarHBondContact N-O 3.28Å; E184-D190 VanDerWaalsContact CA-OD2 3.29Å; E184-D190 WeakPolarHBondContact CA-OD2 3.32Å; E184-D190 WeakPolarHBondContact CB-OD2 3.43Å; E184-D190 PolarHBondContact N-OD2 2.59Å; C185-D190 HydrophobicContact CB-CB 4.21Å; C185-D190 WeakPolarHBondContact CB-OD1 3.35Å; C185-D190 PolarHBondContact N-OD1 2.86Å; C185-D190 PolarHBondContact N-OD2 2.65Å; E188-D190 VanDerWaalsContact C-OD1 3.25Å; E188-D190 WeakPolarHBondContact CA-OD1 3.31Å
191	E	82.5	Confident	67.9	Low	42 Å²	42	81.4 Å²	81.4	20%	0.196	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-103.1	4.1	177.2	-67.4	-60.4	140.1	0	0	113.1	C179 D180 G181 I182 K183 E188 D189	C179-E191 WeakPolarHBondContact CA-OE1 3.15Å; C179-E191 PolarHBondContact N-OE1 2.9Å; D180-E191 PolarHBondContact N-OE1 2.69Å; G181-E191 WeakPolarHBondContact CA-OE2 3.39Å; G181-E191 VanDerWaalsContact N-CD 3.27Å; G181-E191 PolarHBondContact N-OE1 2.78Å; G181-E191 PolarHBondContact N-OE2 2.64Å; G181-E191 VanDerWaalsContact N-OE2 3.11Å; I182-E191 VanDerWaalsContact C-CG 3.45Å; I182-E191 PolarHBondContact N-OE1 3.03Å; I182-E191 VanDerWaalsContact N-OE1 3.15Å; I182-E191 WeakPolarHBondContact O-CG 3.49Å; K183-E191 HydrophobicContact CG-CB 4.27Å; K183-E191 HydrophobicContact CG-CG 4.07Å; E188-E191 PolarHBondContact O-N 2.8Å; D189-E191 PolarHBondContact O-N 3.35Å
192	W	73.7	Confident	68.3	Low	199 Å²	199	85 Å²	85	75%	0.754	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	126.1	-175.9	-168	-70.2	0	0	0	111.5	E188 D189	E188-W192 PolarHBondContact O-N 2.81Å; D189-W192 PolarHBondContact O-N 2.71Å
193	N	61.4	Low	68.9	Low	123 Å²	123	84.2 Å²	84.2	66%	0.658	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	39.1	174.5	-162.6	56	0	0	0	114.7	T195	N193-T195 PolarHBondContact O-N 3.14Å
194	C	63.1	Low	69.1	Low	56 Å²	56	80.3 Å²	80.3	38%	0.378	45%	0.446	S	S	.	.			trans	-71.5	67.2	167	-53.5	0	0	0	0	111.2	C179	C179-C194 WeakPolarHBondContact CA-SG 3.16Å; C179-C194 HydrophobicContact CB-CB 3.76Å; C179-C194 WeakPolarHBondContact CB-SG 3.4Å; C179-C194 VanDerWaalsContact SG-CA 3.59Å; C179-C194 WeakPolarHBondContact SG-CB 3.2Å; C179-C194 CovalentContact SG-SG 2.03Å; C179-C194 PolarHBondContact SG-SG 2.93Å
195	T	53	Low	69.4	Low	120 Å²	120	77.1 Å²	77.1	74%	0.736	43%	0.431	S	S	*	.			trans	-108.8	13.4	175.3	48.6	0	0	0	0	113.8	N193	N193-T195 PolarHBondContact O-N 3.14Å
196	A	40.3	Very low	69.3	Low	80 Å²	80	80.1 Å²	80.1	66%	0.661	44%	0.444	S	S	*	.	S	Bend	trans	-151	116.8	176.2	0	0	0	0	0	109.7
197	V	44.5	Very low	69.6	Low	86 Å²	86	76.3 Å²	76.3	52%	0.521	42%	0.42	S	S	.	.			trans	48	100.7	143.7	-173	0	0	0	0	114.3	H199	V197-H199 PolarHBondContact O-N 2.87Å
198	V	53.2	Low	69.6	Low	68 Å²	68	77.4 Å²	77.4	41%	0.412	43%	0.429	S	S	.	.			trans	-48.6	111.5	158.5	176.3	0	0	0	0	106.6	C200	V198-C200 PolarHBondContact O-N 2.87Å
199	H	58	Low	69.3	Low	173 Å²	173	77.4 Å²	77.4	80%	0.801	45%	0.452	S	S	*	.			trans	-69.1	102.5	179	-83.9	-61.1	0	0	0	107.7	V197	V197-H199 PolarHBondContact O-N 2.87Å
200	C	69.7	Low	68.7	Low	31 Å²	31	77.2 Å²	77.2	21%	0.209	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-55	147.5	169	-56.4	0	0	0	0	110.2	V198 E204 C213	V198-C200 PolarHBondContact O-N 2.87Å; C200-E204 HydrophobicContact CB-CB 3.74Å; C200-C213 WeakPolarHBondContact CA-SG 3.37Å; C200-C213 HydrophobicContact CB-CB 3.6Å; C200-C213 WeakPolarHBondContact CB-SG 3.44Å; C200-C213 VanDerWaalsContact SG-CA 3.6Å; C200-C213 WeakPolarHBondContact SG-CB 3.49Å; C200-C213 CovalentContact SG-SG 2.03Å; C200-C213 PolarHBondContact SG-SG 2.96Å
201	L	71.8	Confident	68.3	Low	102 Å²	102	81 Å²	81	53%	0.534	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-60.8	155.3	-179.2	-67	169.2	0	0	0	110.4	G203 E204	L201-G203 PolarHBondContact O-N 2.95Å; L201-G203 VanDerWaalsContact O-N 3.11Å; L201-E204 HydrophobicContact CB-CG 4.36Å; L201-E204 PolarHBondContact N-OE2 3.21Å; L201-E204 WeakPolarHBondContact O-CB 3.45Å; L201-E204 PolarHBondContact O-N 2.58Å
202	P	73.1	Confident	67.9	Low	136 Å²	136	79.2 Å²	79.2	88%	0.883	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	120.9	173.4	-25.3	34.3	0	0	0	111.5
203	G	75.2	Confident	68.2	Low	44 Å²	44	70.6 Å²	70.6	45%	0.454	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	5.8	-173.8	0	0	0	0	0	114.7	L201 E216	L201-G203 PolarHBondContact O-N 2.95Å; L201-G203 VanDerWaalsContact O-N 3.11Å; G203-E216 VanDerWaalsContact O-CB 3.29Å; G203-E216 WeakPolarHBondContact O-CB 3.19Å; G203-E216 PolarHBondContact O-N 3Å
204	E	81.4	Confident	69	Low	42 Å²	42	64.8 Å²	64.8	20%	0.196	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	157	169.8	-64.8	177.2	171.3	0	0	110.7	C200 L201 C213 M214 R533	C200-E204 HydrophobicContact CB-CB 3.74Å; L201-E204 HydrophobicContact CB-CG 4.36Å; L201-E204 PolarHBondContact N-OE2 3.21Å; L201-E204 WeakPolarHBondContact O-CB 3.45Å; L201-E204 PolarHBondContact O-N 2.58Å; E204-C213 HydrophobicContact CB-CB 4.42Å; E204-M214 CarbonylContact C-O 3.53Å; E204-M214 WeakPolarHBondContact CA-O 3.37Å; E204-M214 WeakPolarHBondContact CB-O 3.3Å; E204-R533 IonicContact OE1-CZ 3.21Å; E204-R533 IonicContact OE1-NH2 3.98Å; E204-R533 PolarHBondContact OE1-NH2 3.18Å
205	F	82.5	Confident	69.9	Low	19 Å²	19	63.2 Å²	63.2	8%	0.083	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.2	172.8	75.8	-81.3	0	0	0	110.6	C213 M214 P215 W218 K219 D231	F205-C213 CarbonylContact O-C 3.52Å; F205-C213 WeakPolarHBondContact O-CA 3.46Å; F205-M214 HydrophobicContact CD1-CB 4.09Å; F205-M214 VanDerWaalsContact CD1-O 3.23Å; F205-M214 WeakPolarHBondContact CD1-O 3.46Å; F205-M214 HydrophobicContact CE1-CB 3.55Å; F205-M214 HydrophobicContact CE2-CB 4.46Å; F205-M214 HydrophobicContact CZ-CB 3.75Å; F205-M214 HydrophobicContact CZ-CG 4.44Å; F205-M214 PolarHBondContact N-O 3.36Å; F205-M214 PolarHBondContact O-N 2.82Å; F205-P215 VanDerWaalsContact CE1-O 3.25Å; F205-P215 WeakPolarHBondContact CE1-O 3.2Å; F205-W218 HydrophobicContact CE1-CB 4.41Å; F205-K219 HydrophobicContact CD1-CD 4.2Å; F205-K219 HydrophobicContact CD1-CG 3.65Å; F205-K219 HydrophobicContact CD2-CD 4.46Å; F205-K219 VanDerWaalsContact CD2-CE 3.42Å; F205-K219 HydrophobicContact CD2-CG 4.2Å; F205-K219 HydrophobicContact CE1-CD 4.49Å; F205-K219 HydrophobicContact CE1-CG 3.48Å; F205-K219 VanDerWaalsContact CE1-CG 3.48Å; F205-K219 HydrophobicContact CE2-CG 4.07Å; F205-K219 HydrophobicContact CG-CD 4.18Å; F205-K219 HydrophobicContact CG-CG 4.01Å; F205-K219 HydrophobicContact CZ-CG 3.72Å; F205-D231 HydrophobicContact CE2-CB 3.88Å; F205-D231 HydrophobicContact CZ-CB 3.54Å
206	Q	79.9	Confident	71.2	Confident	68 Å²	68	63 Å²	63	32%	0.318	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	129.3	176.4	-163.4	176.5	5.9	0	0	109.8	S210 V212	Q206-S210 VanDerWaalsContact CG-O 3.26Å; Q206-S210 WeakPolarHBondContact CG-O 3.47Å; Q206-S210 PolarHBondContact NE2-O 2.66Å; Q206-V212 WeakPolarHBondContact CA-O 2.99Å
207	C	81.7	Confident	72.7	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.034	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-60.1	147.4	168.6	-68.8	0	0	0	0	109.9	G209 S210 V212 C226	C207-G209 PolarHBondContact O-N 2.83Å; C207-S210 WeakPolarHBondContact CB-OG 3.26Å; C207-S210 PolarHBondContact O-N 2.99Å; C207-V212 PolarHBondContact N-O 2.84Å; C207-C226 HydrophobicContact CB-CB 3.77Å; C207-C226 WeakPolarHBondContact CB-SG 3.48Å; C207-C226 VanDerWaalsContact SG-CA 3.57Å; C207-C226 WeakPolarHBondContact SG-CB 3.49Å; C207-C226 CovalentContact SG-SG 2.04Å; C207-C226 PolarHBondContact SG-SG 2.78Å
208	N	79.5	Confident	74.4	Confident	122 Å²	122	60.6 Å²	60.6	65%	0.652	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	131.6	-175.1	-168	20	0	0	0	111.1	S210 D228 S230	N208-S210 PolarHBondContact O-N 3.46Å; N208-D228 WeakPolarHBondContact CB-OD2 2.93Å; N208-S230 PolarHBondContact N-OG 2.81Å
209	G	71.1	Confident	75.6	Confident	85 Å²	85	61.8 Å²	61.8	88%	0.876	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	3.8	179.1	0	0	0	0	0	116.5	C207	C207-G209 PolarHBondContact O-N 2.83Å
210	S	69.2	Low	76.4	Confident	21 Å²	21	55.3 Å²	55.3	15%	0.147	34%	0.341	C	S	.	.	S	Bend	trans	-119.2	162.8	175.8	84.1	0	0	0	0	111.8	Q206 C207 N208 V212	Q206-S210 VanDerWaalsContact CG-O 3.26Å; Q206-S210 WeakPolarHBondContact CG-O 3.47Å; Q206-S210 PolarHBondContact NE2-O 2.66Å; C207-S210 WeakPolarHBondContact CB-OG 3.26Å; C207-S210 PolarHBondContact O-N 2.99Å; N208-S210 PolarHBondContact O-N 3.46Å; S210-V212 PolarHBondContact OG-N 3.46Å
211	S	69.9	Low	76.4	Confident	79 Å²	79	56.7 Å²	56.7	55%	0.552	35%	0.346	S	S	*	.	S	Bend	trans	-86.7	12.8	170.3	59.3	0	0	0	0	113
212	V	73.5	Confident	76.2	Confident	5 Å²	5	54.8 Å²	54.8	3%	0.03	35%	0.351	C	S	.	.			trans	-91.8	125.6	-173.4	179.7	0	0	0	0	110.4	Q206 C207 S210 M214 Y534 S552	Q206-V212 WeakPolarHBondContact CA-O 2.99Å; C207-V212 PolarHBondContact N-O 2.84Å; S210-V212 PolarHBondContact OG-N 3.46Å; V212-M214 HydrophobicContact CG1-CE 4.26Å; V212-M214 HydrophobicContact CG1-SD 4.32Å; V212-Y534 WeakPolarHBondContact CG1-O 3.47Å; V212-S552 WeakPolarHBondContact CG2-O 3.25Å
213	C	79.7	Confident	75.9	Confident	17 Å²	17	51.1 Å²	51.1	12%	0.115	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.7	177.4	-64.8	0	0	0	0	110.7	C200 E204 F205	C200-C213 WeakPolarHBondContact CA-SG 3.37Å; C200-C213 HydrophobicContact CB-CB 3.6Å; C200-C213 WeakPolarHBondContact CB-SG 3.44Å; C200-C213 VanDerWaalsContact SG-CA 3.6Å; C200-C213 WeakPolarHBondContact SG-CB 3.49Å; C200-C213 CovalentContact SG-SG 2.03Å; C200-C213 PolarHBondContact SG-SG 2.96Å; E204-C213 HydrophobicContact CB-CB 4.42Å; F205-C213 CarbonylContact O-C 3.52Å; F205-C213 WeakPolarHBondContact O-CA 3.46Å
214	M	79	Confident	75.9	Confident	2 Å²	2	50 Å²	50	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	150.5	179.8	-65.1	-64.5	-151.9	0	0	110.6	E204 F205 V212 W218 D225 Y534 L536	E204-M214 CarbonylContact C-O 3.53Å; E204-M214 WeakPolarHBondContact CA-O 3.37Å; E204-M214 WeakPolarHBondContact CB-O 3.3Å; F205-M214 HydrophobicContact CD1-CB 4.09Å; F205-M214 VanDerWaalsContact CD1-O 3.23Å; F205-M214 WeakPolarHBondContact CD1-O 3.46Å; F205-M214 HydrophobicContact CE1-CB 3.55Å; F205-M214 HydrophobicContact CE2-CB 4.46Å; F205-M214 HydrophobicContact CZ-CB 3.75Å; F205-M214 HydrophobicContact CZ-CG 4.44Å; F205-M214 PolarHBondContact N-O 3.36Å; F205-M214 PolarHBondContact O-N 2.82Å; V212-M214 HydrophobicContact CG1-CE 4.26Å; V212-M214 HydrophobicContact CG1-SD 4.32Å; M214-W218 HydrophobicContact CB-CE3 4.34Å; M214-W218 HydrophobicContact CE-CZ3 4.3Å; M214-W218 HydrophobicContact SD-CE3 3.84Å; M214-W218 HydrophobicContact SD-CZ3 3.58Å; M214-W218 VanDerWaalsContact SD-CZ3 3.58Å; M214-D225 HydrophobicContact CE-CB 4.22Å; M214-D225 WeakPolarHBondContact CE-O 3.39Å; M214-Y534 HydrophobicContact SD-CD1 4.49Å; M214-L536 HydrophobicContact CE-CD2 3.11Å; M214-L536 HydrophobicContact SD-CD2 3.99Å
215	P	81.2	Confident	75.7	Confident	22 Å²	22	48.1 Å²	48.1	14%	0.143	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	137.4	174.7	-24.6	35.5	0	0	0	112.8	F205 S217 W218 Y534	F205-P215 VanDerWaalsContact CE1-O 3.25Å; F205-P215 WeakPolarHBondContact CE1-O 3.2Å; P215-S217 PolarHBondContact O-N 2.94Å; P215-W218 HydrophobicContact CB-CD2 4.45Å; P215-W218 HydrophobicContact CB-CG 4.34Å; P215-W218 HydrophobicContact CG-CD2 4.15Å; P215-W218 HydrophobicContact CG-CH2 4.42Å; P215-W218 HydrophobicContact CG-CZ2 3.84Å; P215-W218 WeakPolarHBondContact O-CB 3.48Å; P215-W218 PolarHBondContact O-N 3Å; P215-Y534 HydrophobicContact CG-CE1 4.02Å
216	E	79.9	Confident	75.6	Confident	116 Å²	116	47.3 Å²	47.3	54%	0.542	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-58.9	-25.3	179.2	-173.4	169.2	-152.2	0	0	113.2	G203 W218 K219	G203-E216 VanDerWaalsContact O-CB 3.29Å; G203-E216 WeakPolarHBondContact O-CB 3.19Å; G203-E216 PolarHBondContact O-N 3Å; E216-W218 PolarHBondContact O-N 3.19Å; E216-W218 VanDerWaalsContact O-N 3.17Å; E216-K219 PolarHBondContact O-N 3.34Å
217	S	73.8	Confident	75.4	Confident	89 Å²	89	47.2 Å²	47.2	62%	0.622	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-61.9	-16.7	173	54.4	0	0	0	0	114.8	P215	P215-S217 PolarHBondContact O-N 2.94Å
218	W	80	Confident	75.2	Confident	26 Å²	26	50.9 Å²	50.9	10%	0.098	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-93	-8	-179.2	-66.5	6.5	0	0	0	112.8	F205 M214 P215 E216 C220 D225 K511 Y534	F205-W218 HydrophobicContact CE1-CB 4.41Å; M214-W218 HydrophobicContact CB-CE3 4.34Å; M214-W218 HydrophobicContact CE-CZ3 4.3Å; M214-W218 HydrophobicContact SD-CE3 3.84Å; M214-W218 HydrophobicContact SD-CZ3 3.58Å; M214-W218 VanDerWaalsContact SD-CZ3 3.58Å; P215-W218 HydrophobicContact CB-CD2 4.45Å; P215-W218 HydrophobicContact CB-CG 4.34Å; P215-W218 HydrophobicContact CG-CD2 4.15Å; P215-W218 HydrophobicContact CG-CH2 4.42Å; P215-W218 HydrophobicContact CG-CZ2 3.84Å; P215-W218 WeakPolarHBondContact O-CB 3.48Å; P215-W218 PolarHBondContact O-N 3Å; E216-W218 PolarHBondContact O-N 3.19Å; E216-W218 VanDerWaalsContact O-N 3.17Å; W218-C220 PolarHBondContact O-N 3.08Å; W218-D225 VanDerWaalsContact CB-OD2 3.24Å; W218-D225 WeakPolarHBondContact CB-OD2 3.38Å; W218-D225 HydrophobicContact CE3-CB 3.84Å; W218-D225 HydrophobicContact CZ3-CB 4.45Å; W218-K511 HydrophobicContact CD2-CD 3.8Å; W218-K511 HydrophobicContact CD2-CG 4.06Å; W218-K511 HydrophobicContact CE3-CD 4.04Å; W218-K511 HydrophobicContact CE3-CG 4.49Å; W218-K511 HydrophobicContact CG-CD 4.3Å; W218-K511 HydrophobicContact CH2-CB 3.45Å; W218-K511 VanDerWaalsContact CH2-CB 3.45Å; W218-K511 HydrophobicContact CH2-CD 4.38Å; W218-K511 HydrophobicContact CH2-CG 4.05Å; W218-K511 HydrophobicContact CZ2-CB 3.38Å; W218-K511 HydrophobicContact CZ2-CD 4.2Å; W218-K511 HydrophobicContact CZ2-CG 3.59Å; W218-K511 HydrophobicContact CZ3-CB 4.05Å; W218-K511 HydrophobicContact CZ3-CD 4.29Å; W218-K511 HydrophobicContact CZ3-CG 4.45Å; W218-Y534 HydrophobicContact CH2-CD1 4.24Å; W218-Y534 AromaticContact CH2-CD2 3.87Å; W218-Y534 HydrophobicContact CH2-CD2 3.87Å; W218-Y534 AromaticContact CH2-CE1 3.89Å; W218-Y534 HydrophobicContact CH2-CE1 3.89Å; W218-Y534 AromaticContact CH2-CE2 3.47Å; W218-Y534 HydrophobicContact CH2-CE2 3.47Å; W218-Y534 VanDerWaalsContact CH2-CE2 3.47Å; W218-Y534 HydrophobicContact CH2-CG 4.23Å; W218-Y534 AromaticContact CH2-CZ 3.47Å; W218-Y534 VanDerWaalsContact CH2-CZ 3.47Å; W218-Y534 HydrophobicContact CZ2-CE1 4.33Å; W218-Y534 HydrophobicContact CZ2-CE2 4.02Å; W218-Y534 AromaticContact CZ2-CZ 3.73Å
219	K	77.8	Confident	75.2	Confident	94 Å²	94	49.3 Å²	49.3	41%	0.409	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	129.3	165.9	-67.6	-172.4	-179.3	175.2	0	109	F205 E216 D221	F205-K219 HydrophobicContact CD1-CD 4.2Å; F205-K219 HydrophobicContact CD1-CG 3.65Å; F205-K219 HydrophobicContact CD2-CD 4.46Å; F205-K219 VanDerWaalsContact CD2-CE 3.42Å; F205-K219 HydrophobicContact CD2-CG 4.2Å; F205-K219 HydrophobicContact CE1-CD 4.49Å; F205-K219 HydrophobicContact CE1-CG 3.48Å; F205-K219 VanDerWaalsContact CE1-CG 3.48Å; F205-K219 HydrophobicContact CE2-CG 4.07Å; F205-K219 HydrophobicContact CG-CD 4.18Å; F205-K219 HydrophobicContact CG-CG 4.01Å; F205-K219 HydrophobicContact CZ-CG 3.72Å; E216-K219 PolarHBondContact O-N 3.34Å; K219-D221 VanDerWaalsContact C-N 3.25Å; K219-D221 PolarHBondContact O-N 3.37Å
220	C	75.5	Confident	75.7	Confident	37 Å²	37	46.7 Å²	46.7	25%	0.25	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	32.6	167.5	-52.8	0	0	0	0	114.7	W218 G222 D231 E232 C235	W218-C220 PolarHBondContact O-N 3.08Å; C220-G222 VanDerWaalsContact C-N 3.31Å; C220-D231 PolarHBondContact N-O 3.32Å; C220-E232 VanDerWaalsContact CA-OE1 3.22Å; C220-E232 WeakPolarHBondContact CA-OE1 3.47Å; C220-E232 PolarHBondContact N-OE1 3.1Å; C220-C235 WeakPolarHBondContact CA-SG 3.03Å; C220-C235 HydrophobicContact CB-CB 3.58Å; C220-C235 WeakPolarHBondContact CB-SG 2.97Å; C220-C235 WeakPolarHBondContact SG-CA 3.39Å; C220-C235 WeakPolarHBondContact SG-CB 3.21Å; C220-C235 CovalentContact SG-SG 2.02Å; C220-C235 PolarHBondContact SG-SG 2.76Å
221	D	68.8	Low	76.1	Confident	60 Å²	60	45.9 Å²	45.9	32%	0.321	28%	0.275	S	S	.	.	S	Bend	trans	-89.5	-4.2	175.1	78.7	10.4	0	0	0	112.8	K219 V223 E232 K511	K219-D221 VanDerWaalsContact C-N 3.25Å; K219-D221 PolarHBondContact O-N 3.37Å; D221-V223 WeakPolarHBondContact OD1-CB 3.17Å; D221-V223 PolarHBondContact OD1-N 2.88Å; D221-E232 PolarHBondContact N-OE1 2.99Å; D221-K511 IonicContact OD1-NZ 3.75Å; D221-K511 PolarHBondContact OD1-NZ 3.15Å; D221-K511 WeakPolarHBondContact OD2-CE 3.01Å; D221-K511 IonicContact OD2-NZ 2.7Å; D221-K511 PolarHBondContact OD2-NZ 3.02Å
222	G	67.9	Low	76.6	Confident	61 Å²	61	44.7 Å²	44.7	63%	0.629	26%	0.261	S	S	*	.	S	Bend	trans	93	6.4	176.8	0	0	0	0	0	113.7	C220 E232	C220-G222 VanDerWaalsContact C-N 3.31Å; G222-E232 WeakPolarHBondContact CA-OE2 3.02Å; G222-E232 VanDerWaalsContact N-CD 3.33Å; G222-E232 PolarHBondContact N-OE1 3.15Å; G222-E232 PolarHBondContact N-OE2 2.96Å
223	V	66.8	Low	76.7	Confident	59 Å²	59	53.3 Å²	53.3	36%	0.358	30%	0.298	S	S	.	.	S	Bend	trans	-121.7	126.8	177.2	-178.7	0	0	0	0	108.3	D221 D225 D231 E232	D221-V223 WeakPolarHBondContact OD1-CB 3.17Å; D221-V223 PolarHBondContact OD1-N 2.88Å; V223-D225 PolarHBondContact O-N 2.94Å; V223-D231 VanDerWaalsContact O-OD2 3.1Å; V223-E232 PolarHBondContact N-OE1 3.35Å
224	G	75.3	Confident	76.5	Confident	21 Å²	21	59.5 Å²	59.5	22%	0.216	33%	0.33	C	S	.	.			trans	-72.8	95.3	173.8	0	0	0	0	0	111.2	N229	G224-N229 WeakPolarHBondContact CA-OD1 3.08Å
225	D	76.9	Confident	76.1	Confident	3 Å²	3	61 Å²	61	2%	0.016	34%	0.34	C	S	.	.			trans	-88.5	-23.8	176.2	-59.1	-42.9	0	0	0	112	M214 W218 V223 D231 K511 V549	M214-D225 HydrophobicContact CE-CB 4.22Å; M214-D225 WeakPolarHBondContact CE-O 3.39Å; W218-D225 VanDerWaalsContact CB-OD2 3.24Å; W218-D225 WeakPolarHBondContact CB-OD2 3.38Å; W218-D225 HydrophobicContact CE3-CB 3.84Å; W218-D225 HydrophobicContact CZ3-CB 4.45Å; V223-D225 PolarHBondContact O-N 2.94Å; D225-D231 WeakPolarHBondContact CA-OD2 3.48Å; D225-D231 WeakPolarHBondContact CB-OD2 3.35Å; D225-D231 PolarHBondContact N-OD2 2.89Å; D225-K511 VanDerWaalsContact OD1-CD 3.28Å; D225-K511 WeakPolarHBondContact OD1-CD 3.18Å; D225-K511 IonicContact OD1-NZ 3.5Å; D225-K511 PolarHBondContact OD1-NZ 3.25Å; D225-K511 WeakPolarHBondContact OD2-CE 3.23Å; D225-K511 IonicContact OD2-NZ 4Å; D225-K511 PolarHBondContact OD2-NZ 3.08Å; D225-V549 WeakPolarHBondContact O-CG2 3.03Å
226	C	81	Confident	75.4	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.007	37%	0.37	C	S	.	.	S	Bend	trans	-78.3	143.8	167.9	-66.3	0	0	0	0	110.1	C207 D228 N229 S230 D231	C207-C226 HydrophobicContact CB-CB 3.77Å; C207-C226 WeakPolarHBondContact CB-SG 3.48Å; C207-C226 VanDerWaalsContact SG-CA 3.57Å; C207-C226 WeakPolarHBondContact SG-CB 3.49Å; C207-C226 CovalentContact SG-SG 2.04Å; C207-C226 PolarHBondContact SG-SG 2.78Å; C226-D228 VanDerWaalsContact CB-OD1 3.25Å; C226-D228 WeakPolarHBondContact CB-OD1 3.34Å; C226-D228 PolarHBondContact O-N 3.23Å; C226-D228 VanDerWaalsContact O-N 3.08Å; C226-N229 PolarHBondContact O-N 3.42Å; C226-N229 PolarHBondContact O-OD1 2.02Å; C226-S230 WeakPolarHBondContact CB-OG 3.46Å; C226-S230 PolarHBondContact SG-OG 3.16Å; C226-D231 HydrophobicContact CB-CB 4.44Å; C226-D231 VanDerWaalsContact CB-OD1 3.32Å; C226-D231 WeakPolarHBondContact CB-OD1 3.48Å; C226-D231 PolarHBondContact N-OD1 3.04Å; C226-D231 VanDerWaalsContact N-OD1 3.14Å; C226-D231 PolarHBondContact N-OD2 3.5Å
227	Q	74.2	Confident	74.1	Confident	67 Å²	67	63.5 Å²	63.5	31%	0.313	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-30.1	174.9	-178.3	65	28.4	0	0	113.2	V549 L550 F551 S552	Q227-V549 PolarHBondContact OE1-O 3.4Å; Q227-L550 VanDerWaalsContact CD-O 3.25Å; Q227-L550 PolarHBondContact NE2-O 3.08Å; Q227-L550 PolarHBondContact OE1-O 2.9Å; Q227-F551 VanDerWaalsContact OE1-CA 3.29Å; Q227-S552 WeakPolarHBondContact CB-OG 3.38Å
228	D	77.6	Confident	72.6	Confident	81 Å²	81	68.8 Å²	68.8	43%	0.433	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	6.4	178.8	72.4	-25	0	0	0	113.4	N208 C226 S230	N208-D228 WeakPolarHBondContact CB-OD2 2.93Å; C226-D228 VanDerWaalsContact CB-OD1 3.25Å; C226-D228 WeakPolarHBondContact CB-OD1 3.34Å; C226-D228 PolarHBondContact O-N 3.23Å; C226-D228 VanDerWaalsContact O-N 3.08Å; D228-S230 PolarHBondContact O-N 3.49Å; D228-S230 WeakPolarHBondContact OD1-CB 3.38Å; D228-S230 PolarHBondContact OD1-N 3.44Å; D228-S230 PolarHBondContact OD1-OG 2.91Å; D228-S230 VanDerWaalsContact OD2-CB 3.31Å; D228-S230 WeakPolarHBondContact OD2-CB 3.46Å; D228-S230 PolarHBondContact OD2-OG 3.43Å
229	N	80.1	Confident	70.9	Confident	90 Å²	90	72.9 Å²	72.9	48%	0.481	40%	0.397	S	S	.	.			trans	53	27.2	-172	-63.3	-11.2	0	0	0	114.1	G224 C226 D231 E232 F233	G224-N229 WeakPolarHBondContact CA-OD1 3.08Å; C226-N229 PolarHBondContact O-N 3.42Å; C226-N229 PolarHBondContact O-OD1 2.02Å; N229-D231 WeakPolarHBondContact CA-OD1 3.33Å; N229-D231 PolarHBondContact O-N 3.29Å; N229-E232 PolarHBondContact O-N 3.49Å; N229-E232 VanDerWaalsContact O-N 3.11Å; N229-F233 PolarHBondContact O-N 3.09Å
230	S	81.8	Confident	69.4	Low	29 Å²	29	72.7 Å²	72.7	20%	0.203	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-63.8	-24.5	-179.9	48.4	0	0	0	0	114	N208 C226 D228 E232 F233	N208-S230 PolarHBondContact N-OG 2.81Å; C226-S230 WeakPolarHBondContact CB-OG 3.46Å; C226-S230 PolarHBondContact SG-OG 3.16Å; D228-S230 PolarHBondContact O-N 3.49Å; D228-S230 WeakPolarHBondContact OD1-CB 3.38Å; D228-S230 PolarHBondContact OD1-N 3.44Å; D228-S230 PolarHBondContact OD1-OG 2.91Å; D228-S230 VanDerWaalsContact OD2-CB 3.31Å; D228-S230 WeakPolarHBondContact OD2-CB 3.46Å; D228-S230 PolarHBondContact OD2-OG 3.43Å; S230-E232 PolarHBondContact O-N 2.98Å; S230-F233 PolarHBondContact O-N 2.92Å
231	D	76.6	Confident	67.6	Low	5 Å²	5	74.8 Å²	74.8	3%	0.027	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-65.1	-22.4	173.3	57.6	-43.1	0	0	0	114	F205 C220 V223 D225 C226 N229	F205-D231 HydrophobicContact CE2-CB 3.88Å; F205-D231 HydrophobicContact CZ-CB 3.54Å; C220-D231 PolarHBondContact N-O 3.32Å; V223-D231 VanDerWaalsContact O-OD2 3.1Å; D225-D231 WeakPolarHBondContact CA-OD2 3.48Å; D225-D231 WeakPolarHBondContact CB-OD2 3.35Å; D225-D231 PolarHBondContact N-OD2 2.89Å; C226-D231 HydrophobicContact CB-CB 4.44Å; C226-D231 VanDerWaalsContact CB-OD1 3.32Å; C226-D231 WeakPolarHBondContact CB-OD1 3.48Å; C226-D231 PolarHBondContact N-OD1 3.04Å; C226-D231 VanDerWaalsContact N-OD1 3.14Å; C226-D231 PolarHBondContact N-OD2 3.5Å; N229-D231 WeakPolarHBondContact CA-OD1 3.33Å; N229-D231 PolarHBondContact O-N 3.29Å
232	E	81.2	Confident	66.4	Low	53 Å²	53	79.7 Å²	79.7	25%	0.248	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-107.1	-0.9	-180	-67	-62.2	146	0	0	113.4	C220 D221 G222 V223 N229 S230	C220-E232 VanDerWaalsContact CA-OE1 3.22Å; C220-E232 WeakPolarHBondContact CA-OE1 3.47Å; C220-E232 PolarHBondContact N-OE1 3.1Å; D221-E232 PolarHBondContact N-OE1 2.99Å; G222-E232 WeakPolarHBondContact CA-OE2 3.02Å; G222-E232 VanDerWaalsContact N-CD 3.33Å; G222-E232 PolarHBondContact N-OE1 3.15Å; G222-E232 PolarHBondContact N-OE2 2.96Å; V223-E232 PolarHBondContact N-OE1 3.35Å; N229-E232 PolarHBondContact O-N 3.49Å; N229-E232 VanDerWaalsContact O-N 3.11Å; S230-E232 PolarHBondContact O-N 2.98Å
233	F	75.8	Confident	65.3	Low	186 Å²	186	85.4 Å²	85.4	82%	0.816	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-40.6	-172.5	-171.3	-96	0	0	0	114.1	N229 S230	N229-F233 PolarHBondContact O-N 3.09Å; S230-F233 PolarHBondContact O-N 2.92Å
234	D	74.4	Confident	64.7	Low	148 Å²	148	87.1 Å²	87.1	79%	0.791	45%	0.453	S	S	*	.	S	Bend	trans	-111.1	53.5	-176.9	-168.4	30.6	0	0	0	112.2
235	C	72.3	Confident	63.9	Low	32 Å²	32	86.8 Å²	86.8	22%	0.216	45%	0.447	C	S	.	.			trans	-87.2	135.5	-178	-64.5	0	0	0	0	112.8	C220 S237	C220-C235 WeakPolarHBondContact CA-SG 3.03Å; C220-C235 HydrophobicContact CB-CB 3.58Å; C220-C235 WeakPolarHBondContact CB-SG 2.97Å; C220-C235 WeakPolarHBondContact SG-CA 3.39Å; C220-C235 WeakPolarHBondContact SG-CB 3.21Å; C220-C235 CovalentContact SG-SG 2.02Å; C220-C235 PolarHBondContact SG-SG 2.76Å; C235-S237 PolarHBondContact O-N 2.04Å; C235-S237 PolarHBondContact O-OG 3.13Å
236	P	65.9	Low	63.2	Low	120 Å²	120	88.5 Å²	88.5	78%	0.779	47%	0.465	S	S	*	.			trans	-56.3	102.8	167.7	-17.2	28.2	0	0	0	107.8	R238	P236-R238 PolarHBondContact O-N 3.03Å; P236-R238 VanDerWaalsContact O-N 3.07Å
237	S	52.2	Low	62	Low	72 Å²	72	92.8 Å²	92.8	50%	0.503	50%	0.501	S	S	.	.			trans	-63.1	119.5	-163.6	-32.5	0	0	0	0	109.5	C235 I239 S240	C235-S237 PolarHBondContact O-N 2.04Å; C235-S237 PolarHBondContact O-OG 3.13Å; S237-I239 PolarHBondContact O-N 2.71Å; S237-S240 WeakPolarHBondContact O-CB 3.34Å; S237-S240 PolarHBondContact O-N 3.24Å
238	R	43.6	Very low	61.3	Low	200 Å²	200	95.8 Å²	95.8	76%	0.755	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-22.8	161	-85.3	-176.7	168.5	115.7	-3.7	111.6	P236 S240 I241 Y242	P236-R238 PolarHBondContact O-N 3.03Å; P236-R238 VanDerWaalsContact O-N 3.07Å; R238-S240 PolarHBondContact O-N 3.16Å; R238-I241 PolarHBondContact O-N 2.91Å; R238-Y242 WeakPolarHBondContact O-CD2 3.27Å
239	I	43.4	Very low	60.8	Low	112 Å²	112	96.6 Å²	96.6	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-66.2	-19.6	173.4	-63.4	167.9	0	0	0	112.9	S237 I241 Y242 K243	S237-I239 PolarHBondContact O-N 2.71Å; I239-I241 VanDerWaalsContact C-N 3.28Å; I239-I241 PolarHBondContact O-N 2.74Å; I239-Y242 PolarHBondContact O-N 2.04Å; I239-K243 HydrophobicContact CG2-CD 4.25Å; I239-K243 HydrophobicContact CG2-CG 4.4Å; I239-K243 PolarHBondContact O-N 2.85Å; I239-K243 VanDerWaalsContact O-N 3.07Å
240	S	45.2	Very low	60.5	Low	90 Å²	90	94.6 Å²	94.6	63%	0.629	51%	0.509	S	S	*	.	H	α-helix	trans	-74	-17.7	178.3	-165	0	0	0	0	113.6	S237 R238	S237-S240 WeakPolarHBondContact O-CB 3.34Å; S237-S240 PolarHBondContact O-N 3.24Å; R238-S240 PolarHBondContact O-N 3.16Å
241	I	39.4	Very low	59.9	Low	80 Å²	80	93.6 Å²	93.6	41%	0.41	50%	0.502	S	S	.	.	H	α-helix	trans	-82.2	-42.3	174.3	-60.1	174.7	0	0	0	109.9	R238 I239 S244 A251	R238-I241 PolarHBondContact O-N 2.91Å; I239-I241 VanDerWaalsContact C-N 3.28Å; I239-I241 PolarHBondContact O-N 2.74Å; I241-S244 PolarHBondContact O-N 3.47Å; I241-A251 HydrophobicContact CG2-CB 4.06Å
242	Y	43	Very low	59.6	Low	163 Å²	163	93.4 Å²	93.4	64%	0.639	50%	0.501	S	S	*	.	H	α-helix	trans	-74.9	-30.3	-178.7	-67.7	-75	0	0	0	114.3	R238 I239 S244 C245 A251	R238-Y242 WeakPolarHBondContact O-CD2 3.27Å; I239-Y242 PolarHBondContact O-N 2.04Å; Y242-S244 PolarHBondContact O-N 3.3Å; Y242-C245 PolarHBondContact O-N 2.83Å; Y242-A251 HydrophobicContact CD1-CB 4.42Å; Y242-A251 HydrophobicContact CE1-CB 4.47Å
243	K	45.1	Very low	59.1	Low	181 Å²	181	96.8 Å²	96.8	79%	0.787	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-17.8	176.4	-101.4	-178.9	178	173.6	0	114.1	I239	I239-K243 HydrophobicContact CG2-CD 4.25Å; I239-K243 HydrophobicContact CG2-CG 4.4Å; I239-K243 PolarHBondContact O-N 2.85Å; I239-K243 VanDerWaalsContact O-N 3.07Å
244	S	53.1	Low	58.6	Low	95 Å²	95	91.6 Å²	91.6	66%	0.664	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-18.5	-179.1	-164.7	0	0	0	0	113.4	I241 Y242	I241-S244 PolarHBondContact O-N 3.47Å; Y242-S244 PolarHBondContact O-N 3.3Å
245	C	60.2	Low	58.4	Low	15 Å²	15	86.4 Å²	86.4	10%	0.101	48%	0.483	C	S	.	.	S	Bend	trans	-98.3	124.5	176.4	-55.9	0	0	0	0	108.8	Y242 M249 A251 C257	Y242-C245 PolarHBondContact O-N 2.83Å; C245-M249 HydrophobicContact CB-CB 3.94Å; C245-A251 VanDerWaalsContact SG-CB 3.56Å; C245-C257 WeakPolarHBondContact CA-SG 3.19Å; C245-C257 HydrophobicContact CB-CB 3.87Å; C245-C257 WeakPolarHBondContact CB-SG 3.32Å; C245-C257 WeakPolarHBondContact SG-CB 3.5Å; C245-C257 CovalentContact SG-SG 2.03Å; C245-C257 PolarHBondContact SG-SG 3.21Å
246	G	61.5	Low	58.4	Low	38 Å²	38	90.8 Å²	90.8	39%	0.392	50%	0.495	S	S	.	.			trans	-57.7	160.2	175	0	0	0	0	0	111.5	D248 M249	G246-D248 PolarHBondContact O-N 2.78Å; G246-M249 WeakPolarHBondContact O-CB 3.09Å; G246-M249 PolarHBondContact O-N 3.25Å
247	A	55.8	Low	58.9	Low	92 Å²	92	87.1 Å²	87.1	76%	0.76	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-22.3	-175	0	0	0	0	0	115
248	D	59.2	Low	59.9	Low	130 Å²	130	84 Å²	84	70%	0.695	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	7.3	-179.9	-49	-40.1	0	0	0	113.5	G246 R260	G246-D248 PolarHBondContact O-N 2.78Å; D248-R260 PolarHBondContact O-N 3.42Å
249	M	67.8	Low	61.4	Low	97 Å²	97	76.8 Å²	76.8	48%	0.478	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.6	-175.6	-68.7	-173.7	-107.7	0	0	112.6	C245 G246 C257 I258	C245-M249 HydrophobicContact CB-CB 3.94Å; G246-M249 WeakPolarHBondContact O-CB 3.09Å; G246-M249 PolarHBondContact O-N 3.25Å; M249-C257 HydrophobicContact CB-CB 4.24Å; M249-C257 HydrophobicContact SD-CB 3.95Å; M249-I258 CarbonylContact C-O 3.52Å; M249-I258 WeakPolarHBondContact CA-O 3.24Å; M249-I258 VanDerWaalsContact CB-O 3.29Å; M249-I258 WeakPolarHBondContact CB-O 3.2Å
250	F	72.9	Confident	62.8	Low	49 Å²	49	79.2 Å²	79.2	22%	0.215	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134.5	173.6	173.2	-96.4	0	0	0	110.5	C257 I258 M263 D275	F250-C257 CarbonylContact O-C 3.54Å; F250-C257 VanDerWaalsContact O-CA 3.31Å; F250-C257 WeakPolarHBondContact O-CA 3.26Å; F250-I258 HydrophobicContact CB-CG1 4.02Å; F250-I258 HydrophobicContact CD1-CD1 3.86Å; F250-I258 HydrophobicContact CD1-CG1 3.78Å; F250-I258 HydrophobicContact CG-CG1 4.4Å; F250-I258 PolarHBondContact N-O 2.7Å; F250-I258 PolarHBondContact O-N 2.77Å; F250-M263 HydrophobicContact CD2-SD 3.98Å; F250-M263 HydrophobicContact CE2-SD 4.11Å; F250-D275 HydrophobicContact CD1-CB 4.47Å; F250-D275 HydrophobicContact CE1-CB 4.14Å
251	A	70.4	Confident	64.1	Low	7 Å²	7	80.6 Å²	80.6	6%	0.058	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	118.2	175.3	0	0	0	0	0	110.4	I241 Y242 C245	I241-A251 HydrophobicContact CG2-CB 4.06Å; Y242-A251 HydrophobicContact CD1-CB 4.42Å; Y242-A251 HydrophobicContact CE1-CB 4.47Å; C245-A251 VanDerWaalsContact SG-CB 3.56Å
252	C	69.6	Low	65.9	Low	1 Å²	1	79.6 Å²	79.6	1%	0.007	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-63.7	159.1	167	-52	0	0	0	0	110.4	N254 G255 R256 C270	C252-N254 VanDerWaalsContact CB-OD1 3.27Å; C252-N254 WeakPolarHBondContact CB-OD1 3.1Å; C252-N254 PolarHBondContact O-N 3.45Å; C252-G255 WeakPolarHBondContact O-CA 3.45Å; C252-G255 PolarHBondContact O-N 2.88Å; C252-R256 HydrophobicContact CB-CB 4.31Å; C252-R256 WeakPolarHBondContact CB-O 3.4Å; C252-R256 PolarHBondContact N-O 3.36Å; C252-R256 PolarHBondContact SG-O 2.7Å; C252-C270 HydrophobicContact CB-CB 3.74Å; C252-C270 WeakPolarHBondContact CB-SG 3.25Å; C252-C270 VanDerWaalsContact SG-CA 3.6Å; C252-C270 WeakPolarHBondContact SG-CB 3.22Å; C252-C270 CovalentContact SG-SG 2.02Å; C252-C270 PolarHBondContact SG-SG 2.86Å
253	D	69.5	Low	67.4	Low	124 Å²	124	75.8 Å²	75.8	66%	0.663	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-28	178.9	-67.9	-29.6	0	0	0	112.2	G255 D272 S274	D253-G255 PolarHBondContact O-N 2.79Å; D253-D272 PolarHBondContact N-OD2 3.44Å; D253-S274 WeakPolarHBondContact OD2-CB 3.42Å; D253-S274 PolarHBondContact OD2-OG 2.86Å
254	N	67.1	Low	68.7	Low	78 Å²	78	69.8 Å²	69.8	42%	0.417	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	1.5	171.1	67.2	29.2	0	0	0	115.2	C252 R256 D272	C252-N254 VanDerWaalsContact CB-OD1 3.27Å; C252-N254 WeakPolarHBondContact CB-OD1 3.1Å; C252-N254 PolarHBondContact O-N 3.45Å; N254-R256 WeakPolarHBondContact OD1-CB 3.43Å; N254-R256 PolarHBondContact OD1-N 3.48Å; N254-D272 PolarHBondContact N-OD2 2.78Å; N254-D272 PolarHBondContact ND2-OD2 3.09Å
255	G	69.2	Low	69.8	Low	39 Å²	39	68.7 Å²	68.7	40%	0.402	39%	0.385	S	S	.	.	S	Bend	trans	83.8	2.4	179	0	0	0	0	0	115.9	C252 D253	C252-G255 WeakPolarHBondContact O-CA 3.45Å; C252-G255 PolarHBondContact O-N 2.88Å; D253-G255 PolarHBondContact O-N 2.79Å
256	R	71.9	Confident	70.4	Confident	123 Å²	123	71 Å²	71	46%	0.464	41%	0.412	S	S	.	.			trans	-74.4	134.4	172.8	-176.2	-178.6	178.7	-154.8	-4.9	110.5	C252 N254 D269	C252-R256 HydrophobicContact CB-CB 4.31Å; C252-R256 WeakPolarHBondContact CB-O 3.4Å; C252-R256 PolarHBondContact N-O 3.36Å; C252-R256 PolarHBondContact SG-O 2.7Å; N254-R256 WeakPolarHBondContact OD1-CB 3.43Å; N254-R256 PolarHBondContact OD1-N 3.48Å; R256-D269 PolarHBondContact NH1-O 3.18Å
257	C	76.1	Confident	70.9	Confident	43 Å²	43	77.8 Å²	77.8	29%	0.291	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.9	171.4	-51.6	0	0	0	0	111	C245 M249 F250	C245-C257 WeakPolarHBondContact CA-SG 3.19Å; C245-C257 HydrophobicContact CB-CB 3.87Å; C245-C257 WeakPolarHBondContact CB-SG 3.32Å; C245-C257 WeakPolarHBondContact SG-CB 3.5Å; C245-C257 CovalentContact SG-SG 2.03Å; C245-C257 PolarHBondContact SG-SG 3.21Å; M249-C257 HydrophobicContact CB-CB 4.24Å; M249-C257 HydrophobicContact SD-CB 3.95Å; F250-C257 CarbonylContact O-C 3.54Å; F250-C257 VanDerWaalsContact O-CA 3.31Å; F250-C257 WeakPolarHBondContact O-CA 3.26Å
258	I	74.1	Confident	72.1	Confident	8 Å²	8	81.4 Å²	81.4	4%	0.041	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	166.5	167.4	62.1	169.1	0	0	0	109.5	M249 F250 Q262 D269 D275	M249-I258 CarbonylContact C-O 3.52Å; M249-I258 WeakPolarHBondContact CA-O 3.24Å; M249-I258 VanDerWaalsContact CB-O 3.29Å; M249-I258 WeakPolarHBondContact CB-O 3.2Å; F250-I258 HydrophobicContact CB-CG1 4.02Å; F250-I258 HydrophobicContact CD1-CD1 3.86Å; F250-I258 HydrophobicContact CD1-CG1 3.78Å; F250-I258 HydrophobicContact CG-CG1 4.4Å; F250-I258 PolarHBondContact N-O 2.7Å; F250-I258 PolarHBondContact O-N 2.77Å; I258-Q262 HydrophobicContact CB-CB 4.47Å; I258-Q262 HydrophobicContact CD1-CB 3.96Å; I258-Q262 HydrophobicContact CG1-CB 4.48Å; I258-D269 HydrophobicContact CD1-CB 4.17Å; I258-D269 HydrophobicContact CG2-CB 4.38Å; I258-D275 HydrophobicContact CD1-CB 3.56Å
259	S	75.6	Confident	73.1	Confident	47 Å²	47	77.1 Å²	77.1	33%	0.329	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	145.6	176.2	-177	0	0	0	0	111.1	V261 Q262	S259-V261 PolarHBondContact O-N 3.48Å; S259-V261 VanDerWaalsContact O-N 3.12Å; S259-V261 WeakPolarHBondContact OG-CG2 3.14Å; S259-Q262 VanDerWaalsContact O-CB 3.29Å; S259-Q262 WeakPolarHBondContact O-CB 3.05Å; S259-Q262 PolarHBondContact O-N 2.84Å
260	R	72.9	Confident	73.6	Confident	163 Å²	163	72.7 Å²	72.7	62%	0.615	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-61.1	-23.3	179.8	-160.8	173.1	-174.4	-174.4	-0.2	113.5	D248 Q262 M263	D248-R260 PolarHBondContact O-N 3.42Å; R260-Q262 VanDerWaalsContact C-N 3.27Å; R260-Q262 PolarHBondContact O-N 2.96Å; R260-M263 WeakPolarHBondContact O-CB 3.46Å; R260-M263 PolarHBondContact O-N 3.38Å
261	V	72.4	Confident	73.8	Confident	119 Å²	119	77.6 Å²	77.6	72%	0.721	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-77.5	-9.7	174.7	-59.3	0	0	0	0	114.2	S259 M263	S259-V261 PolarHBondContact O-N 3.48Å; S259-V261 VanDerWaalsContact O-N 3.12Å; S259-V261 WeakPolarHBondContact OG-CG2 3.14Å; V261-M263 VanDerWaalsContact C-N 3.32Å
262	Q	76.1	Confident	74.1	Confident	60 Å²	60	80.5 Å²	80.5	28%	0.28	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-89.8	-2.1	174.9	-65.8	-178.5	-84.4	0	0	112.1	I258 S259 R260 D269	I258-Q262 HydrophobicContact CB-CB 4.47Å; I258-Q262 HydrophobicContact CD1-CB 3.96Å; I258-Q262 HydrophobicContact CG1-CB 4.48Å; S259-Q262 VanDerWaalsContact O-CB 3.29Å; S259-Q262 WeakPolarHBondContact O-CB 3.05Å; S259-Q262 PolarHBondContact O-N 2.84Å; R260-Q262 VanDerWaalsContact C-N 3.27Å; R260-Q262 PolarHBondContact O-N 2.96Å; Q262-D269 HydrophobicContact CB-CB 4.33Å; Q262-D269 VanDerWaalsContact CB-OD2 3.27Å; Q262-D269 WeakPolarHBondContact CB-OD2 3.47Å; Q262-D269 WeakPolarHBondContact CG-OD2 3.5Å; Q262-D269 VanDerWaalsContact NE2-CG 3.28Å; Q262-D269 PolarHBondContact NE2-OD2 3.47Å
263	M	75.8	Confident	74.3	Confident	82 Å²	82	81.1 Å²	81.1	40%	0.404	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	132.8	171.3	-174.1	-176.4	165.8	0	0	108.7	F250 R260 V261 D265	F250-M263 HydrophobicContact CD2-SD 3.98Å; F250-M263 HydrophobicContact CE2-SD 4.11Å; R260-M263 WeakPolarHBondContact O-CB 3.46Å; R260-M263 PolarHBondContact O-N 3.38Å; V261-M263 VanDerWaalsContact C-N 3.32Å; M263-D265 PolarHBondContact O-N 2.88Å
264	C	72.6	Confident	74.8	Confident	55 Å²	55	76.3 Å²	76.3	37%	0.372	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	26.8	178	-48	0	0	0	0	114.6	G266 D275 E276 C280	C264-G266 VanDerWaalsContact C-N 3.26Å; C264-D275 PolarHBondContact N-O 2.94Å; C264-D275 VanDerWaalsContact N-O 3.15Å; C264-E276 VanDerWaalsContact C-OE1 3.29Å; C264-E276 WeakPolarHBondContact CA-OE1 3.2Å; C264-E276 PolarHBondContact N-OE1 2.9Å; C264-E276 VanDerWaalsContact N-OE1 3.13Å; C264-C280 WeakPolarHBondContact CA-SG 3Å; C264-C280 HydrophobicContact CB-CB 3.43Å; C264-C280 VanDerWaalsContact CB-CB 3.43Å; C264-C280 WeakPolarHBondContact CB-SG 3.49Å; C264-C280 WeakPolarHBondContact SG-CA 3.21Å; C264-C280 WeakPolarHBondContact SG-CB 3.16Å; C264-C280 CovalentContact SG-SG 2.01Å; C264-C280 PolarHBondContact SG-SG 2.98Å
265	D	75.1	Confident	75.3	Confident	73 Å²	73	72.7 Å²	72.7	39%	0.39	39%	0.385	S	S	.	.	S	Bend	trans	-86.8	-1.6	179.7	86.4	-14.9	0	0	0	112.4	M263 R267 E276	M263-D265 PolarHBondContact O-N 2.88Å; D265-R267 WeakPolarHBondContact OD1-CA 3.24Å; D265-R267 VanDerWaalsContact OD1-CB 3.26Å; D265-R267 WeakPolarHBondContact OD1-CB 3.41Å; D265-R267 PolarHBondContact OD1-N 2.79Å; D265-E276 PolarHBondContact N-OE1 2.93Å
266	G	72.4	Confident	75.7	Confident	63 Å²	63	73.3 Å²	73.3	65%	0.649	38%	0.378	S	S	*	.	S	Bend	trans	86.7	5.7	-178.9	0	0	0	0	0	113.5	C264 E276	C264-G266 VanDerWaalsContact C-N 3.26Å; G266-E276 VanDerWaalsContact CA-OE2 3.22Å; G266-E276 WeakPolarHBondContact CA-OE2 3.02Å; G266-E276 PolarHBondContact N-OE1 3.46Å; G266-E276 VanDerWaalsContact N-OE1 3.08Å; G266-E276 PolarHBondContact N-OE2 2.79Å
267	R	72.1	Confident	75.6	Confident	181 Å²	181	72.9 Å²	72.9	68%	0.683	38%	0.381	S	S	*	.	S	Bend	trans	-120.4	137.5	176.4	-58.7	-178.2	173.7	-150.2	0.2	109.8	D265 D269 E276	D265-R267 WeakPolarHBondContact OD1-CA 3.24Å; D265-R267 VanDerWaalsContact OD1-CB 3.26Å; D265-R267 WeakPolarHBondContact OD1-CB 3.41Å; D265-R267 PolarHBondContact OD1-N 2.79Å; R267-D269 PolarHBondContact O-N 3.07Å; R267-D269 VanDerWaalsContact O-N 3.09Å; R267-E276 WeakPolarHBondContact O-CG 3.36Å
268	K	80.5	Confident	74.8	Confident	167 Å²	167	80 Å²	80	73%	0.726	41%	0.407	S	S	*	.			trans	-77.9	94.1	172.5	-65.5	-175.1	178.5	-171.7	0	109.9	E276	K268-E276 HydrophobicContact CG-CG 4.33Å
269	D	80.6	Confident	73.7	Confident	41 Å²	41	90.4 Å²	90.4	22%	0.219	45%	0.446	C	S	.	.			trans	-89.5	-26.6	173.4	-72.4	-35.2	0	0	0	112.2	R256 I258 Q262 R267 D275	R256-D269 PolarHBondContact NH1-O 3.18Å; I258-D269 HydrophobicContact CD1-CB 4.17Å; I258-D269 HydrophobicContact CG2-CB 4.38Å; Q262-D269 HydrophobicContact CB-CB 4.33Å; Q262-D269 VanDerWaalsContact CB-OD2 3.27Å; Q262-D269 WeakPolarHBondContact CB-OD2 3.47Å; Q262-D269 WeakPolarHBondContact CG-OD2 3.5Å; Q262-D269 VanDerWaalsContact NE2-CG 3.28Å; Q262-D269 PolarHBondContact NE2-OD2 3.47Å; R267-D269 PolarHBondContact O-N 3.07Å; R267-D269 VanDerWaalsContact O-N 3.09Å; D269-D275 VanDerWaalsContact CA-OD2 3.25Å; D269-D275 WeakPolarHBondContact CA-OD2 3.33Å; D269-D275 VanDerWaalsContact CB-OD2 3.31Å; D269-D275 WeakPolarHBondContact CB-OD2 3.42Å; D269-D275 PolarHBondContact N-OD2 2.84Å
270	C	79.5	Confident	72.5	Confident	3 Å²	3	90.2 Å²	90.2	2%	0.02	44%	0.444	C	S	.	.	S	Bend	trans	-80.2	137.2	163.6	-65.4	0	0	0	0	111.7	C252 D272 G273 D275	C252-C270 HydrophobicContact CB-CB 3.74Å; C252-C270 WeakPolarHBondContact CB-SG 3.25Å; C252-C270 VanDerWaalsContact SG-CA 3.6Å; C252-C270 WeakPolarHBondContact SG-CB 3.22Å; C252-C270 CovalentContact SG-SG 2.02Å; C252-C270 PolarHBondContact SG-SG 2.86Å; C270-D272 WeakPolarHBondContact CB-OD1 3.37Å; C270-D272 PolarHBondContact O-N 2.03Å; C270-G273 PolarHBondContact O-N 3.13Å; C270-D275 HydrophobicContact CB-CB 4.16Å; C270-D275 VanDerWaalsContact CB-OD1 3.31Å; C270-D275 WeakPolarHBondContact CB-OD1 3.36Å; C270-D275 VanDerWaalsContact N-CG 3.33Å; C270-D275 PolarHBondContact N-OD1 2.8Å; C270-D275 PolarHBondContact N-OD2 3.49Å
271	L	75.6	Confident	71.1	Confident	152 Å²	152	86 Å²	86	80%	0.796	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-27	-178.9	-68.1	170.1	0	0	0	113.2
272	D	77.4	Confident	69.5	Low	68 Å²	68	84.6 Å²	84.6	36%	0.364	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-14.2	174.1	48	16.9	0	0	0	112.8	D253 N254 C270 S274	D253-D272 PolarHBondContact N-OD2 3.44Å; N254-D272 PolarHBondContact N-OD2 2.78Å; N254-D272 PolarHBondContact ND2-OD2 3.09Å; C270-D272 WeakPolarHBondContact CB-OD1 3.37Å; C270-D272 PolarHBondContact O-N 2.03Å; D272-S274 PolarHBondContact OD1-N 2.85Å; D272-S274 PolarHBondContact OD1-OG 2.92Å; D272-S274 PolarHBondContact OD2-OG 2.03Å
273	G	74.3	Confident	67.4	Low	15 Å²	15	90.9 Å²	90.9	16%	0.155	48%	0.482	C	S	.	.			trans	75.4	19.9	-175.9	0	0	0	0	0	114.3	C270 D275 E276	C270-G273 PolarHBondContact O-N 3.13Å; G273-D275 VanDerWaalsContact C-OD1 3.3Å; G273-D275 WeakPolarHBondContact CA-OD1 3.43Å; G273-D275 PolarHBondContact O-N 2.86Å; G273-E276 PolarHBondContact O-N 3.18Å
274	S	79.6	Confident	65.4	Low	23 Å²	23	93.6 Å²	93.6	16%	0.161	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-68.5	-20.4	-179.8	-58.6	0	0	0	0	113.7	D253 D272 E276	D253-S274 WeakPolarHBondContact OD2-CB 3.42Å; D253-S274 PolarHBondContact OD2-OG 2.86Å; D272-S274 PolarHBondContact OD1-N 2.85Å; D272-S274 PolarHBondContact OD1-OG 2.92Å; D272-S274 PolarHBondContact OD2-OG 2.03Å; S274-E276 VanDerWaalsContact C-N 3.33Å
275	D	77.1	Confident	63.5	Low	1 Å²	1	102 Å²	102	1%	0.005	53%	0.529	C	S	.	.	G	3₁₀ helix	trans	-71.1	-23.9	173.5	55.5	-28	0	0	0	114.4	F250 I258 C264 D269 C270 G273	F250-D275 HydrophobicContact CD1-CB 4.47Å; F250-D275 HydrophobicContact CE1-CB 4.14Å; I258-D275 HydrophobicContact CD1-CB 3.56Å; C264-D275 PolarHBondContact N-O 2.94Å; C264-D275 VanDerWaalsContact N-O 3.15Å; D269-D275 VanDerWaalsContact CA-OD2 3.25Å; D269-D275 WeakPolarHBondContact CA-OD2 3.33Å; D269-D275 VanDerWaalsContact CB-OD2 3.31Å; D269-D275 WeakPolarHBondContact CB-OD2 3.42Å; D269-D275 PolarHBondContact N-OD2 2.84Å; C270-D275 HydrophobicContact CB-CB 4.16Å; C270-D275 VanDerWaalsContact CB-OD1 3.31Å; C270-D275 WeakPolarHBondContact CB-OD1 3.36Å; C270-D275 VanDerWaalsContact N-CG 3.33Å; C270-D275 PolarHBondContact N-OD1 2.8Å; C270-D275 PolarHBondContact N-OD2 3.49Å; G273-D275 VanDerWaalsContact C-OD1 3.3Å; G273-D275 WeakPolarHBondContact CA-OD1 3.43Å; G273-D275 PolarHBondContact O-N 2.86Å
276	E	78.6	Confident	61.4	Low	52 Å²	52	106.9 Å²	106.9	24%	0.243	55%	0.549	C	S	.	.	G	3₁₀ helix	trans	-110.4	38.1	-177.5	-67.5	-64.9	133.5	0	0	111.6	C264 D265 G266 R267 K268 G273 S274	C264-E276 VanDerWaalsContact C-OE1 3.29Å; C264-E276 WeakPolarHBondContact CA-OE1 3.2Å; C264-E276 PolarHBondContact N-OE1 2.9Å; C264-E276 VanDerWaalsContact N-OE1 3.13Å; D265-E276 PolarHBondContact N-OE1 2.93Å; G266-E276 VanDerWaalsContact CA-OE2 3.22Å; G266-E276 WeakPolarHBondContact CA-OE2 3.02Å; G266-E276 PolarHBondContact N-OE1 3.46Å; G266-E276 VanDerWaalsContact N-OE1 3.08Å; G266-E276 PolarHBondContact N-OE2 2.79Å; R267-E276 WeakPolarHBondContact O-CG 3.36Å; K268-E276 HydrophobicContact CG-CG 4.33Å; G273-E276 PolarHBondContact O-N 3.18Å; S274-E276 VanDerWaalsContact C-N 3.33Å
277	H	68.4	Low	59.3	Low	115 Å²	115	107.3 Å²	107.3	53%	0.532	55%	0.552	S	S	.	*			trans	-65.2	156.7	-178.8	-167.4	74.7	0	0	0	112.4	W279 C280	H277-W279 PolarHBondContact O-N 2.73Å; H277-C280 WeakPolarHBondContact O-CB 3.33Å; H277-C280 PolarHBondContact O-N 3.14Å
278	K	59.3	Low	57.6	Low	193 Å²	193	105.7 Å²	105.7	84%	0.839	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-12.6	-174	-164.9	174.6	179.3	-175.7	0	115.2
279	W	52.3	Low	55.5	Low	225 Å²	225	106.2 Å²	106.2	85%	0.852	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	3.8	-178.2	-66.8	11	0	0	0	113.5	H277 G281	H277-W279 PolarHBondContact O-N 2.73Å; W279-G281 PolarHBondContact O-N 3.02Å
280	C	51	Low	53.7	Low	44 Å²	44	107.4 Å²	107.4	30%	0.297	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	94.6	167.5	-77.5	0	0	0	0	111.1	C264 H277	C264-C280 WeakPolarHBondContact CA-SG 3Å; C264-C280 HydrophobicContact CB-CB 3.43Å; C264-C280 VanDerWaalsContact CB-CB 3.43Å; C264-C280 WeakPolarHBondContact CB-SG 3.49Å; C264-C280 WeakPolarHBondContact SG-CA 3.21Å; C264-C280 WeakPolarHBondContact SG-CB 3.16Å; C264-C280 CovalentContact SG-SG 2.01Å; C264-C280 PolarHBondContact SG-SG 2.98Å; H277-C280 WeakPolarHBondContact O-CB 3.33Å; H277-C280 PolarHBondContact O-N 3.14Å
281	G	43.1	Very low	52.4	Low	75 Å²	75	114.8 Å²	114.8	77%	0.773	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	171.5	0.3	179.2	0	0	0	0	0	117	W279	W279-G281 PolarHBondContact O-N 3.02Å
282	A	38.9	Very low	51.3	Low	89 Å²	89	108.8 Å²	108.8	74%	0.736	59%	0.587	S	S	*	*			trans	-91	105.7	173.6	0	0	0	0	0	110.2	T284	A282-T284 PolarHBondContact O-N 3.27Å; A282-T284 VanDerWaalsContact O-N 3.15Å
283	E	31.2	Very low	49.8	Very low	192 Å²	192	113.7 Å²	113.7	90%	0.897	61%	0.605	S	S	*	*			trans	-56	109.4	176.2	-68.2	177	154.5	0	0	111.6
284	T	34.3	Very low	48.6	Very low	138 Å²	138	120.3 Å²	120.3	85%	0.847	64%	0.637	S	S	*	*			trans	-149.9	115.4	154.4	31.3	0	0	0	0	110.9	A282	A282-T284 PolarHBondContact O-N 3.27Å; A282-T284 VanDerWaalsContact O-N 3.15Å
285	Y	32.2	Very low	46.8	Very low	233 Å²	233	124 Å²	124	91%	0.914	65%	0.652	S	S	*	*			trans	-97.6	152.1	-179.6	-114.1	-96.8	0	0	0	111
286	H	31.2	Very low	45.5	Very low	175 Å²	175	129.9 Å²	129.9	81%	0.81	67%	0.674	S	S	*	*			trans	-52.2	141.3	-177.2	-66.5	-99.9	0	0	0	118.1
287	G	29.1	Very low	44.2	Very low	71 Å²	71	133.4 Å²	133.4	73%	0.732	69%	0.685	S	S	*	*			trans	166.4	103	156.7	0	0	0	0	0	116.4
288	V	34.3	Very low	43.3	Very low	148 Å²	148	130.8 Å²	130.8	90%	0.897	68%	0.675	S	S	*	*			trans	53.4	94.7	162.8	-153.5	0	0	0	0	117.5
289	E	36.7	Very low	43	Very low	177 Å²	177	121.7 Å²	121.7	83%	0.827	64%	0.635	S	S	*	*			trans	-84	124.1	174	-77.4	175.7	152.5	0	0	112.2
290	C	44.6	Very low	43.2	Very low	67 Å²	67	116.6 Å²	116.6	45%	0.453	63%	0.634	S	S	.	*			trans	-75.4	141.7	159.4	-71.2	0	0	0	0	109.3	L298	C290-L298 HydrophobicContact CB-CD1 3.79Å; C290-L298 HydrophobicContact CB-CD2 4.15Å; C290-L298 HydrophobicContact CB-CG 4.49Å; C290-L298 WeakPolarHBondContact O-CD1 3.35Å
291	L	50.5	Low	43.1	Very low	157 Å²	157	119.9 Å²	119.9	82%	0.822	65%	0.653	S	S	*	*			trans	-112.5	125.9	-179.6	-64.1	168.4	0	0	0	109.9
292	C	53.2	Low	43.2	Very low	26 Å²	26	121.7 Å²	121.7	18%	0.176	65%	0.645	C	S	.	*			trans	-91.4	145.5	172.3	-68.3	0	0	0	0	110.2	N294 W296 C306	C292-N294 PolarHBondContact O-N 2.99Å; C292-W296 VanDerWaalsContact CB-C 3.48Å; C292-W296 HydrophobicContact CB-CB 3.71Å; C292-W296 WeakPolarHBondContact CB-O 3.31Å; C292-C306 HydrophobicContact CB-CB 4.01Å; C292-C306 WeakPolarHBondContact CB-SG 3.47Å; C292-C306 VanDerWaalsContact SG-CA 3.58Å; C292-C306 WeakPolarHBondContact SG-CB 3.13Å; C292-C306 CovalentContact SG-SG 2.04Å; C292-C306 PolarHBondContact SG-SG 2.95Å
293	K	46.4	Very low	43.8	Very low	171 Å²	171	123.6 Å²	123.6	74%	0.743	64%	0.643	S	S	*	*			trans	-67.8	130.8	-176	-176.1	-179.3	-179.4	-176.3	0	110.6	E295 W296	K293-E295 PolarHBondContact O-N 3.26Å; K293-W296 VanDerWaalsContact O-CD1 3.25Å; K293-W296 PolarHBondContact O-N 2.75Å
294	N	48.4	Very low	44.8	Very low	155 Å²	155	121.2 Å²	121.2	83%	0.829	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	25	-38	171.7	-67.3	11.2	0	0	0	121.6	C292	C292-N294 PolarHBondContact O-N 2.99Å
295	E	41.3	Very low	45.5	Very low	100 Å²	100	119 Å²	119	47%	0.467	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.1	13.6	-171.9	-56.4	-77.5	158.3	0	0	112.2	K293 Q316	K293-E295 PolarHBondContact O-N 3.26Å; E295-Q316 PolarHBondContact OE2-NE2 3.3Å; E295-Q316 PolarHBondContact OE2-OE1 3.18Å
296	W	51.1	Low	46.8	Very low	125 Å²	125	110.2 Å²	110.2	47%	0.473	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.1	145.4	-173.4	-62.7	72.3	0	0	0	109.8	C292 K293 C306 D308	C292-W296 VanDerWaalsContact CB-C 3.48Å; C292-W296 HydrophobicContact CB-CB 3.71Å; C292-W296 WeakPolarHBondContact CB-O 3.31Å; K293-W296 VanDerWaalsContact O-CD1 3.25Å; K293-W296 PolarHBondContact O-N 2.75Å; W296-C306 HydrophobicContact CB-CB 4.12Å; W296-C306 HydrophobicContact CE3-CB 4.1Å; W296-C306 VanDerWaalsContact CE3-O 3.26Å; W296-D308 HydrophobicContact CD2-CB 4.2Å; W296-D308 HydrophobicContact CE3-CB 3.93Å; W296-D308 VanDerWaalsContact CE3-N 3.25Å; W296-D308 HydrophobicContact CH2-CB 4.16Å; W296-D308 HydrophobicContact CZ2-CB 4.4Å; W296-D308 HydrophobicContact CZ3-CB 3.92Å
297	R	50.2	Low	47.8	Very low	126 Å²	126	105 Å²	105	48%	0.475	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.7	154.4	176.6	58.4	176.7	-158.2	173.3	4.8	111.1	A299 C306 E307 E309	R297-A299 PolarHBondContact O-N 3.07Å; R297-C306 CarbonylContact O-C 3.39Å; R297-C306 WeakPolarHBondContact O-CA 3.19Å; R297-E307 VanDerWaalsContact CG-O 3.31Å; R297-E307 WeakPolarHBondContact CG-O 3.34Å; R297-E307 PolarHBondContact N-O 3.44Å; R297-E307 PolarHBondContact O-N 3.3Å; R297-E307 VanDerWaalsContact O-O 3.13Å; R297-E309 HydrophobicContact CG-CB 4.09Å; R297-E309 IonicContact CZ-OE1 3.43Å; R297-E309 IonicContact NE-OE1 3.67Å; R297-E309 IonicContact NH1-OE1 3.7Å; R297-E309 PolarHBondContact NH1-OE1 3.18Å
298	L	49.4	Very low	48.9	Very low	60 Å²	60	102.6 Å²	102.6	31%	0.314	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	135.9	179.3	-106.9	81.5	0	0	0	111.7	C290 D303 D305	C290-L298 HydrophobicContact CB-CD1 3.79Å; C290-L298 HydrophobicContact CB-CD2 4.15Å; C290-L298 HydrophobicContact CB-CG 4.49Å; C290-L298 WeakPolarHBondContact O-CD1 3.35Å; L298-D303 HydrophobicContact CD2-CB 4.5Å; L298-D303 WeakPolarHBondContact CD2-O 3.31Å; L298-D305 CarbonylContact C-O 3.48Å; L298-D305 WeakPolarHBondContact CA-O 3.45Å
299	A	54.5	Low	49.8	Very low	1 Å²	1	99.8 Å²	99.8	1%	0.008	52%	0.515	C	S	.	.			trans	-64.6	130.8	174.8	0	0	0	0	0	110.7	R297 T301 N302 D305 E307	R297-A299 PolarHBondContact O-N 3.07Å; A299-T301 PolarHBondContact O-N 2.92Å; A299-T301 VanDerWaalsContact O-N 3.11Å; A299-N302 CarbonylContact O-C 3.54Å; A299-N302 PolarHBondContact O-N 3.01Å; A299-D305 HydrophobicContact CB-CB 3.79Å; A299-D305 WeakPolarHBondContact CB-O 3.2Å; A299-D305 PolarHBondContact N-O 3.23Å; A299-E307 WeakPolarHBondContact CA-OE1 3.42Å; A299-E307 HydrophobicContact CB-CG 3.75Å; A299-E307 VanDerWaalsContact CB-OE1 3.28Å; A299-E307 WeakPolarHBondContact CB-OE1 3.07Å
300	S	54.9	Low	50.9	Low	119 Å²	119	92.5 Å²	92.5	83%	0.832	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-17.5	-178.6	-178.3	0	0	0	0	113.7
301	T	50.7	Low	52.2	Low	112 Å²	112	90.6 Å²	90.6	69%	0.687	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-18.4	-175.4	50.6	0	0	0	0	114	A299	A299-T301 PolarHBondContact O-N 2.92Å; A299-T301 VanDerWaalsContact O-N 3.11Å
302	N	44.7	Very low	53.3	Low	113 Å²	113	84.4 Å²	84.4	60%	0.604	44%	0.441	S	S	*	.			trans	-155.6	122.3	179.6	-83.6	-32.1	0	0	0	109.6	A299 N304 D305	A299-N302 CarbonylContact O-C 3.54Å; A299-N302 PolarHBondContact O-N 3.01Å; N302-N304 PolarHBondContact O-N 2.88Å; N302-D305 PolarHBondContact O-N 2.86Å
303	D	51.4	Low	54	Low	130 Å²	130	91.1 Å²	91.1	70%	0.695	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	9.7	-176	-71.8	-29.1	0	0	0	116.1	L298	L298-D303 HydrophobicContact CD2-CB 4.5Å; L298-D303 WeakPolarHBondContact CD2-O 3.31Å
304	N	52.2	Low	54.9	Low	141 Å²	141	87.1 Å²	87.1	75%	0.754	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	0.6	-177.2	-67.1	-11.7	0	0	0	114	N302	N302-N304 PolarHBondContact O-N 2.88Å
305	D	48.5	Very low	55.7	Low	91 Å²	91	81.8 Å²	81.8	49%	0.487	44%	0.435	S	S	.	.			trans	-107.2	144.1	-178.6	-167.7	18.6	0	0	0	110.7	L298 A299 N302	L298-D305 CarbonylContact C-O 3.48Å; L298-D305 WeakPolarHBondContact CA-O 3.45Å; A299-D305 HydrophobicContact CB-CB 3.79Å; A299-D305 WeakPolarHBondContact CB-O 3.2Å; A299-D305 PolarHBondContact N-O 3.23Å; N302-D305 PolarHBondContact O-N 2.86Å
306	C	59.8	Low	57.1	Low	49 Å²	49	82 Å²	82	33%	0.331	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.5	-178.4	-71.6	0	0	0	0	109.3	C292 W296 R297	C292-C306 HydrophobicContact CB-CB 4.01Å; C292-C306 WeakPolarHBondContact CB-SG 3.47Å; C292-C306 VanDerWaalsContact SG-CA 3.58Å; C292-C306 WeakPolarHBondContact SG-CB 3.13Å; C292-C306 CovalentContact SG-SG 2.04Å; C292-C306 PolarHBondContact SG-SG 2.95Å; W296-C306 HydrophobicContact CB-CB 4.12Å; W296-C306 HydrophobicContact CE3-CB 4.1Å; W296-C306 VanDerWaalsContact CE3-O 3.26Å; R297-C306 CarbonylContact O-C 3.39Å; R297-C306 WeakPolarHBondContact O-CA 3.19Å
307	E	52.3	Low	58.5	Low	66 Å²	66	78.4 Å²	78.4	31%	0.308	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.5	170.5	-72.5	176.3	-161.2	0	0	110.5	R297 A299 E309	R297-E307 VanDerWaalsContact CG-O 3.31Å; R297-E307 WeakPolarHBondContact CG-O 3.34Å; R297-E307 PolarHBondContact N-O 3.44Å; R297-E307 PolarHBondContact O-N 3.3Å; R297-E307 VanDerWaalsContact O-O 3.13Å; A299-E307 WeakPolarHBondContact CA-OE1 3.42Å; A299-E307 HydrophobicContact CB-CG 3.75Å; A299-E307 VanDerWaalsContact CB-OE1 3.28Å; A299-E307 WeakPolarHBondContact CB-OE1 3.07Å; E307-E309 PolarHBondContact O-N 3.01Å
308	D	52.3	Low	60.1	Low	20 Å²	20	80.1 Å²	80.1	11%	0.107	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	122.1	162.9	174.7	-10.7	0	0	0	108.6	W296 A310 V311 R325	W296-D308 HydrophobicContact CD2-CB 4.2Å; W296-D308 HydrophobicContact CE3-CB 3.93Å; W296-D308 VanDerWaalsContact CE3-N 3.25Å; W296-D308 HydrophobicContact CH2-CB 4.16Å; W296-D308 HydrophobicContact CZ2-CB 4.4Å; W296-D308 HydrophobicContact CZ3-CB 3.92Å; D308-A310 PolarHBondContact O-N 2.78Å; D308-A310 PolarHBondContact OD1-N 3Å; D308-V311 PolarHBondContact OD1-N 3.14Å; D308-R325 PolarHBondContact O-NH2 3.24Å
309	E	52.8	Low	61.9	Low	90 Å²	90	77.7 Å²	77.7	42%	0.421	42%	0.419	S	S	.	.			trans	-74.3	68.7	171.8	-158.6	171.9	-149.2	0	0	109.2	R297 E307 V311 N314	R297-E309 HydrophobicContact CG-CB 4.09Å; R297-E309 IonicContact CZ-OE1 3.43Å; R297-E309 IonicContact NE-OE1 3.67Å; R297-E309 IonicContact NH1-OE1 3.7Å; R297-E309 PolarHBondContact NH1-OE1 3.18Å; E307-E309 PolarHBondContact O-N 3.01Å; E309-V311 PolarHBondContact O-N 3.28Å; E309-N314 PolarHBondContact O-ND2 3.28Å
310	A	59.9	Low	63.5	Low	24 Å²	24	77.8 Å²	77.8	20%	0.198	42%	0.419	C	S	.	.			trans	21.6	87.9	176	0	0	0	0	0	115	D308 C312 K313 N314	D308-A310 PolarHBondContact O-N 2.78Å; D308-A310 PolarHBondContact OD1-N 3Å; A310-C312 PolarHBondContact O-N 3.2Å; A310-K313 HydrophobicContact CB-CB 4.18Å; A310-K313 HydrophobicContact CB-CD 4.23Å; A310-K313 HydrophobicContact CB-CG 4.05Å; A310-K313 PolarHBondContact O-N 2.77Å; A310-N314 PolarHBondContact O-N 3.37Å
311	V	71	Confident	65.2	Low	26 Å²	26	72.7 Å²	72.7	16%	0.158	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-36.2	-37.1	166.4	-179.2	0	0	0	0	113.7	D308 E309 Q316 Y330	D308-V311 PolarHBondContact OD1-N 3.14Å; E309-V311 PolarHBondContact O-N 3.28Å; V311-Q316 HydrophobicContact CG1-CB 4.26Å; V311-Y330 HydrophobicContact CB-CD1 4.46Å; V311-Y330 HydrophobicContact CG1-CD1 3.67Å; V311-Y330 HydrophobicContact CG1-CE1 4.04Å
312	C	73.5	Confident	67	Low	27 Å²	27	71.2 Å²	71.2	18%	0.182	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-30.8	176.9	-62.3	0	0	0	0	115.4	A310 H317 C323	A310-C312 PolarHBondContact O-N 3.2Å; C312-H317 PolarHBondContact O-CD2 3.41Å; C312-C323 WeakPolarHBondContact CA-SG 3.49Å; C312-C323 HydrophobicContact CB-CB 3.65Å; C312-C323 WeakPolarHBondContact CB-SG 3.2Å; C312-C323 WeakPolarHBondContact SG-CB 3.44Å; C312-C323 PolarHBondContact SG-O 2.81Å; C312-C323 VanDerWaalsContact SG-O 3.42Å; C312-C323 CovalentContact SG-SG 2.04Å; C312-C323 PolarHBondContact SG-SG 3.25Å
313	K	68.6	Low	69	Low	167 Å²	167	67 Å²	67	73%	0.726	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-34.5	179.6	-73	-172.6	176.3	-178.2	0	112.4	A310 G315	A310-K313 HydrophobicContact CB-CB 4.18Å; A310-K313 HydrophobicContact CB-CD 4.23Å; A310-K313 HydrophobicContact CB-CG 4.05Å; A310-K313 PolarHBondContact O-N 2.77Å; K313-G315 PolarHBondContact O-N 2.87Å
314	N	66.5	Low	70.6	Confident	88 Å²	88	65.2 Å²	65.2	47%	0.471	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-1.3	-179.7	-69.3	-2.7	0	0	0	113.3	E309 A310 Q316	E309-N314 PolarHBondContact O-ND2 3.28Å; A310-N314 PolarHBondContact O-N 3.37Å; N314-Q316 HydrophobicContact CB-CG 4.41Å; N314-Q316 PolarHBondContact O-N 2.81Å
315	G	65.2	Low	71.9	Confident	43 Å²	43	65.7 Å²	65.7	44%	0.443	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	6.4	178.8	0	0	0	0	0	114.6	K313 H317	K313-G315 PolarHBondContact O-N 2.87Å; G315-H317 PolarHBondContact O-N 3.49Å
316	Q	69.9	Low	73.2	Confident	105 Å²	105	66.7 Å²	66.7	49%	0.491	33%	0.326	S	S	.	.			trans	-77.3	2.7	179	-69.5	177.9	-24.3	0	0	113.7	E295 V311 N314	E295-Q316 PolarHBondContact OE2-NE2 3.3Å; E295-Q316 PolarHBondContact OE2-OE1 3.18Å; V311-Q316 HydrophobicContact CG1-CB 4.26Å; N314-Q316 HydrophobicContact CB-CG 4.41Å; N314-Q316 PolarHBondContact O-N 2.81Å
317	H	80.9	Confident	73.6	Confident	49 Å²	49	70.8 Å²	70.8	23%	0.227	36%	0.355	C	S	.	.			trans	-86.9	150.7	177.2	69.9	81.5	0	0	0	111.7	C312 G315 C319 C323 Y330	C312-H317 PolarHBondContact O-CD2 3.41Å; G315-H317 PolarHBondContact O-N 3.49Å; H317-C319 WeakPolarHBondContact ND1-CB 2.98Å; H317-C319 PolarHBondContact ND1-N 2.91Å; H317-C323 HydrophobicContact CB-CB 4.32Å; H317-C323 VanDerWaalsContact CB-SG 3.55Å; H317-C323 VanDerWaalsContact CG-SG 3.59Å; H317-Y330 HydrophobicContact CB-CD1 4.36Å; H317-Y330 HydrophobicContact CB-CD2 4.01Å; H317-Y330 HydrophobicContact CB-CE1 4.18Å; H317-Y330 HydrophobicContact CB-CE2 3.81Å; H317-Y330 HydrophobicContact CB-CG 4.27Å
318	R	83.7	Confident	74.3	Confident	162 Å²	162	71.7 Å²	71.7	61%	0.611	38%	0.382	S	S	*	.			trans	-97.4	8.3	174.4	-64.8	179.2	74.5	-139.4	6.5	113.3	S320 Y330 E345 R584	R318-S320 PolarHBondContact O-N 2.94Å; R318-Y330 PolarHBondContact N-OH 3.11Å; R318-Y330 VanDerWaalsContact N-OH 3.07Å; R318-E345 VanDerWaalsContact CB-CD 3.47Å; R318-E345 HydrophobicContact CB-CG 4.25Å; R318-E345 VanDerWaalsContact CB-OE2 3.23Å; R318-E345 WeakPolarHBondContact CB-OE2 3.5Å; R318-E345 IonicContact CZ-OE2 3.11Å; R318-E345 IonicContact NE-OE2 3.08Å; R318-E345 IonicContact NH1-OE1 3.66Å; R318-E345 PolarHBondContact NH1-OE1 2.83Å; R318-E345 IonicContact NH1-OE2 3.07Å; R318-E345 PolarHBondContact NH1-OE2 2.85Å; R318-E345 IonicContact NH2-OE2 2.62Å; R318-R584 PolarHBondContact O-NH2 2.9Å
319	C	86.5	Confident	75.4	Confident	9 Å²	9	71.9 Å²	71.9	6%	0.061	39%	0.389	C	S	.	.			trans	-56.7	131.3	178	-56.7	0	0	0	0	112.9	H317 C323 Y330 C332	H317-C319 WeakPolarHBondContact ND1-CB 2.98Å; H317-C319 PolarHBondContact ND1-N 2.91Å; C319-C323 HydrophobicContact CB-CB 4.23Å; C319-Y330 WeakPolarHBondContact SG-CD2 3.15Å; C319-Y330 VanDerWaalsContact SG-CE2 3.55Å; C319-C332 WeakPolarHBondContact CA-SG 3.25Å; C319-C332 HydrophobicContact CB-CB 3.62Å; C319-C332 WeakPolarHBondContact CB-SG 3.2Å; C319-C332 WeakPolarHBondContact SG-CA 3.39Å; C319-C332 WeakPolarHBondContact SG-CB 3.44Å; C319-C332 CovalentContact SG-SG 2.03Å; C319-C332 PolarHBondContact SG-SG 3.39Å
320	S	88.6	Confident	76.8	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.014	38%	0.382	C	S	.	.	S	Bend	trans	-61.2	-54.1	172.4	175.5	0	0	0	0	109.9	R318 E345 R524 D566	R318-S320 PolarHBondContact O-N 2.94Å; S320-E345 WeakPolarHBondContact CB-O 3.2Å; S320-E345 PolarHBondContact N-O 3Å; S320-R524 PolarHBondContact O-NE 2.94Å; S320-R524 PolarHBondContact O-NH2 3.15Å; S320-R524 PolarHBondContact OG-NH2 3.48Å; S320-R524 VanDerWaalsContact OG-NH2 3.08Å; S320-D566 PolarHBondContact OG-OD2 2.79Å
321	H	90.2	Very high	78.1	Confident	13 Å²	13	74.9 Å²	74.9	6%	0.06	40%	0.397	C	S	.	.	S	Bend	trans	-105.9	-96	-178.3	-63.4	-172	0	0	0	111.3	S333 A335 Y338 V523	H321-S333 WeakPolarHBondContact CB-O 2.88Å; H321-A335 WeakPolarHBondContact ND1-CB 3.34Å; H321-A335 PolarHBondContact ND1-N 3.27Å; H321-Y338 AromaticContact CE1-CD1 3.51Å; H321-Y338 AromaticContact CE1-CD2 3.56Å; H321-Y338 AromaticContact CE1-CE1 3.79Å; H321-Y338 AromaticContact CE1-CE2 3.81Å; H321-Y338 AromaticContact CE1-CG 3.41Å; H321-Y338 VanDerWaalsContact CE1-CG 3.41Å; H321-Y338 AromaticContact CE1-CZ 3.93Å; H321-Y338 AromaticContact NE2-CD1 3.99Å; H321-V523 HydrophobicContact CB-CG1 3.86Å; H321-V523 VanDerWaalsContact CG-CG1 3.47Å; H321-V523 WeakPolarHBondContact ND1-CG1 3.47Å
322	F	89.6	Confident	79.1	Confident	81 Å²	81	74 Å²	74	36%	0.355	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	135.9	-171.1	-49.3	-60.6	0	0	0	111.5	C332 S333 A335 V523	F322-C332 CarbonylContact O-C 3.49Å; F322-C332 VanDerWaalsContact O-CA 3.3Å; F322-C332 WeakPolarHBondContact O-CA 3.06Å; F322-S333 PolarHBondContact N-O 3.4Å; F322-S333 PolarHBondContact O-N 3.07Å; F322-A335 HydrophobicContact CE2-CB 3.91Å; F322-A335 HydrophobicContact CZ-CB 4.2Å; F322-V523 HydrophobicContact CE1-CG1 4.44Å; F322-V523 VanDerWaalsContact CE1-O 3.25Å; F322-V523 WeakPolarHBondContact CE1-O 3.39Å; F322-V523 HydrophobicContact CZ-CG1 4.16Å
323	C	86.2	Confident	80	Confident	25 Å²	25	74.3 Å²	74.3	17%	0.169	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.4	174.1	-177.3	0	0	0	0	109.9	C312 H317 C319 Y330	C312-C323 WeakPolarHBondContact CA-SG 3.49Å; C312-C323 HydrophobicContact CB-CB 3.65Å; C312-C323 WeakPolarHBondContact CB-SG 3.2Å; C312-C323 WeakPolarHBondContact SG-CB 3.44Å; C312-C323 PolarHBondContact SG-O 2.81Å; C312-C323 VanDerWaalsContact SG-O 3.42Å; C312-C323 CovalentContact SG-SG 2.04Å; C312-C323 PolarHBondContact SG-SG 3.25Å; H317-C323 HydrophobicContact CB-CB 4.32Å; H317-C323 VanDerWaalsContact CB-SG 3.55Å; H317-C323 VanDerWaalsContact CG-SG 3.59Å; C319-C323 HydrophobicContact CB-CB 4.23Å; C323-Y330 VanDerWaalsContact SG-CB 3.54Å
324	H	84.5	Confident	81.1	Confident	92 Å²	92	67.8 Å²	67.8	43%	0.426	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	142	175.6	-59.5	-67.3	0	0	0	110.2	Y330 Q331 S333	H324-Y330 CarbonylContact O-C 3.58Å; H324-Y330 VanDerWaalsContact O-CA 3.23Å; H324-Y330 WeakPolarHBondContact O-CA 3.35Å; H324-Q331 PolarHBondContact N-O 3.37Å; H324-Q331 PolarHBondContact O-N 3.29Å; H324-S333 PolarHBondContact CD2-OG 3.45Å; H324-S333 PolarHBondContact NE2-OG 2.71Å
325	R	79.4	Confident	82.3	Confident	151 Å²	151	64.3 Å²	64.3	57%	0.57	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	133.1	176	-174.8	178.9	-178.4	165.6	3.9	110.2	D308	D308-R325 PolarHBondContact O-NH2 3.24Å
326	E	76.2	Confident	83.4	Confident	112 Å²	112	69.2 Å²	69.2	52%	0.523	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	157.8	171.5	-164.2	170.8	-165.7	0	0	110.1	G328 G329	E326-G328 PolarHBondContact O-N 3.03Å; E326-G329 PolarHBondContact N-O 3.3Å; E326-G329 PolarHBondContact O-N 3.33Å
327	S	68.6	Low	84.3	Confident	134 Å²	134	65.2 Å²	65.2	94%	0.937	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-11.4	-173.3	-57.5	0	0	0	0	115.4
328	G	66.8	Low	84.8	Confident	85 Å²	85	64.1 Å²	64.1	88%	0.876	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	15.7	177.8	0	0	0	0	0	114.9	E326	E326-G328 PolarHBondContact O-N 3.03Å
329	G	74.7	Confident	85.2	Confident	25 Å²	25	62 Å²	62	26%	0.258	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	145.3	-129.1	-179.2	0	0	0	0	0	112.3	E326	E326-G329 PolarHBondContact N-O 3.3Å; E326-G329 PolarHBondContact O-N 3.33Å
330	Y	82.8	Confident	85.5	Confident	69 Å²	69	65 Å²	65	27%	0.271	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	151	176.6	67.8	-89	0	0	0	112	V311 H317 R318 C319 C323 H324	V311-Y330 HydrophobicContact CB-CD1 4.46Å; V311-Y330 HydrophobicContact CG1-CD1 3.67Å; V311-Y330 HydrophobicContact CG1-CE1 4.04Å; H317-Y330 HydrophobicContact CB-CD1 4.36Å; H317-Y330 HydrophobicContact CB-CD2 4.01Å; H317-Y330 HydrophobicContact CB-CE1 4.18Å; H317-Y330 HydrophobicContact CB-CE2 3.81Å; H317-Y330 HydrophobicContact CB-CG 4.27Å; R318-Y330 PolarHBondContact N-OH 3.11Å; R318-Y330 VanDerWaalsContact N-OH 3.07Å; C319-Y330 WeakPolarHBondContact SG-CD2 3.15Å; C319-Y330 VanDerWaalsContact SG-CE2 3.55Å; C323-Y330 VanDerWaalsContact SG-CB 3.54Å; H324-Y330 CarbonylContact O-C 3.58Å; H324-Y330 VanDerWaalsContact O-CA 3.23Å; H324-Y330 WeakPolarHBondContact O-CA 3.35Å
331	Q	86.9	Confident	85.7	Confident	107 Å²	107	67.5 Å²	67.5	50%	0.5	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.1	174.1	-174.3	177	26.4	0	0	109.4	H324	H324-Q331 PolarHBondContact N-O 3.37Å; H324-Q331 PolarHBondContact O-N 3.29Å
332	C	91	Very high	85.7	Confident	7 Å²	7	76.2 Å²	76.2	5%	0.047	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	148.5	176.5	-51.1	0	0	0	0	111.7	C319 F322 L340 G344	C319-C332 WeakPolarHBondContact CA-SG 3.25Å; C319-C332 HydrophobicContact CB-CB 3.62Å; C319-C332 WeakPolarHBondContact CB-SG 3.2Å; C319-C332 WeakPolarHBondContact SG-CA 3.39Å; C319-C332 WeakPolarHBondContact SG-CB 3.44Å; C319-C332 CovalentContact SG-SG 2.03Å; C319-C332 PolarHBondContact SG-SG 3.39Å; F322-C332 CarbonylContact O-C 3.49Å; F322-C332 VanDerWaalsContact O-CA 3.3Å; F322-C332 WeakPolarHBondContact O-CA 3.06Å; C332-L340 HydrophobicContact CB-CD1 4.16Å; C332-G344 VanDerWaalsContact CB-O 3.24Å; C332-G344 WeakPolarHBondContact CB-O 3.32Å; C332-G344 PolarHBondContact SG-O 2.89Å
333	S	92.6	Very high	85.7	Confident	34 Å²	34	76.4 Å²	76.4	24%	0.238	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	158.5	170.2	74.5	0	0	0	0	110.8	H321 F322 H324	H321-S333 WeakPolarHBondContact CB-O 2.88Å; F322-S333 PolarHBondContact N-O 3.4Å; F322-S333 PolarHBondContact O-N 3.07Å; H324-S333 PolarHBondContact CD2-OG 3.45Å; H324-S333 PolarHBondContact NE2-OG 2.71Å
334	C	93	Very high	85.8	Confident	30 Å²	30	76.7 Å²	76.7	20%	0.203	42%	0.416	C	S	.	.			trans	-105	160.2	-175	-59.3	0	0	0	0	112.8	R339 L340 C347	C334-R339 VanDerWaalsContact SG-C 3.55Å; C334-L340 WeakPolarHBondContact SG-CA 3.34Å; C334-L340 PolarHBondContact SG-N 3.41Å; C334-L340 VanDerWaalsContact SG-N 3.36Å; C334-C347 WeakPolarHBondContact CA-SG 3.3Å; C334-C347 HydrophobicContact CB-CB 3.84Å; C334-C347 WeakPolarHBondContact CB-SG 3.28Å; C334-C347 VanDerWaalsContact SG-CA 3.5Å; C334-C347 WeakPolarHBondContact SG-CB 3.09Å; C334-C347 CovalentContact SG-SG 2.04Å; C334-C347 PolarHBondContact SG-SG 2.85Å
335	A	90.8	Very high	86	Confident	15 Å²	15	74 Å²	74	12%	0.124	40%	0.403	C	S	.	.			trans	-75.7	161.3	175.2	0	0	0	0	0	110.5	H321 F322 G337 Y338 V523	H321-A335 WeakPolarHBondContact ND1-CB 3.34Å; H321-A335 PolarHBondContact ND1-N 3.27Å; F322-A335 HydrophobicContact CE2-CB 3.91Å; F322-A335 HydrophobicContact CZ-CB 4.2Å; A335-G337 PolarHBondContact O-N 3.13Å; A335-Y338 HydrophobicContact CB-CD2 4.04Å; A335-Y338 HydrophobicContact CB-CE2 4.48Å; A335-Y338 WeakPolarHBondContact O-CB 3.42Å; A335-Y338 PolarHBondContact O-N 3.48Å; A335-V523 HydrophobicContact CB-CG1 3.84Å; A335-V523 HydrophobicContact CB-CG2 4.09Å
336	E	88.7	Confident	86.5	Confident	147 Å²	147	68.2 Å²	68.2	69%	0.687	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	133.2	172.8	-172.9	178.2	-172.3	0	0	110.3
337	G	88.3	Confident	87.3	Confident	21 Å²	21	63.3 Å²	63.3	22%	0.216	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-4.3	-173	0	0	0	0	0	114.9	A335 L350	A335-G337 PolarHBondContact O-N 3.13Å; G337-L350 VanDerWaalsContact O-CB 3.31Å; G337-L350 WeakPolarHBondContact O-CB 3.29Å; G337-L350 WeakPolarHBondContact O-CG 3.38Å; G337-L350 PolarHBondContact O-N 2.87Å
338	Y	91.7	Very high	88.2	Confident	25 Å²	25	60.1 Å²	60.1	10%	0.098	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	151.5	177.7	-63	-102.9	0	0	0	111.6	H321 A335 C347 K348 L349 D565 V608	H321-Y338 AromaticContact CE1-CD1 3.51Å; H321-Y338 AromaticContact CE1-CD2 3.56Å; H321-Y338 AromaticContact CE1-CE1 3.79Å; H321-Y338 AromaticContact CE1-CE2 3.81Å; H321-Y338 AromaticContact CE1-CG 3.41Å; H321-Y338 VanDerWaalsContact CE1-CG 3.41Å; H321-Y338 AromaticContact CE1-CZ 3.93Å; H321-Y338 AromaticContact NE2-CD1 3.99Å; A335-Y338 HydrophobicContact CB-CD2 4.04Å; A335-Y338 HydrophobicContact CB-CE2 4.48Å; A335-Y338 WeakPolarHBondContact O-CB 3.42Å; A335-Y338 PolarHBondContact O-N 3.48Å; Y338-C347 HydrophobicContact CD1-CB 4.37Å; Y338-K348 CarbonylContact C-O 3.51Å; Y338-K348 VanDerWaalsContact CA-O 3.32Å; Y338-K348 WeakPolarHBondContact CA-O 3.49Å; Y338-L349 HydrophobicContact CD1-CB 4.12Å; Y338-L349 HydrophobicContact CD1-CD1 4.11Å; Y338-L349 HydrophobicContact CD2-CD1 4.31Å; Y338-L349 HydrophobicContact CE1-CB 3.95Å; Y338-L349 HydrophobicContact CE1-CD1 3.67Å; Y338-L349 HydrophobicContact CE1-CG 4.42Å; Y338-L349 HydrophobicContact CE2-CD1 3.92Å; Y338-L349 HydrophobicContact CG-CD1 4.39Å; Y338-D565 WeakPolarHBondContact CE1-OD1 3.4Å; Y338-V608 HydrophobicContact CD2-CG1 4.22Å; Y338-V608 HydrophobicContact CE2-CG1 3.52Å
339	R	92.9	Very high	89.3	Confident	119 Å²	119	56.4 Å²	56.4	45%	0.449	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	143.8	171.8	62.1	175.5	-159.2	178.7	10.1	110.9	C334 E341 C347 K348 L350	C334-R339 VanDerWaalsContact SG-C 3.55Å; R339-E341 IonicContact CZ-OE1 3.9Å; R339-E341 VanDerWaalsContact CZ-OE1 3.25Å; R339-E341 IonicContact NE-OE1 3.74Å; R339-E341 PolarHBondContact NE-OE1 2.74Å; R339-E341 IonicContact NH2-OE1 2.79Å; R339-E341 PolarHBondContact NH2-OE1 2.97Å; R339-E341 IonicContact NH2-OE2 4Å; R339-C347 CarbonylContact O-C 3.4Å; R339-C347 WeakPolarHBondContact O-CA 3.1Å; R339-K348 HydrophobicContact CG-CB 4.25Å; R339-K348 WeakPolarHBondContact CG-O 3.19Å; R339-K348 PolarHBondContact N-O 2.84Å; R339-K348 PolarHBondContact O-N 2.86Å; R339-L350 HydrophobicContact CB-CD2 3.78Å; R339-L350 HydrophobicContact CB-CG 4.49Å; R339-L350 HydrophobicContact CG-CD2 3.88Å
340	L	92.7	Very high	89.8	Confident	72 Å²	72	60.7 Å²	60.7	38%	0.377	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128	172	-167.6	69.2	0	0	0	108.9	C332 C334	C332-L340 HydrophobicContact CB-CD1 4.16Å; C334-L340 WeakPolarHBondContact SG-CA 3.34Å; C334-L340 PolarHBondContact SG-N 3.41Å; C334-L340 VanDerWaalsContact SG-N 3.36Å
341	E	91.8	Very high	89.6	Confident	53 Å²	53	61.1 Å²	61.1	25%	0.248	32%	0.317	C	S	.	.			trans	-78	173	176.2	-70.1	-73.2	114.9	0	0	111	R339 D343 G344 S346 K348	R339-E341 IonicContact CZ-OE1 3.9Å; R339-E341 VanDerWaalsContact CZ-OE1 3.25Å; R339-E341 IonicContact NE-OE1 3.74Å; R339-E341 PolarHBondContact NE-OE1 2.74Å; R339-E341 IonicContact NH2-OE1 2.79Å; R339-E341 PolarHBondContact NH2-OE1 2.97Å; R339-E341 IonicContact NH2-OE2 4Å; E341-D343 PolarHBondContact O-N 3.45Å; E341-G344 PolarHBondContact O-N 2.82Å; E341-G344 VanDerWaalsContact O-N 3.09Å; E341-S346 WeakPolarHBondContact CB-O 3.41Å; E341-S346 PolarHBondContact N-O 2.88Å; E341-K348 HydrophobicContact CG-CB 3.69Å; E341-K348 WeakPolarHBondContact OE1-CB 3.28Å; E341-K348 WeakPolarHBondContact OE1-CD 3.47Å
342	H	91.1	Very high	88.7	Confident	197 Å²	197	59.2 Å²	59.2	91%	0.912	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.4	-173.8	-66.5	-62.3	0	0	0	114.5	G344	H342-G344 PolarHBondContact O-N 2.03Å
343	D	90.1	Very high	87.5	Confident	85 Å²	85	67.1 Å²	67.1	46%	0.455	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-13	174.4	64.4	-3.9	0	0	0	112.7	E341 E345 S346	E341-D343 PolarHBondContact O-N 3.45Å; D343-E345 PolarHBondContact O-N 3.02Å; D343-E345 PolarHBondContact OD1-N 2.87Å; D343-S346 PolarHBondContact OD1-N 2.81Å; D343-S346 WeakPolarHBondContact OD2-CB 3.22Å; D343-S346 PolarHBondContact OD2-N 3.24Å; D343-S346 PolarHBondContact OD2-OG 2.61Å
344	G	87.9	Confident	86.5	Confident	31 Å²	31	67.3 Å²	67.3	32%	0.32	35%	0.347	S	S	.	.	S	Bend	trans	71.7	6.8	-177.9	0	0	0	0	0	113.9	C332 E341 H342	C332-G344 VanDerWaalsContact CB-O 3.24Å; C332-G344 WeakPolarHBondContact CB-O 3.32Å; C332-G344 PolarHBondContact SG-O 2.89Å; E341-G344 PolarHBondContact O-N 2.82Å; E341-G344 VanDerWaalsContact O-N 3.09Å; H342-G344 PolarHBondContact O-N 2.03Å
345	E	88.7	Confident	86.3	Confident	35 Å²	35	66 Å²	66	16%	0.164	34%	0.339	C	S	.	.	S	Bend	trans	-124.9	-38.9	-174.5	-70.1	178.5	177.2	0	0	111.9	R318 S320 D343	R318-E345 VanDerWaalsContact CB-CD 3.47Å; R318-E345 HydrophobicContact CB-CG 4.25Å; R318-E345 VanDerWaalsContact CB-OE2 3.23Å; R318-E345 WeakPolarHBondContact CB-OE2 3.5Å; R318-E345 IonicContact CZ-OE2 3.11Å; R318-E345 IonicContact NE-OE2 3.08Å; R318-E345 IonicContact NH1-OE1 3.66Å; R318-E345 PolarHBondContact NH1-OE1 2.83Å; R318-E345 IonicContact NH1-OE2 3.07Å; R318-E345 PolarHBondContact NH1-OE2 2.85Å; R318-E345 IonicContact NH2-OE2 2.62Å; S320-E345 WeakPolarHBondContact CB-O 3.2Å; S320-E345 PolarHBondContact N-O 3Å; D343-E345 PolarHBondContact O-N 3.02Å; D343-E345 PolarHBondContact OD1-N 2.87Å
346	S	89.7	Confident	86.4	Confident	29 Å²	29	70.8 Å²	70.8	20%	0.203	35%	0.354	C	S	.	.			trans	-93.7	140.3	-172.1	-59.7	0	0	0	0	112.4	E341 D343 R584	E341-S346 WeakPolarHBondContact CB-O 3.41Å; E341-S346 PolarHBondContact N-O 2.88Å; D343-S346 PolarHBondContact OD1-N 2.81Å; D343-S346 WeakPolarHBondContact OD2-CB 3.22Å; D343-S346 PolarHBondContact OD2-N 3.24Å; D343-S346 PolarHBondContact OD2-OG 2.61Å; S346-R584 PolarHBondContact OG-NH1 3.24Å
347	C	91.8	Very high	86.7	Confident	9 Å²	9	63.8 Å²	63.8	6%	0.061	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.9	177.4	-68	0	0	0	0	109.3	C334 Y338 R339	C334-C347 WeakPolarHBondContact CA-SG 3.3Å; C334-C347 HydrophobicContact CB-CB 3.84Å; C334-C347 WeakPolarHBondContact CB-SG 3.28Å; C334-C347 VanDerWaalsContact SG-CA 3.5Å; C334-C347 WeakPolarHBondContact SG-CB 3.09Å; C334-C347 CovalentContact SG-SG 2.04Å; C334-C347 PolarHBondContact SG-SG 2.85Å; Y338-C347 HydrophobicContact CD1-CB 4.37Å; R339-C347 CarbonylContact O-C 3.4Å; R339-C347 WeakPolarHBondContact O-CA 3.1Å
348	K	89.4	Confident	87.2	Confident	68 Å²	68	63 Å²	63	30%	0.296	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.3	177.5	-176.3	176	-179.3	175.7	0	110.5	Y338 R339 E341 L350	Y338-K348 CarbonylContact C-O 3.51Å; Y338-K348 VanDerWaalsContact CA-O 3.32Å; Y338-K348 WeakPolarHBondContact CA-O 3.49Å; R339-K348 HydrophobicContact CG-CB 4.25Å; R339-K348 WeakPolarHBondContact CG-O 3.19Å; R339-K348 PolarHBondContact N-O 2.84Å; R339-K348 PolarHBondContact O-N 2.86Å; E341-K348 HydrophobicContact CG-CB 3.69Å; E341-K348 WeakPolarHBondContact OE1-CB 3.28Å; E341-K348 WeakPolarHBondContact OE1-CD 3.47Å; K348-L350 PolarHBondContact O-N 3.06Å
349	L	89	Confident	87.4	Confident	7 Å²	7	61.8 Å²	61.8	4%	0.037	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	131.5	175.4	-169.2	69	0	0	0	111.3	Y338 Q352 F564 V608	Y338-L349 HydrophobicContact CD1-CB 4.12Å; Y338-L349 HydrophobicContact CD1-CD1 4.11Å; Y338-L349 HydrophobicContact CD2-CD1 4.31Å; Y338-L349 HydrophobicContact CE1-CB 3.95Å; Y338-L349 HydrophobicContact CE1-CD1 3.67Å; Y338-L349 HydrophobicContact CE1-CG 4.42Å; Y338-L349 HydrophobicContact CE2-CD1 3.92Å; Y338-L349 HydrophobicContact CG-CD1 4.39Å; L349-Q352 HydrophobicContact CB-CG 4.44Å; L349-Q352 VanDerWaalsContact O-CG 3.27Å; L349-Q352 WeakPolarHBondContact O-CG 3.18Å; L349-F564 HydrophobicContact CD2-CE1 4.05Å; L349-F564 HydrophobicContact CD2-CZ 3.81Å; L349-V608 HydrophobicContact CD1-CB 4.29Å; L349-V608 HydrophobicContact CD1-CG1 4.23Å; L349-V608 HydrophobicContact CD1-CG2 4.26Å
350	L	85.4	Confident	87.6	Confident	114 Å²	114	56.1 Å²	56.1	60%	0.597	29%	0.286	S	S	*	.	S	Bend	trans	-70.8	-47	-178	-73.9	173.5	0	0	0	112.4	G337 R339 K348	G337-L350 VanDerWaalsContact O-CB 3.31Å; G337-L350 WeakPolarHBondContact O-CB 3.29Å; G337-L350 WeakPolarHBondContact O-CG 3.38Å; G337-L350 PolarHBondContact O-N 2.87Å; R339-L350 HydrophobicContact CB-CD2 3.78Å; R339-L350 HydrophobicContact CB-CG 4.49Å; R339-L350 HydrophobicContact CG-CD2 3.88Å; K348-L350 PolarHBondContact O-N 3.06Å
351	D	79.4	Confident	87.7	Confident	79 Å²	79	52.9 Å²	52.9	42%	0.422	27%	0.269	S	S	.	.			trans	-101.4	74.6	178	-170.8	1.7	0	0	0	110.4	Q353 A354 H606	D351-Q353 PolarHBondContact O-N 3.14Å; D351-Q353 PolarHBondContact OD1-N 2.95Å; D351-A354 PolarHBondContact OD1-N 2.86Å; D351-A354 WeakPolarHBondContact OD2-CB 3.4Å; D351-H606 PolarHBondContact O-NE2 2.91Å
352	Q	67.4	Low	87.7	Confident	66 Å²	66	52.1 Å²	52.1	31%	0.308	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-62.5	-29.7	176.1	-62	-161.1	-67.5	0	0	111.4	L349 A354 N371	L349-Q352 HydrophobicContact CB-CG 4.44Å; L349-Q352 VanDerWaalsContact O-CG 3.27Å; L349-Q352 WeakPolarHBondContact O-CG 3.18Å; Q352-A354 VanDerWaalsContact C-N 3.33Å; Q352-A354 PolarHBondContact O-N 2.9Å; Q352-N371 VanDerWaalsContact CB-ND2 3.32Å; Q352-N371 WeakPolarHBondContact CB-ND2 3Å; Q352-N371 WeakPolarHBondContact CB-OD1 3.49Å; Q352-N371 PolarHBondContact O-ND2 3.04Å; Q352-N371 PolarHBondContact O-OD1 3.1Å; Q352-N371 VanDerWaalsContact O-OD1 3.09Å
353	Q	65.9	Low	87.9	Confident	174 Å²	174	46.1 Å²	46.1	81%	0.813	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-77.3	-14.4	-168.4	-67.7	-174.8	-5.1	0	0	114.3	D351 N371	D351-Q353 PolarHBondContact O-N 3.14Å; D351-Q353 PolarHBondContact OD1-N 2.95Å; Q353-N371 PolarHBondContact N-ND2 3.13Å
354	A	70.8	Confident	88.1	Confident	37 Å²	37	44 Å²	44	31%	0.306	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-94.2	-2.6	-173.5	0	0	0	0	0	115.4	D351 Q352	D351-A354 PolarHBondContact OD1-N 2.86Å; D351-A354 WeakPolarHBondContact OD2-CB 3.4Å; Q352-A354 VanDerWaalsContact C-N 3.33Å; Q352-A354 PolarHBondContact O-N 2.9Å
355	G	88.4	Confident	88.5	Confident	3 Å²	3	42.5 Å²	42.5	3%	0.031	21%	0.211	C	C	.	.			trans	-90	137.7	-171.4	0	0	0	0	0	115.1	L370	G355-L370 PolarHBondContact O-N 3.02Å
356	R	93.6	Very high	88.9	Confident	116 Å²	116	42.2 Å²	42.2	44%	0.438	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	138.9	171.2	-58.2	172.2	177.6	-175.8	-5	111.7	L358 V368 D605	R356-L358 HydrophobicContact CB-CD2 4.35Å; R356-V368 CarbonylContact C-O 3.5Å; R356-V368 VanDerWaalsContact CA-O 3.26Å; R356-V368 WeakPolarHBondContact CA-O 3.19Å; R356-D605 HydrophobicContact CB-CB 4.23Å; R356-D605 PolarHBondContact N-O 2.78Å; R356-D605 PolarHBondContact O-N 3.05Å
357	L	95.8	Very high	89.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	124.4	165.2	-174.5	68.4	0	0	0	108.1	F359 S367 V368 L370 V562 F569 V578 V592 V602 I604	L357-F359 HydrophobicContact CD2-CD1 4.44Å; L357-F359 HydrophobicContact CG-CD1 4.29Å; L357-S367 CarbonylContact O-C 3.53Å; L357-S367 WeakPolarHBondContact O-CA 3.16Å; L357-V368 PolarHBondContact N-O 2.79Å; L357-V368 PolarHBondContact O-N 3.27Å; L357-L370 HydrophobicContact CB-CD2 3.88Å; L357-V562 HydrophobicContact CD1-CG2 4.11Å; L357-F569 HydrophobicContact CD1-CB 4.2Å; L357-F569 HydrophobicContact CD1-CD2 4.3Å; L357-F569 HydrophobicContact CD1-CG 4.11Å; L357-F569 HydrophobicContact CD2-CD1 4.05Å; L357-F569 HydrophobicContact CD2-CG 4.29Å; L357-V578 HydrophobicContact CD2-CG1 3.9Å; L357-V592 HydrophobicContact CD2-CB 4.46Å; L357-V592 HydrophobicContact CD2-CG1 3.92Å; L357-V592 HydrophobicContact CD2-CG2 4.35Å; L357-V602 HydrophobicContact CD1-CG1 3.68Å; L357-V602 HydrophobicContact CG-CG1 4.4Å; L357-I604 HydrophobicContact CD1-CD1 3.52Å
358	L	97.1	Very high	89.1	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140	175.4	-51.7	-176.9	0	0	0	108.9	R356 R366 I382 L393 H395 V602 A603 D605	R356-L358 HydrophobicContact CB-CD2 4.35Å; L358-R366 WeakPolarHBondContact CA-O 3.12Å; L358-I382 HydrophobicContact CD1-CD1 4.46Å; L358-I382 HydrophobicContact CD2-CD1 3.92Å; L358-L393 HydrophobicContact CB-CD2 3.99Å; L358-H395 HydrophobicContact CD1-CB 3.89Å; L358-V602 CarbonylContact O-C 3.58Å; L358-V602 WeakPolarHBondContact O-CA 3.36Å; L358-A603 HydrophobicContact CB-CB 4.34Å; L358-A603 PolarHBondContact N-O 2.88Å; L358-A603 PolarHBondContact O-N 2.98Å; L358-D605 HydrophobicContact CD1-CB 4.24Å; L358-D605 HydrophobicContact CG-CB 4.39Å
359	F	97.1	Very high	89.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	149.9	174.3	53.6	-84.8	0	0	0	110.8	L357 V361 R366 V368 V578 Q593 G601 V602	L357-F359 HydrophobicContact CD2-CD1 4.44Å; L357-F359 HydrophobicContact CG-CD1 4.29Å; F359-V361 HydrophobicContact CD2-CG2 3.69Å; F359-V361 HydrophobicContact CE2-CG2 3.76Å; F359-R366 HydrophobicContact CD2-CB 4.27Å; F359-R366 HydrophobicContact CE1-CB 4.31Å; F359-R366 HydrophobicContact CE2-CB 3.74Å; F359-R366 HydrophobicContact CE2-CG 4.38Å; F359-R366 HydrophobicContact CZ-CB 3.75Å; F359-R366 PolarHBondContact N-O 2.91Å; F359-R366 PolarHBondContact O-N 2.92Å; F359-V368 HydrophobicContact CE1-CB 4.29Å; F359-V368 HydrophobicContact CE1-CG2 3.75Å; F359-V368 HydrophobicContact CZ-CG2 4.04Å; F359-V578 HydrophobicContact CB-CG2 4Å; F359-V578 HydrophobicContact CD1-CG2 4.1Å; F359-V578 HydrophobicContact CD2-CG2 3.65Å; F359-V578 HydrophobicContact CE2-CG2 4.13Å; F359-V578 HydrophobicContact CG-CG2 3.65Å; F359-Q593 HydrophobicContact CZ-CB 4.03Å; F359-Q593 VanDerWaalsContact CZ-CD 3.42Å; F359-Q593 HydrophobicContact CZ-CG 4.27Å; F359-Q593 VanDerWaalsContact CZ-OE1 3.29Å; F359-G601 CarbonylContact C-O 3.52Å; F359-G601 WeakPolarHBondContact CA-O 3.34Å; F359-V602 HydrophobicContact CB-CG2 4.25Å
360	S	96.2	Very high	89.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.5	176.6	55.4	0	0	0	0	111.8	Q364 I390 A599 Y600 G601	S360-Q364 CarbonylContact C-O 3.59Å; S360-Q364 WeakPolarHBondContact CA-O 3.26Å; S360-I390 VanDerWaalsContact CB-CG2 3.49Å; S360-I390 PolarHBondContact OG-O 2.03Å; S360-A599 CarbonylContact O-C 3.54Å; S360-A599 VanDerWaalsContact O-CA 3.23Å; S360-A599 WeakPolarHBondContact O-CA 3.12Å; S360-Y600 PolarHBondContact O-N 2.89Å; S360-Y600 WeakPolarHBondContact OG-CB 3.48Å; S360-G601 PolarHBondContact N-O 3.28Å; S360-G601 PolarHBondContact OG-N 3.48Å
361	V	94.9	Very high	89.1	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.024	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	114.5	172.3	-175	0	0	0	0	108	F359 Q363 Q364 F595 Q598 A599	F359-V361 HydrophobicContact CD2-CG2 3.69Å; F359-V361 HydrophobicContact CE2-CG2 3.76Å; V361-Q363 PolarHBondContact O-N 3.44Å; V361-Q364 PolarHBondContact N-O 2.98Å; V361-Q364 PolarHBondContact O-N 3.01Å; V361-F595 HydrophobicContact CG1-CB 4.2Å; V361-F595 HydrophobicContact CG1-CD2 3.8Å; V361-F595 HydrophobicContact CG1-CE2 4.42Å; V361-F595 HydrophobicContact CG1-CG 3.93Å; V361-F595 HydrophobicContact CG2-CD1 3.88Å; V361-F595 HydrophobicContact CG2-CD2 4.41Å; V361-F595 HydrophobicContact CG2-CE1 4.17Å; V361-F595 HydrophobicContact CG2-CG 4.04Å; V361-Q598 CarbonylContact C-O 3.58Å; V361-Q598 WeakPolarHBondContact CA-O 3.22Å; V361-A599 HydrophobicContact CG2-CB 4.37Å
362	D	92.9	Very high	88.8	Confident	38 Å²	38	37.4 Å²	37.4	20%	0.203	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	-108.7	-172.9	-62.2	-60.7	0	0	0	111.6	R389 I390 G597 Q598	D362-R389 CarbonylContact O-C 3.57Å; D362-R389 VanDerWaalsContact O-CA 3.25Å; D362-R389 WeakPolarHBondContact O-CA 3.1Å; D362-R389 IonicContact OD1-NE 3.34Å; D362-I390 PolarHBondContact O-N 3.11Å; D362-G597 WeakPolarHBondContact OD2-CA 3.42Å; D362-Q598 PolarHBondContact N-O 2.95Å; D362-Q598 PolarHBondContact OD2-N 2.94Å
363	Q	93.8	Very high	88.8	Confident	70 Å²	70	44 Å²	44	33%	0.327	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-0.1	-178	62.9	-146.9	71.9	0	0	114.8	V361 T385 S386	V361-Q363 PolarHBondContact O-N 3.44Å; Q363-T385 WeakPolarHBondContact CB-OG1 3.31Å; Q363-T385 PolarHBondContact O-N 2.88Å; Q363-T385 PolarHBondContact O-OG1 2.86Å; Q363-S386 PolarHBondContact NE2-O 2.75Å
364	Q	95.5	Very high	88.5	Confident	40 Å²	40	43.4 Å²	43.4	19%	0.187	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	146.2	-172.8	-65.8	-177.8	-21.3	0	0	111.7	S360 V361 R366 V381 L383 D384	S360-Q364 CarbonylContact C-O 3.59Å; S360-Q364 WeakPolarHBondContact CA-O 3.26Å; V361-Q364 PolarHBondContact N-O 2.98Å; V361-Q364 PolarHBondContact O-N 3.01Å; Q364-R366 VanDerWaalsContact OE1-NH2 3.16Å; Q364-V381 HydrophobicContact CB-CG1 4.2Å; Q364-V381 HydrophobicContact CG-CG1 4.12Å; Q364-L383 CarbonylContact C-O 3.57Å; Q364-L383 VanDerWaalsContact CA-O 3.26Å; Q364-L383 WeakPolarHBondContact CA-O 3.38Å; Q364-D384 HydrophobicContact CG-CB 4.27Å; Q364-D384 PolarHBondContact NE2-OD2 3.19Å
365	V	96.5	Very high	88	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124.1	157.9	-173.8	0	0	0	0	108.1	I382 L383 I390 L393 F413	V365-I382 HydrophobicContact CB-CD1 4.43Å; V365-I382 HydrophobicContact CB-CG1 3.91Å; V365-I382 HydrophobicContact CG1-CD1 3.79Å; V365-I382 HydrophobicContact CG1-CG1 3.78Å; V365-I382 WeakPolarHBondContact O-CG1 3.45Å; V365-I382 PolarHBondContact O-N 3.08Å; V365-L383 HydrophobicContact CB-CB 4.03Å; V365-L383 HydrophobicContact CG2-CB 4.04Å; V365-L383 HydrophobicContact CG2-CD2 4.03Å; V365-L383 PolarHBondContact N-O 3.45Å; V365-L383 PolarHBondContact O-N 2.99Å; V365-I390 HydrophobicContact CG2-CD1 3.48Å; V365-I390 VanDerWaalsContact CG2-CD1 3.48Å; V365-L393 HydrophobicContact CG1-CD1 4.27Å; V365-L393 HydrophobicContact CG1-CD2 3.79Å; V365-L393 HydrophobicContact CG2-CD1 4.25Å; V365-F413 HydrophobicContact CB-CZ 4.18Å; V365-F413 HydrophobicContact CG1-CZ 4.15Å; V365-F413 HydrophobicContact CG2-CE1 4.09Å; V365-F413 HydrophobicContact CG2-CZ 4.09Å
366	R	95.3	Very high	86.9	Confident	30 Å²	30	51.4 Å²	51.4	11%	0.113	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	150.3	177.5	-64.9	179.3	179.3	-171.8	-0.1	109.7	L358 F359 Q364 Y379 S380 V381 Q593	L358-R366 WeakPolarHBondContact CA-O 3.12Å; F359-R366 HydrophobicContact CD2-CB 4.27Å; F359-R366 HydrophobicContact CE1-CB 4.31Å; F359-R366 HydrophobicContact CE2-CB 3.74Å; F359-R366 HydrophobicContact CE2-CG 4.38Å; F359-R366 HydrophobicContact CZ-CB 3.75Å; F359-R366 PolarHBondContact N-O 2.91Å; F359-R366 PolarHBondContact O-N 2.92Å; Q364-R366 VanDerWaalsContact OE1-NH2 3.16Å; R366-Y379 HydrophobicContact CB-CD2 4.27Å; R366-Y379 HydrophobicContact CG-CD2 3.89Å; R366-Y379 HydrophobicContact CG-CE2 4.27Å; R366-S380 CarbonylContact C-O 3.54Å; R366-S380 WeakPolarHBondContact CA-O 3.06Å; R366-V381 HydrophobicContact CG-CG2 4.35Å; R366-Q593 VanDerWaalsContact CD-OE1 3.3Å
367	S	94.5	Very high	85.9	Confident	5 Å²	5	46.4 Å²	46.4	4%	0.035	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136	172.3	70	0	0	0	0	110.9	L357 Y379 S380	L357-S367 CarbonylContact O-C 3.53Å; L357-S367 WeakPolarHBondContact O-CA 3.16Å; S367-Y379 WeakPolarHBondContact O-CA 3.08Å; S367-S380 PolarHBondContact N-O 3.4Å; S367-S380 PolarHBondContact O-N 2.81Å; S367-S380 PolarHBondContact OG-O 2.7Å; S367-S380 PolarHBondContact OG-OG 2.95Å
368	V	93.3	Very high	85.4	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.9	175.5	165.7	0	0	0	0	108.2	R356 L357 F359 W372 A377 V592	R356-V368 CarbonylContact C-O 3.5Å; R356-V368 VanDerWaalsContact CA-O 3.26Å; R356-V368 WeakPolarHBondContact CA-O 3.19Å; L357-V368 PolarHBondContact N-O 2.79Å; L357-V368 PolarHBondContact O-N 3.27Å; F359-V368 HydrophobicContact CE1-CB 4.29Å; F359-V368 HydrophobicContact CE1-CG2 3.75Å; F359-V368 HydrophobicContact CZ-CG2 4.04Å; V368-W372 HydrophobicContact CG1-CE3 4.35Å; V368-A377 HydrophobicContact CG1-CB 3.33Å; V368-A377 HydrophobicContact CG2-CB 4.46Å; V368-V592 HydrophobicContact CG1-CG1 4.04Å
369	S	91.2	Very high	85.1	Confident	57 Å²	57	58.2 Å²	58.2	40%	0.399	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	138.1	173.6	178.2	0	0	0	0	109.8	N371	S369-N371 PolarHBondContact O-N 3.3Å; S369-N371 PolarHBondContact OG-N 3.01Å
370	L	89	Confident	84.8	Confident	29 Å²	29	61.1 Å²	61.1	15%	0.152	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.7	175	-71.8	172.5	0	0	0	114	G355 L357 W372 F564 F569 I604	G355-L370 PolarHBondContact O-N 3.02Å; L357-L370 HydrophobicContact CB-CD2 3.88Å; L370-W372 VanDerWaalsContact C-CE3 3.49Å; L370-W372 HydrophobicContact CD2-CZ3 4.04Å; L370-F564 HydrophobicContact CD1-CD1 3.56Å; L370-F564 HydrophobicContact CD1-CE1 3.52Å; L370-F564 HydrophobicContact CD1-CZ 4.48Å; L370-F569 HydrophobicContact CD2-CE2 4.4Å; L370-F569 HydrophobicContact CD2-CZ 4.22Å; L370-I604 HydrophobicContact CD1-CD1 4.39Å; L370-I604 HydrophobicContact CD1-CG2 4.41Å; L370-I604 HydrophobicContact CD2-CD1 4.35Å
371	N	82.7	Confident	84.7	Confident	60 Å²	60	64.1 Å²	64.1	32%	0.321	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	23.2	-175.9	-99.4	7.2	0	0	0	114.9	Q352 Q353 S369	Q352-N371 VanDerWaalsContact CB-ND2 3.32Å; Q352-N371 WeakPolarHBondContact CB-ND2 3Å; Q352-N371 WeakPolarHBondContact CB-OD1 3.49Å; Q352-N371 PolarHBondContact O-ND2 3.04Å; Q352-N371 PolarHBondContact O-OD1 3.1Å; Q352-N371 VanDerWaalsContact O-OD1 3.09Å; Q353-N371 PolarHBondContact N-ND2 3.13Å; S369-N371 PolarHBondContact O-N 3.3Å; S369-N371 PolarHBondContact OG-N 3.01Å
372	W	74	Confident	84.7	Confident	52 Å²	52	67.1 Å²	67.1	20%	0.197	35%	0.345	C	S	.	.			trans	-69.3	145	-176.7	74.8	94.5	0	0	0	111.6	V368 L370 A377 F569 K580 V592	V368-W372 HydrophobicContact CG1-CE3 4.35Å; L370-W372 VanDerWaalsContact C-CE3 3.49Å; L370-W372 HydrophobicContact CD2-CZ3 4.04Å; W372-A377 HydrophobicContact CB-CB 3.65Å; W372-A377 HydrophobicContact CD2-CB 4.19Å; W372-A377 HydrophobicContact CG-CB 3.69Å; W372-F569 AromaticContact CH2-CE1 3.65Å; W372-F569 HydrophobicContact CH2-CE1 3.65Å; W372-F569 HydrophobicContact CH2-CZ 4.24Å; W372-F569 HydrophobicContact CZ2-CE1 4.48Å; W372-K580 HydrophobicContact CH2-CD 4.36Å; W372-K580 HydrophobicContact CZ2-CD 3.78Å; W372-V592 HydrophobicContact CH2-CB 4.22Å; W372-V592 HydrophobicContact CH2-CG1 3.53Å; W372-V592 HydrophobicContact CH2-CG2 3.79Å; W372-V592 HydrophobicContact CZ2-CB 3.98Å; W372-V592 HydrophobicContact CZ2-CG1 3.54Å; W372-V592 HydrophobicContact CZ2-CG2 3.67Å; W372-V592 HydrophobicContact CZ3-CG1 4.2Å
373	K	65.6	Low	84.8	Confident	203 Å²	203	66.5 Å²	66.5	88%	0.883	34%	0.342	S	S	*	.			trans	-103.2	-17.1	-175.6	-66.2	-172.3	176.8	-178.3	0	114.2
374	E	60.9	Low	84.8	Confident	162 Å²	162	66.5 Å²	66.5	76%	0.757	34%	0.344	S	S	*	.	S	Bend	trans	-132.6	149.3	-171.4	-65.6	178.4	-174.9	0	0	110.8	G376	E374-G376 PolarHBondContact O-N 2.97Å
375	E	60.4	Low	84.6	Confident	162 Å²	162	65.3 Å²	65.3	76%	0.757	34%	0.34	S	S	*	.	S	Bend	trans	-58.4	133.5	175.6	-70.6	179.5	169	0	0	111.4
376	G	64.4	Low	84	Confident	46 Å²	46	70 Å²	70	47%	0.474	37%	0.372	S	S	.	.	S	Bend	trans	83.3	63.6	-176	0	0	0	0	0	113	E374	E374-G376 PolarHBondContact O-N 2.97Å
377	A	73.5	Confident	83.4	Confident	11 Å²	11	73.3 Å²	73.3	9%	0.091	40%	0.4	C	S	.	.			trans	-62.5	140.3	-177.2	0	0	0	0	0	112.6	V368 W372 V592	V368-A377 HydrophobicContact CG1-CB 3.33Å; V368-A377 HydrophobicContact CG2-CB 4.46Å; W372-A377 HydrophobicContact CB-CB 3.65Å; W372-A377 HydrophobicContact CD2-CB 4.19Å; W372-A377 HydrophobicContact CG-CB 3.69Å; A377-V592 PolarHBondContact N-O 2.85Å; A377-V592 VanDerWaalsContact N-O 3.13Å
378	D	84	Confident	83.2	Confident	148 Å²	148	74.5 Å²	74.5	79%	0.791	41%	0.407	S	S	*	.			trans	-60.2	142.7	173	-169.8	22.8	0	0	0	110.5
379	Y	90.5	Very high	83.2	Confident	104 Å²	104	81.5 Å²	81.5	41%	0.408	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.3	-173.1	72.1	-87.7	0	0	0	112.1	R366 S367 V381	R366-Y379 HydrophobicContact CB-CD2 4.27Å; R366-Y379 HydrophobicContact CG-CD2 3.89Å; R366-Y379 HydrophobicContact CG-CE2 4.27Å; S367-Y379 WeakPolarHBondContact O-CA 3.08Å; Y379-V381 HydrophobicContact CD2-CG2 4.33Å; Y379-V381 HydrophobicContact CE2-CG2 3.97Å
380	S	92.5	Very high	83.4	Confident	60 Å²	60	78.8 Å²	78.8	42%	0.42	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.3	168.5	53	0	0	0	0	110.8	R366 S367 I382	R366-S380 CarbonylContact C-O 3.54Å; R366-S380 WeakPolarHBondContact CA-O 3.06Å; S367-S380 PolarHBondContact N-O 3.4Å; S367-S380 PolarHBondContact O-N 2.81Å; S367-S380 PolarHBondContact OG-O 2.7Å; S367-S380 PolarHBondContact OG-OG 2.95Å; S380-I382 PolarHBondContact O-N 3.44Å
381	V	93.8	Very high	83.7	Confident	63 Å²	63	79.8 Å²	79.8	38%	0.382	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	116.6	168.9	-179	0	0	0	0	107.9	Q364 R366 Y379 L383 D384	Q364-V381 HydrophobicContact CB-CG1 4.2Å; Q364-V381 HydrophobicContact CG-CG1 4.12Å; R366-V381 HydrophobicContact CG-CG2 4.35Å; Y379-V381 HydrophobicContact CD2-CG2 4.33Å; Y379-V381 HydrophobicContact CE2-CG2 3.97Å; V381-L383 WeakPolarHBondContact CG1-O 3.5Å; V381-D384 HydrophobicContact CG1-CB 4.33Å
382	I	94.7	Very high	84.3	Confident	67 Å²	67	76.9 Å²	76.9	34%	0.344	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-17.8	-179.1	62.4	171.3	0	0	0	112.8	L358 V365 S380 F413	L358-I382 HydrophobicContact CD1-CD1 4.46Å; L358-I382 HydrophobicContact CD2-CD1 3.92Å; V365-I382 HydrophobicContact CB-CD1 4.43Å; V365-I382 HydrophobicContact CB-CG1 3.91Å; V365-I382 HydrophobicContact CG1-CD1 3.79Å; V365-I382 HydrophobicContact CG1-CG1 3.78Å; V365-I382 WeakPolarHBondContact O-CG1 3.45Å; V365-I382 PolarHBondContact O-N 3.08Å; S380-I382 PolarHBondContact O-N 3.44Å; I382-F413 HydrophobicContact CD1-CE2 3.9Å; I382-F413 HydrophobicContact CD1-CZ 3.95Å; I382-F413 HydrophobicContact CG1-CE2 4.12Å; I382-F413 HydrophobicContact CG1-CZ 4.25Å
383	L	95.5	Very high	85.4	Confident	26 Å²	26	74.6 Å²	74.6	14%	0.136	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	139.2	173.1	179.2	69.1	0	0	0	109.3	Q364 V365 V381 T385 I390 Y404 F413 E418	Q364-L383 CarbonylContact C-O 3.57Å; Q364-L383 VanDerWaalsContact CA-O 3.26Å; Q364-L383 WeakPolarHBondContact CA-O 3.38Å; V365-L383 HydrophobicContact CB-CB 4.03Å; V365-L383 HydrophobicContact CG2-CB 4.04Å; V365-L383 HydrophobicContact CG2-CD2 4.03Å; V365-L383 PolarHBondContact N-O 3.45Å; V365-L383 PolarHBondContact O-N 2.99Å; V381-L383 WeakPolarHBondContact CG1-O 3.5Å; L383-T385 HydrophobicContact CD2-CG2 4.24Å; L383-T385 HydrophobicContact CG-CG2 4.39Å; L383-I390 HydrophobicContact CD2-CD1 4.11Å; L383-Y404 HydrophobicContact CD2-CD1 4.36Å; L383-Y404 HydrophobicContact CD2-CE1 3.75Å; L383-Y404 HydrophobicContact CD2-CE2 3.96Å; L383-F413 HydrophobicContact CB-CD2 4.4Å; L383-F413 HydrophobicContact CB-CE1 4.4Å; L383-F413 HydrophobicContact CB-CE2 4.12Å; L383-F413 HydrophobicContact CB-CZ 4.09Å; L383-F413 HydrophobicContact CD2-CD1 3.67Å; L383-F413 HydrophobicContact CD2-CE1 3.71Å; L383-F413 HydrophobicContact CD2-CG 4.1Å; L383-F413 HydrophobicContact CD2-CZ 4.26Å; L383-E418 HydrophobicContact CD1-CG 4.39Å
384	D	93.9	Very high	87	Confident	70 Å²	70	66.2 Å²	66.2	37%	0.374	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	119.8	167.9	-168.2	-35.3	0	0	0	108.8	Q364 V381 S386	Q364-D384 HydrophobicContact CG-CB 4.27Å; Q364-D384 PolarHBondContact NE2-OD2 3.19Å; V381-D384 HydrophobicContact CG1-CB 4.33Å; D384-S386 VanDerWaalsContact C-N 3.27Å; D384-S386 PolarHBondContact O-N 3.01Å; D384-S386 WeakPolarHBondContact OD1-CA 3.34Å; D384-S386 PolarHBondContact OD1-N 2.65Å
385	T	91	Very high	88.7	Confident	15 Å²	15	58.9 Å²	58.9	9%	0.092	33%	0.326	C	S	.	.			trans	-86.4	2	-175.5	68.7	0	0	0	0	112.8	Q363 L383 S387 T388 I390 Y404	Q363-T385 WeakPolarHBondContact CB-OG1 3.31Å; Q363-T385 PolarHBondContact O-N 2.88Å; Q363-T385 PolarHBondContact O-OG1 2.86Å; L383-T385 HydrophobicContact CD2-CG2 4.24Å; L383-T385 HydrophobicContact CG-CG2 4.39Å; T385-S387 PolarHBondContact O-N 3.05Å; T385-T388 PolarHBondContact OG1-N 3.32Å; T385-T388 PolarHBondContact OG1-O 3.15Å; T385-T388 PolarHBondContact OG1-OG1 3.06Å; T385-I390 HydrophobicContact CG2-CD1 3.76Å; T385-I390 HydrophobicContact CG2-CG1 3.89Å; T385-Y404 HydrophobicContact CG2-CE2 4.16Å
386	S	83.5	Confident	90.5	Very high	97 Å²	97	51.2 Å²	51.2	68%	0.678	29%	0.291	S	S	*	.	S	Bend	trans	66	-30	179.7	-52.6	0	0	0	0	117	Q363 D384	Q363-S386 PolarHBondContact NE2-O 2.75Å; D384-S386 VanDerWaalsContact C-N 3.27Å; D384-S386 PolarHBondContact O-N 3.01Å; D384-S386 WeakPolarHBondContact OD1-CA 3.34Å; D384-S386 PolarHBondContact OD1-N 2.65Å
387	S	82.1	Confident	91.8	Very high	101 Å²	101	49.6 Å²	49.6	71%	0.706	27%	0.272	S	S	*	.	S	Bend	trans	-153.2	-7.5	-175	71.2	0	0	0	0	117.3	T385	T385-S387 PolarHBondContact O-N 3.05Å
388	T	90.5	Very high	92.7	Very high	29 Å²	29	55.8 Å²	55.8	18%	0.178	29%	0.293	C	S	.	.			trans	-123.2	130.8	-171.8	44.1	0	0	0	0	111.1	T385 R406	T385-T388 PolarHBondContact OG1-N 3.32Å; T385-T388 PolarHBondContact OG1-O 3.15Å; T385-T388 PolarHBondContact OG1-OG1 3.06Å; T388-R406 WeakPolarHBondContact OG1-CD 3.33Å
389	R	93.8	Very high	93.1	Very high	150 Å²	150	52.6 Å²	52.6	57%	0.566	27%	0.274	S	S	*	.			trans	-66.6	141.1	179.7	-58.7	-167.8	-169.7	116.6	-0.5	111	D362 L391 Y600	D362-R389 CarbonylContact O-C 3.57Å; D362-R389 VanDerWaalsContact O-CA 3.25Å; D362-R389 WeakPolarHBondContact O-CA 3.1Å; D362-R389 IonicContact OD1-NE 3.34Å; R389-L391 HydrophobicContact CB-CD2 4.42Å; R389-Y600 HydrophobicContact CB-CE2 4.42Å; R389-Y600 WeakPolarHBondContact CD-OH 3.48Å
390	I	95.6	Very high	93.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.5	173.7	-61.2	176.8	0	0	0	107.3	S360 D362 V365 L383 T385 Y404 T405 R406 Y600	S360-I390 VanDerWaalsContact CB-CG2 3.49Å; S360-I390 PolarHBondContact OG-O 2.03Å; D362-I390 PolarHBondContact O-N 3.11Å; V365-I390 HydrophobicContact CG2-CD1 3.48Å; V365-I390 VanDerWaalsContact CG2-CD1 3.48Å; L383-I390 HydrophobicContact CD2-CD1 4.11Å; T385-I390 HydrophobicContact CG2-CD1 3.76Å; T385-I390 HydrophobicContact CG2-CG1 3.89Å; I390-Y404 HydrophobicContact CB-CD2 4.37Å; I390-Y404 HydrophobicContact CD1-CD2 4.1Å; I390-Y404 HydrophobicContact CD1-CE2 4.16Å; I390-Y404 HydrophobicContact CG1-CD2 3.9Å; I390-Y404 HydrophobicContact CG1-CE2 4.06Å; I390-Y404 HydrophobicContact CG2-CD2 3.79Å; I390-Y404 HydrophobicContact CG2-CG 4.3Å; I390-T405 WeakPolarHBondContact CA-O 3.36Å; I390-R406 HydrophobicContact CG1-CG 4.46Å; I390-Y600 WeakPolarHBondContact O-CB 3.46Å; I390-Y600 WeakPolarHBondContact O-CD2 3.35Å
391	L	93.8	Very high	93.5	Very high	49 Å²	49	55 Å²	55	26%	0.257	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-34	-170.6	-59	177.1	0	0	0	113.4	R389 T405 F559 Y600	R389-L391 HydrophobicContact CB-CD2 4.42Å; L391-T405 PolarHBondContact N-O 3.36Å; L391-T405 VanDerWaalsContact N-O 3.14Å; L391-F559 WeakPolarHBondContact O-CE1 3.47Å; L391-F559 WeakPolarHBondContact O-CZ 3.45Å; L391-Y600 HydrophobicContact CD2-CD1 4.34Å; L391-Y600 HydrophobicContact CD2-CE1 4.18Å; L391-Y600 VanDerWaalsContact O-CB 3.31Å; L391-Y600 WeakPolarHBondContact O-CB 3.33Å
392	S	96.4	Very high	93.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	154.9	176.2	67.8	0	0	0	0	110.4	Y404 T405	S392-Y404 WeakPolarHBondContact O-CA 3.5Å; S392-Y404 WeakPolarHBondContact O-CB 3.37Å; S392-T405 PolarHBondContact N-OG1 2.89Å; S392-T405 PolarHBondContact O-N 3.01Å; S392-T405 VanDerWaalsContact O-N 3.14Å; S392-T405 WeakPolarHBondContact OG-CG2 3.36Å; S392-T405 PolarHBondContact OG-OG1 3.17Å
393	L	97.9	Very high	93.9	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	132.8	-173.4	178.9	68.1	0	0	0	109.4	L358 V365 Y403 F413 A603	L358-L393 HydrophobicContact CB-CD2 3.99Å; V365-L393 HydrophobicContact CG1-CD1 4.27Å; V365-L393 HydrophobicContact CG1-CD2 3.79Å; V365-L393 HydrophobicContact CG2-CD1 4.25Å; L393-Y403 CarbonylContact C-O 3.46Å; L393-Y403 WeakPolarHBondContact CA-O 3.42Å; L393-F413 HydrophobicContact CD1-CE1 4.36Å; L393-A603 HydrophobicContact CD2-CB 4.41Å; L393-A603 HydrophobicContact CG-CB 4.25Å
394	D	98	Very high	94	Very high	27 Å²	27	47.9 Å²	47.9	14%	0.144	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	159.6	167.2	-167.1	10.9	0	0	0	109.6	S402 Y403 I431 A432 V433	D394-S402 CarbonylContact O-C 3.58Å; D394-S402 WeakPolarHBondContact O-CA 3.33Å; D394-Y403 PolarHBondContact N-O 3.46Å; D394-Y403 PolarHBondContact O-N 3.22Å; D394-Y403 VanDerWaalsContact O-O 3.13Å; D394-I431 HydrophobicContact CB-CG1 4.45Å; D394-A432 WeakPolarHBondContact OD2-CA 3.35Å; D394-V433 HydrophobicContact CB-CG2 4.19Å; D394-V433 WeakPolarHBondContact OD2-CB 3.47Å; D394-V433 PolarHBondContact OD2-N 3.03Å
395	H	97.5	Very high	94.1	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.037	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	136.8	-173.1	-173.7	77	0	0	0	112.3	L358 R401 S402 A603 D605 Q610	L358-H395 HydrophobicContact CD1-CB 3.89Å; H395-R401 PolarHBondContact ND1-O 3.26Å; H395-S402 PolarHBondContact ND1-OG 3.43Å; H395-A603 HydrophobicContact CB-CB 4.17Å; H395-D605 IonicContact CD2-OD1 2.77Å; H395-D605 IonicContact NE2-OD1 3.61Å; H395-D605 PolarHBondContact NE2-OD1 2.97Å; H395-D605 IonicContact NE2-OD2 3.56Å; H395-Q610 PolarHBondContact O-NE2 2.92Å
396	V	96.8	Very high	94.2	Very high	2 Å²	2	45 Å²	45	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	103.2	172.8	-179.6	0	0	0	0	109.2	R398 E399 R400 R401 Y403 V433 W435	V396-R398 PolarHBondContact O-N 2.59Å; V396-E399 HydrophobicContact CB-CB 4.36Å; V396-E399 HydrophobicContact CG1-CB 3.99Å; V396-E399 HydrophobicContact CG1-CG 3.92Å; V396-E399 PolarHBondContact O-N 3.39Å; V396-E399 VanDerWaalsContact O-N 3.11Å; V396-R400 PolarHBondContact O-N 3.49Å; V396-R401 PolarHBondContact N-O 3.41Å; V396-R401 PolarHBondContact O-N 3.34Å; V396-Y403 HydrophobicContact CB-CE2 4.43Å; V396-Y403 HydrophobicContact CG2-CD2 4.28Å; V396-Y403 HydrophobicContact CG2-CE2 3.77Å; V396-V433 HydrophobicContact CG2-CB 4.13Å; V396-V433 HydrophobicContact CG2-CG1 3.64Å; V396-W435 HydrophobicContact CG1-CB 4.03Å; V396-W435 HydrophobicContact CG2-CB 4.42Å
397	S	93.5	Very high	94.4	Very high	12 Å²	12	47 Å²	47	8%	0.084	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-60.3	-42.1	-171.2	-58.6	0	0	0	0	112.2	E399 R400 H606	S397-E399 VanDerWaalsContact C-N 3.26Å; S397-E399 PolarHBondContact O-N 2.03Å; S397-R400 PolarHBondContact O-N 2.83Å; S397-H606 PolarHBondContact OG-N 3.12Å; S397-H606 VanDerWaalsContact OG-N 3.14Å; S397-H606 PolarHBondContact OG-O 3.22Å
398	R	91.3	Very high	94.9	Very high	141 Å²	141	43.9 Å²	43.9	53%	0.532	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-61.7	-34.7	179.2	-176.7	-178.9	64.2	-168.9	-4.4	112.7	V396 W435 T612	V396-R398 PolarHBondContact O-N 2.59Å; R398-W435 PolarHBondContact NH2-O 3.03Å; R398-T612 HydrophobicContact CB-CG2 4.46Å
399	E	93.2	Very high	95.1	Very high	81 Å²	81	43.4 Å²	43.4	38%	0.379	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-94	-7.8	-177	-65.5	-178.2	-166.9	0	0	112.4	V396 S397 R401	V396-E399 HydrophobicContact CB-CB 4.36Å; V396-E399 HydrophobicContact CG1-CB 3.99Å; V396-E399 HydrophobicContact CG1-CG 3.92Å; V396-E399 PolarHBondContact O-N 3.39Å; V396-E399 VanDerWaalsContact O-N 3.11Å; S397-E399 VanDerWaalsContact C-N 3.26Å; S397-E399 PolarHBondContact O-N 2.03Å; E399-R401 HydrophobicContact CB-CB 4.02Å; E399-R401 PolarHBondContact O-N 2.79Å; E399-R401 IonicContact OE2-NH1 2.76Å
400	R	93.9	Very high	95.2	Very high	145 Å²	145	36.2 Å²	36.2	55%	0.547	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	42.4	-170.7	-63.7	170.2	64	103.6	-8.7	111.1	V396 S397 E415	V396-R400 PolarHBondContact O-N 3.49Å; S397-R400 PolarHBondContact O-N 2.83Å; R400-E415 IonicContact CZ-OE1 3.25Å; R400-E415 IonicContact NE-OE1 2.84Å; R400-E415 PolarHBondContact NE-OE1 2.86Å; R400-E415 IonicContact NH2-OE1 2.83Å; R400-E415 PolarHBondContact NH2-OE1 3.18Å
401	R	96.6	Very high	95.3	Very high	69 Å²	69	38.2 Å²	38.2	26%	0.26	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.3	-173.9	179.5	178.1	-73	170.5	0.4	109.9	H395 V396 E399 Y403 F413 D414	H395-R401 PolarHBondContact ND1-O 3.26Å; V396-R401 PolarHBondContact N-O 3.41Å; V396-R401 PolarHBondContact O-N 3.34Å; E399-R401 HydrophobicContact CB-CB 4.02Å; E399-R401 PolarHBondContact O-N 2.79Å; E399-R401 IonicContact OE2-NH1 2.76Å; R401-Y403 HydrophobicContact CB-CE2 4.41Å; R401-Y403 VanDerWaalsContact CD-CZ 3.5Å; R401-Y403 WeakPolarHBondContact CD-OH 3.23Å; R401-Y403 HydrophobicContact CG-CD2 4.42Å; R401-Y403 HydrophobicContact CG-CE2 3.82Å; R401-F413 WeakPolarHBondContact CA-O 3.37Å; R401-D414 HydrophobicContact CB-CB 4.21Å; R401-D414 HydrophobicContact CG-CB 4.34Å; R401-D414 IonicContact CZ-OD2 3.02Å; R401-D414 IonicContact NE-OD2 3.68Å; R401-D414 PolarHBondContact NE-OD2 3.45Å; R401-D414 IonicContact NH2-OD2 2.98Å; R401-D414 PolarHBondContact NH2-OD2 2.95Å
402	S	97.9	Very high	95.4	Very high	3 Å²	3	36 Å²	36	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	148.6	174.4	-62.6	0	0	0	0	110.4	D394 H395 S412 F413	D394-S402 CarbonylContact O-C 3.58Å; D394-S402 WeakPolarHBondContact O-CA 3.33Å; H395-S402 PolarHBondContact ND1-OG 3.43Å; S402-S412 CarbonylContact O-C 3.56Å; S402-S412 WeakPolarHBondContact O-CA 3.39Å; S402-S412 WeakPolarHBondContact O-CB 3.45Å; S402-F413 PolarHBondContact N-O 2.71Å; S402-F413 PolarHBondContact O-N 2.9Å; S402-F413 WeakPolarHBondContact OG-CZ 3.23Å
403	Y	98.3	Very high	95.4	Very high	3 Å²	3	37 Å²	37	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.8	175.9	-62.8	-97.6	0	0	0	108	L393 D394 V396 R401 Y411 L421 V433 I440	L393-Y403 CarbonylContact C-O 3.46Å; L393-Y403 WeakPolarHBondContact CA-O 3.42Å; D394-Y403 PolarHBondContact N-O 3.46Å; D394-Y403 PolarHBondContact O-N 3.22Å; D394-Y403 VanDerWaalsContact O-O 3.13Å; V396-Y403 HydrophobicContact CB-CE2 4.43Å; V396-Y403 HydrophobicContact CG2-CD2 4.28Å; V396-Y403 HydrophobicContact CG2-CE2 3.77Å; R401-Y403 HydrophobicContact CB-CE2 4.41Å; R401-Y403 VanDerWaalsContact CD-CZ 3.5Å; R401-Y403 WeakPolarHBondContact CD-OH 3.23Å; R401-Y403 HydrophobicContact CG-CD2 4.42Å; R401-Y403 HydrophobicContact CG-CE2 3.82Å; Y403-Y411 CarbonylContact C-O 3.31Å; Y403-Y411 WeakPolarHBondContact CA-O 3.19Å; Y403-L421 HydrophobicContact CD1-CD1 3.69Å; Y403-L421 HydrophobicContact CE1-CD1 3.74Å; Y403-V433 HydrophobicContact CD1-CG2 4.5Å; Y403-V433 HydrophobicContact CD2-CB 4.48Å; Y403-V433 HydrophobicContact CD2-CG1 4.31Å; Y403-V433 HydrophobicContact CD2-CG2 3.74Å; Y403-V433 HydrophobicContact CE2-CG1 4.12Å; Y403-V433 HydrophobicContact CE2-CG2 4.36Å; Y403-V433 HydrophobicContact CG-CG2 3.81Å; Y403-I440 HydrophobicContact CD1-CD1 3.74Å; Y403-I440 HydrophobicContact CD1-CG1 4.3Å; Y403-I440 HydrophobicContact CE1-CD1 3.68Å; Y403-I440 HydrophobicContact CE1-CG1 4.29Å
404	Y	97.6	Very high	95.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	163.6	-175.2	70.8	-76.1	0	0	0	111.8	L383 T385 I390 S392 R406 V410 Y411 F413 E418	L383-Y404 HydrophobicContact CD2-CD1 4.36Å; L383-Y404 HydrophobicContact CD2-CE1 3.75Å; L383-Y404 HydrophobicContact CD2-CE2 3.96Å; T385-Y404 HydrophobicContact CG2-CE2 4.16Å; I390-Y404 HydrophobicContact CB-CD2 4.37Å; I390-Y404 HydrophobicContact CD1-CD2 4.1Å; I390-Y404 HydrophobicContact CD1-CE2 4.16Å; I390-Y404 HydrophobicContact CG1-CD2 3.9Å; I390-Y404 HydrophobicContact CG1-CE2 4.06Å; I390-Y404 HydrophobicContact CG2-CD2 3.79Å; I390-Y404 HydrophobicContact CG2-CG 4.3Å; S392-Y404 WeakPolarHBondContact O-CA 3.5Å; S392-Y404 WeakPolarHBondContact O-CB 3.37Å; Y404-R406 HydrophobicContact CD2-CG 4.02Å; Y404-R406 HydrophobicContact CE2-CG 3.63Å; Y404-R406 PolarHBondContact OH-NE 3.46Å; Y404-R406 PolarHBondContact OH-NH2 3.2Å; Y404-R406 VanDerWaalsContact OH-NH2 3.1Å; Y404-V410 WeakPolarHBondContact O-CA 3.49Å; Y404-Y411 HydrophobicContact CE1-CG 4.43Å; Y404-Y411 PolarHBondContact N-O 2.97Å; Y404-Y411 PolarHBondContact O-N 2.92Å; Y404-F413 AromaticContact CD1-CD1 3.56Å; Y404-F413 HydrophobicContact CD1-CD1 3.56Å; Y404-F413 AromaticContact CD1-CE1 3.93Å; Y404-F413 HydrophobicContact CD1-CE1 3.93Å; Y404-F413 HydrophobicContact CE1-CB 4.45Å; Y404-F413 AromaticContact CE1-CD1 3.54Å; Y404-F413 HydrophobicContact CE1-CD1 3.54Å; Y404-F413 HydrophobicContact CE1-CE1 4.24Å; Y404-F413 HydrophobicContact CE1-CG 4.44Å; Y404-E418 PolarHBondContact OH-OE1 2.81Å; Y404-E418 PolarHBondContact OH-OE2 2.71Å
405	T	96.5	Very high	94.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141	179.1	54.9	0	0	0	0	111.8	I390 L391 S392 T409 V410 F428 I431	I390-T405 WeakPolarHBondContact CA-O 3.36Å; L391-T405 PolarHBondContact N-O 3.36Å; L391-T405 VanDerWaalsContact N-O 3.14Å; S392-T405 PolarHBondContact N-OG1 2.89Å; S392-T405 PolarHBondContact O-N 3.01Å; S392-T405 VanDerWaalsContact O-N 3.14Å; S392-T405 WeakPolarHBondContact OG-CG2 3.36Å; S392-T405 PolarHBondContact OG-OG1 3.17Å; T405-T409 WeakPolarHBondContact CA-O 3.47Å; T405-V410 HydrophobicContact CG2-CG2 3.97Å; T405-F428 HydrophobicContact CG2-CB 3.75Å; T405-F428 HydrophobicContact CG2-CD2 4.21Å; T405-F428 HydrophobicContact CG2-CG 3.93Å; T405-I431 HydrophobicContact CG2-CD1 4.45Å; T405-I431 HydrophobicContact CG2-CG2 3.59Å
406	R	92.8	Very high	94.6	Very high	24 Å²	24	53.5 Å²	53.5	9%	0.091	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	129.8	165.5	-65.2	-177.6	-82.8	-168.7	5.3	108.6	T388 I390 Y404 S408 T409 Y411 E418	T388-R406 WeakPolarHBondContact OG1-CD 3.33Å; I390-R406 HydrophobicContact CG1-CG 4.46Å; Y404-R406 HydrophobicContact CD2-CG 4.02Å; Y404-R406 HydrophobicContact CE2-CG 3.63Å; Y404-R406 PolarHBondContact OH-NE 3.46Å; Y404-R406 PolarHBondContact OH-NH2 3.2Å; Y404-R406 VanDerWaalsContact OH-NH2 3.1Å; R406-S408 PolarHBondContact O-N 2.89Å; R406-T409 PolarHBondContact N-O 3.29Å; R406-T409 PolarHBondContact O-N 2.87Å; R406-Y411 HydrophobicContact CB-CD2 4.2Å; R406-Y411 HydrophobicContact CB-CE2 3.88Å; R406-Y411 HydrophobicContact CG-CD2 4.34Å; R406-Y411 HydrophobicContact CG-CE2 4.38Å; R406-E418 IonicContact CZ-OE1 2.78Å; R406-E418 IonicContact CZ-OE2 2.61Å; R406-E418 IonicContact NH1-OE2 3.24Å; R406-E418 PolarHBondContact NH1-OE2 2.66Å; R406-E418 IonicContact NH2-OE1 3.92Å; R406-E418 PolarHBondContact NH2-OE1 2.95Å; R406-E418 IonicContact NH2-OE2 2.71Å; R406-E418 PolarHBondContact NH2-OE2 2.91Å
407	E	89.1	Confident	94.4	Very high	139 Å²	139	55.1 Å²	55.1	65%	0.65	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	-110.6	-178.2	-56.5	176.6	164.6	0	0	111
408	S	91.8	Very high	94.4	Very high	37 Å²	37	58.5 Å²	58.5	26%	0.259	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	28.2	179.1	63.5	0	0	0	0	113.2	R406 G423 D424 I426 F428	R406-S408 PolarHBondContact O-N 2.89Å; S408-G423 CarbonylContact O-C 3.56Å; S408-G423 WeakPolarHBondContact O-CA 3.34Å; S408-D424 PolarHBondContact O-N 3.3Å; S408-I426 WeakPolarHBondContact CB-O 3.11Å; S408-F428 VanDerWaalsContact C-CE2 3.48Å; S408-F428 WeakPolarHBondContact O-CE2 3.37Å
409	T	94.4	Very high	94.5	Very high	18 Å²	18	54 Å²	54	11%	0.11	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.6	-179	-59.8	0	0	0	0	112.4	T405 R406 Y411	T405-T409 WeakPolarHBondContact CA-O 3.47Å; R406-T409 PolarHBondContact N-O 3.29Å; R406-T409 PolarHBondContact O-N 2.87Å; T409-Y411 HydrophobicContact CG2-CD2 4.04Å; T409-Y411 HydrophobicContact CG2-CE1 4.34Å; T409-Y411 HydrophobicContact CG2-CE2 3.47Å; T409-Y411 VanDerWaalsContact CG2-CE2 3.47Å; T409-Y411 WeakPolarHBondContact O-CD2 3.4Å
410	V	97.2	Very high	94.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	134.5	170.9	-179.1	0	0	0	0	109.7	Y404 T405 L421 F422 F428 I431	Y404-V410 WeakPolarHBondContact O-CA 3.49Å; T405-V410 HydrophobicContact CG2-CG2 3.97Å; V410-L421 HydrophobicContact CG1-CD1 4.26Å; V410-L421 WeakPolarHBondContact O-CB 3.37Å; V410-L421 PolarHBondContact O-N 2.82Å; V410-F422 HydrophobicContact CB-CD1 4.31Å; V410-F422 HydrophobicContact CB-CE1 4Å; V410-F422 HydrophobicContact CB-CE2 4.21Å; V410-F422 HydrophobicContact CB-CZ 3.96Å; V410-F422 HydrophobicContact CG1-CE1 4.05Å; V410-F422 HydrophobicContact CG1-CZ 4.18Å; V410-F422 HydrophobicContact CG2-CD2 4.26Å; V410-F422 HydrophobicContact CG2-CE1 4.22Å; V410-F422 HydrophobicContact CG2-CE2 3.66Å; V410-F422 HydrophobicContact CG2-CZ 3.65Å; V410-F422 PolarHBondContact N-O 3.22Å; V410-F428 HydrophobicContact CG2-CD1 4.34Å; V410-F428 HydrophobicContact CG2-CD2 4.42Å; V410-F428 HydrophobicContact CG2-CE1 3.85Å; V410-F428 HydrophobicContact CG2-CE2 3.94Å; V410-F428 HydrophobicContact CG2-CZ 3.63Å; V410-I431 HydrophobicContact CG2-CG2 4.33Å
411	Y	96.4	Very high	94.7	Very high	42 Å²	42	43.5 Å²	43.5	17%	0.165	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	160.1	177.3	-65.6	-95.7	0	0	0	110.1	Y403 Y404 R406 T409 E418 N419 C420	Y403-Y411 CarbonylContact C-O 3.31Å; Y403-Y411 WeakPolarHBondContact CA-O 3.19Å; Y404-Y411 HydrophobicContact CE1-CG 4.43Å; Y404-Y411 PolarHBondContact N-O 2.97Å; Y404-Y411 PolarHBondContact O-N 2.92Å; R406-Y411 HydrophobicContact CB-CD2 4.2Å; R406-Y411 HydrophobicContact CB-CE2 3.88Å; R406-Y411 HydrophobicContact CG-CD2 4.34Å; R406-Y411 HydrophobicContact CG-CE2 4.38Å; T409-Y411 HydrophobicContact CG2-CD2 4.04Å; T409-Y411 HydrophobicContact CG2-CE1 4.34Å; T409-Y411 HydrophobicContact CG2-CE2 3.47Å; T409-Y411 VanDerWaalsContact CG2-CE2 3.47Å; T409-Y411 WeakPolarHBondContact O-CD2 3.4Å; Y411-E418 WeakPolarHBondContact CB-OE1 3.31Å; Y411-E418 WeakPolarHBondContact CD1-OE1 3.49Å; Y411-N419 CarbonylContact C-O 3.35Å; Y411-N419 WeakPolarHBondContact CA-O 3.22Å; Y411-C420 VanDerWaalsContact CD1-CA 3.42Å; Y411-C420 HydrophobicContact CD1-CB 3.49Å; Y411-C420 VanDerWaalsContact CD1-CB 3.49Å; Y411-C420 HydrophobicContact CE1-CB 3.31Å; Y411-C420 HydrophobicContact CG-CB 4.49Å
412	S	96.8	Very high	94.6	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	154	163.4	62.1	0	0	0	0	110.9	S402 N419	S402-S412 CarbonylContact O-C 3.56Å; S402-S412 WeakPolarHBondContact O-CA 3.39Å; S402-S412 WeakPolarHBondContact O-CB 3.45Å; S412-N419 PolarHBondContact N-O 3.03Å; S412-N419 PolarHBondContact O-N 3.14Å
413	F	95.8	Very high	94.2	Very high	19 Å²	19	40.2 Å²	40.2	8%	0.083	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	141.3	172	71.8	-86.4	0	0	0	110.9	V365 I382 L383 L393 R401 S402 Y404 E418	V365-F413 HydrophobicContact CB-CZ 4.18Å; V365-F413 HydrophobicContact CG1-CZ 4.15Å; V365-F413 HydrophobicContact CG2-CE1 4.09Å; V365-F413 HydrophobicContact CG2-CZ 4.09Å; I382-F413 HydrophobicContact CD1-CE2 3.9Å; I382-F413 HydrophobicContact CD1-CZ 3.95Å; I382-F413 HydrophobicContact CG1-CE2 4.12Å; I382-F413 HydrophobicContact CG1-CZ 4.25Å; L383-F413 HydrophobicContact CB-CD2 4.4Å; L383-F413 HydrophobicContact CB-CE1 4.4Å; L383-F413 HydrophobicContact CB-CE2 4.12Å; L383-F413 HydrophobicContact CB-CZ 4.09Å; L383-F413 HydrophobicContact CD2-CD1 3.67Å; L383-F413 HydrophobicContact CD2-CE1 3.71Å; L383-F413 HydrophobicContact CD2-CG 4.1Å; L383-F413 HydrophobicContact CD2-CZ 4.26Å; L393-F413 HydrophobicContact CD1-CE1 4.36Å; R401-F413 WeakPolarHBondContact CA-O 3.37Å; S402-F413 PolarHBondContact N-O 2.71Å; S402-F413 PolarHBondContact O-N 2.9Å; S402-F413 WeakPolarHBondContact OG-CZ 3.23Å; Y404-F413 AromaticContact CD1-CD1 3.56Å; Y404-F413 HydrophobicContact CD1-CD1 3.56Å; Y404-F413 AromaticContact CD1-CE1 3.93Å; Y404-F413 HydrophobicContact CD1-CE1 3.93Å; Y404-F413 HydrophobicContact CE1-CB 4.45Å; Y404-F413 AromaticContact CE1-CD1 3.54Å; Y404-F413 HydrophobicContact CE1-CD1 3.54Å; Y404-F413 HydrophobicContact CE1-CE1 4.24Å; Y404-F413 HydrophobicContact CE1-CG 4.44Å; F413-E418 HydrophobicContact CB-CG 4.14Å
414	D	94.8	Very high	93.4	Very high	33 Å²	33	43.1 Å²	43.1	18%	0.176	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	-169.6	172.9	62.9	33.2	0	0	0	109.2	R401 K416 G417	R401-D414 HydrophobicContact CB-CB 4.21Å; R401-D414 HydrophobicContact CG-CB 4.34Å; R401-D414 IonicContact CZ-OD2 3.02Å; R401-D414 IonicContact NE-OD2 3.68Å; R401-D414 PolarHBondContact NE-OD2 3.45Å; R401-D414 IonicContact NH2-OD2 2.98Å; R401-D414 PolarHBondContact NH2-OD2 2.95Å; D414-K416 PolarHBondContact O-N 3.08Å; D414-K416 VanDerWaalsContact O-N 3.13Å; D414-K416 WeakPolarHBondContact OD1-CA 3.28Å; D414-K416 WeakPolarHBondContact OD1-CB 3.47Å; D414-K416 PolarHBondContact OD1-N 2.03Å; D414-G417 PolarHBondContact N-O 3.13Å; D414-G417 PolarHBondContact O-N 3.2Å
415	E	91.7	Very high	92.6	Very high	156 Å²	156	49.8 Å²	49.8	73%	0.729	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-20	179.3	-65.6	-179.9	-178.4	0	0	113.8	R400	R400-E415 IonicContact CZ-OE1 3.25Å; R400-E415 IonicContact NE-OE1 2.84Å; R400-E415 PolarHBondContact NE-OE1 2.86Å; R400-E415 IonicContact NH2-OE1 2.83Å; R400-E415 PolarHBondContact NH2-OE1 3.18Å
416	K	91	Very high	92.3	Very high	196 Å²	196	50.1 Å²	50.1	85%	0.852	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-4.9	176.3	-56	173.5	-179.5	170.2	0	112.3	D414	D414-K416 PolarHBondContact O-N 3.08Å; D414-K416 VanDerWaalsContact O-N 3.13Å; D414-K416 WeakPolarHBondContact OD1-CA 3.28Å; D414-K416 WeakPolarHBondContact OD1-CB 3.47Å; D414-K416 PolarHBondContact OD1-N 2.03Å
417	G	92	Very high	92.3	Very high	37 Å²	37	52.8 Å²	52.8	38%	0.381	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	104.9	-161.1	-179.5	0	0	0	0	0	112.8	D414	D414-G417 PolarHBondContact N-O 3.13Å; D414-G417 PolarHBondContact O-N 3.2Å
418	E	93.5	Very high	92.6	Very high	83 Å²	83	46.3 Å²	46.3	39%	0.388	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	144.6	-170.1	-126.7	-133.1	110.1	0	0	112.4	L383 Y404 R406 Y411 F413	L383-E418 HydrophobicContact CD1-CG 4.39Å; Y404-E418 PolarHBondContact OH-OE1 2.81Å; Y404-E418 PolarHBondContact OH-OE2 2.71Å; R406-E418 IonicContact CZ-OE1 2.78Å; R406-E418 IonicContact CZ-OE2 2.61Å; R406-E418 IonicContact NH1-OE2 3.24Å; R406-E418 PolarHBondContact NH1-OE2 2.66Å; R406-E418 IonicContact NH2-OE1 3.92Å; R406-E418 PolarHBondContact NH2-OE1 2.95Å; R406-E418 IonicContact NH2-OE2 2.71Å; R406-E418 PolarHBondContact NH2-OE2 2.91Å; Y411-E418 WeakPolarHBondContact CB-OE1 3.31Å; Y411-E418 WeakPolarHBondContact CD1-OE1 3.49Å; F413-E418 HydrophobicContact CB-CG 4.14Å
419	N	94.1	Very high	92.8	Very high	47 Å²	47	45 Å²	45	25%	0.251	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	121.6	177.2	-166.6	62.5	0	0	0	111	Y411 S412 L421 S675	Y411-N419 CarbonylContact C-O 3.35Å; Y411-N419 WeakPolarHBondContact CA-O 3.22Å; S412-N419 PolarHBondContact N-O 3.03Å; S412-N419 PolarHBondContact O-N 3.14Å; N419-L421 WeakPolarHBondContact ND2-CD2 3.41Å; N419-S675 PolarHBondContact OD1-OG 3.26Å
420	C	94.4	Very high	92.9	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.014	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	139.1	173.3	71.8	0	0	0	0	110.8	Y411 C672 S675	Y411-C420 VanDerWaalsContact CD1-CA 3.42Å; Y411-C420 HydrophobicContact CD1-CB 3.49Å; Y411-C420 VanDerWaalsContact CD1-CB 3.49Å; Y411-C420 HydrophobicContact CE1-CB 3.31Å; Y411-C420 HydrophobicContact CG-CB 4.49Å; C420-C672 HydrophobicContact CB-CB 3.67Å; C420-C672 WeakPolarHBondContact CB-SG 3.45Å; C420-C672 WeakPolarHBondContact SG-CB 3.15Å; C420-C672 CovalentContact SG-SG 2.01Å; C420-C672 PolarHBondContact SG-SG 3.41Å; C420-S675 VanDerWaalsContact O-CB 3.26Å; C420-S675 WeakPolarHBondContact O-CB 3.42Å; C420-S675 PolarHBondContact O-OG 2.04Å
421	L	95.6	Very high	92.9	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.016	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	-77	-174.1	-56.8	-179.2	0	0	0	110.7	Y403 V410 N419 I440 C672	Y403-L421 HydrophobicContact CD1-CD1 3.69Å; Y403-L421 HydrophobicContact CE1-CD1 3.74Å; V410-L421 HydrophobicContact CG1-CD1 4.26Å; V410-L421 WeakPolarHBondContact O-CB 3.37Å; V410-L421 PolarHBondContact O-N 2.82Å; N419-L421 WeakPolarHBondContact ND2-CD2 3.41Å; L421-I440 HydrophobicContact CD1-CD1 3.6Å; L421-C672 VanDerWaalsContact O-CB 3.29Å; L421-C672 WeakPolarHBondContact O-CB 3.3Å; L421-C672 PolarHBondContact O-N 3.19Å
422	F	94.9	Very high	93	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	160	-174.1	61.3	-88.3	0	0	0	111.1	V410 F428 I440 Y442 C453 G457 I669 R670	V410-F422 HydrophobicContact CB-CD1 4.31Å; V410-F422 HydrophobicContact CB-CE1 4Å; V410-F422 HydrophobicContact CB-CE2 4.21Å; V410-F422 HydrophobicContact CB-CZ 3.96Å; V410-F422 HydrophobicContact CG1-CE1 4.05Å; V410-F422 HydrophobicContact CG1-CZ 4.18Å; V410-F422 HydrophobicContact CG2-CD2 4.26Å; V410-F422 HydrophobicContact CG2-CE1 4.22Å; V410-F422 HydrophobicContact CG2-CE2 3.66Å; V410-F422 HydrophobicContact CG2-CZ 3.65Å; V410-F422 PolarHBondContact N-O 3.22Å; F422-F428 HydrophobicContact CD2-CZ 4.27Å; F422-F428 HydrophobicContact CE2-CE1 4.14Å; F422-F428 HydrophobicContact CE2-CZ 4.02Å; F422-I440 HydrophobicContact CE1-CB 4.14Å; F422-I440 HydrophobicContact CE1-CD1 3.88Å; F422-I440 HydrophobicContact CE1-CG2 4.12Å; F422-I440 HydrophobicContact CZ-CB 4.2Å; F422-I440 HydrophobicContact CZ-CG2 3.89Å; F422-Y442 AromaticContact CE2-CD1 3.94Å; F422-Y442 HydrophobicContact CE2-CD1 3.94Å; F422-Y442 HydrophobicContact CE2-CE1 4.18Å; F422-Y442 HydrophobicContact CZ-CD1 4.25Å; F422-C453 HydrophobicContact CD1-CB 3.9Å; F422-C453 HydrophobicContact CD2-CB 4.42Å; F422-C453 WeakPolarHBondContact CD2-SG 3.34Å; F422-C453 HydrophobicContact CE1-CB 3.63Å; F422-C453 HydrophobicContact CE2-CB 4.18Å; F422-C453 WeakPolarHBondContact CE2-SG 3.06Å; F422-C453 HydrophobicContact CG-CB 4.27Å; F422-C453 HydrophobicContact CZ-CB 3.77Å; F422-C453 VanDerWaalsContact CZ-SG 3.57Å; F422-G457 VanDerWaalsContact CD1-CA 3.41Å; F422-I669 HydrophobicContact CB-CG2 4.23Å; F422-I669 HydrophobicContact CD2-CG2 3.95Å; F422-R670 WeakPolarHBondContact CA-O 3.36Å
423	G	90.5	Very high	93.1	Very high	2 Å²	2	42.9 Å²	42.9	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-148.4	-177.1	0	0	0	0	0	112.7	S408 R670	S408-G423 CarbonylContact O-C 3.56Å; S408-G423 WeakPolarHBondContact O-CA 3.34Å; G423-R670 PolarHBondContact N-O 2.8Å; G423-R670 VanDerWaalsContact N-O 3.08Å; G423-R670 PolarHBondContact O-N 2.94Å
424	D	80.2	Confident	93.1	Very high	65 Å²	65	42 Å²	42	35%	0.348	21%	0.212	S	C	.	.	S	Bend	trans	78.4	117.7	-172.5	-63.4	-18.1	0	0	0	113.9	S408 I426 R670	S408-D424 PolarHBondContact O-N 3.3Å; D424-I426 VanDerWaalsContact C-N 3.3Å; D424-I426 PolarHBondContact O-N 2.96Å; D424-R670 HydrophobicContact CB-CB 4.39Å; D424-R670 WeakPolarHBondContact OD2-CD 3.27Å
425	F	81.4	Confident	93.2	Very high	140 Å²	140	40.9 Å²	40.9	61%	0.614	21%	0.206	S	C	*	.	S	Bend	trans	60.1	31.7	174.1	-48.8	-79	0	0	0	115.2	R447 M667	F425-R447 PolarHBondContact O-NH2 2.98Å; F425-R447 VanDerWaalsContact O-NH2 3.07Å; F425-M667 HydrophobicContact CD2-SD 3.98Å; F425-M667 HydrophobicContact CE2-SD 4.17Å
426	I	89.3	Confident	93.3	Very high	6 Å²	6	34.1 Å²	34.1	3%	0.031	17%	0.174	C	C	.	.			trans	-116.1	134.9	172.8	-57.8	172.3	0	0	0	108.4	S408 D424 F428 Y442 D444 I669	S408-I426 WeakPolarHBondContact CB-O 3.11Å; D424-I426 VanDerWaalsContact C-N 3.3Å; D424-I426 PolarHBondContact O-N 2.96Å; I426-F428 HydrophobicContact CB-CD2 4.28Å; I426-F428 HydrophobicContact CB-CE1 4.15Å; I426-F428 HydrophobicContact CB-CE2 3.87Å; I426-F428 HydrophobicContact CB-CZ 3.8Å; I426-F428 HydrophobicContact CD1-CE1 4.1Å; I426-F428 HydrophobicContact CD1-CE2 4.42Å; I426-F428 HydrophobicContact CD1-CZ 3.66Å; I426-F428 HydrophobicContact CG1-CZ 4.33Å; I426-F428 HydrophobicContact CG2-CD1 3.63Å; I426-F428 HydrophobicContact CG2-CD2 4.15Å; I426-F428 HydrophobicContact CG2-CE1 3.5Å; I426-F428 VanDerWaalsContact CG2-CE1 3.5Å; I426-F428 HydrophobicContact CG2-CE2 4.02Å; I426-F428 HydrophobicContact CG2-CG 3.97Å; I426-F428 HydrophobicContact CG2-CZ 3.7Å; I426-Y442 HydrophobicContact CG2-CD2 4.5Å; I426-D444 HydrophobicContact CG2-CB 4.04Å; I426-I669 HydrophobicContact CD1-CB 4.43Å; I426-I669 HydrophobicContact CD1-CD1 3.74Å; I426-I669 HydrophobicContact CD1-CG1 3.86Å; I426-I669 HydrophobicContact CD1-CG2 3.84Å
427	N	92.7	Very high	93.4	Very high	81 Å²	81	26.3 Å²	26.3	43%	0.433	14%	0.142	S	C	.	.			trans	-95.8	87.5	172.3	-173.2	24	0	0	0	109	A429 D444 E445	N427-A429 PolarHBondContact O-N 3.48Å; N427-D444 WeakPolarHBondContact O-CA 3.46Å; N427-E445 PolarHBondContact O-N 3.22Å
428	F	95.4	Very high	93.5	Very high	3 Å²	3	25.1 Å²	25.1	1%	0.013	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	113.8	-177.1	-66.7	-69.6	0	0	0	110.9	T405 S408 V410 F422 I426 Y442 A443	T405-F428 HydrophobicContact CG2-CB 3.75Å; T405-F428 HydrophobicContact CG2-CD2 4.21Å; T405-F428 HydrophobicContact CG2-CG 3.93Å; S408-F428 VanDerWaalsContact C-CE2 3.48Å; S408-F428 WeakPolarHBondContact O-CE2 3.37Å; V410-F428 HydrophobicContact CG2-CD1 4.34Å; V410-F428 HydrophobicContact CG2-CD2 4.42Å; V410-F428 HydrophobicContact CG2-CE1 3.85Å; V410-F428 HydrophobicContact CG2-CE2 3.94Å; V410-F428 HydrophobicContact CG2-CZ 3.63Å; F422-F428 HydrophobicContact CD2-CZ 4.27Å; F422-F428 HydrophobicContact CE2-CE1 4.14Å; F422-F428 HydrophobicContact CE2-CZ 4.02Å; I426-F428 HydrophobicContact CB-CD2 4.28Å; I426-F428 HydrophobicContact CB-CE1 4.15Å; I426-F428 HydrophobicContact CB-CE2 3.87Å; I426-F428 HydrophobicContact CB-CZ 3.8Å; I426-F428 HydrophobicContact CD1-CE1 4.1Å; I426-F428 HydrophobicContact CD1-CE2 4.42Å; I426-F428 HydrophobicContact CD1-CZ 3.66Å; I426-F428 HydrophobicContact CG1-CZ 4.33Å; I426-F428 HydrophobicContact CG2-CD1 3.63Å; I426-F428 HydrophobicContact CG2-CD2 4.15Å; I426-F428 HydrophobicContact CG2-CE1 3.5Å; I426-F428 VanDerWaalsContact CG2-CE1 3.5Å; I426-F428 HydrophobicContact CG2-CE2 4.02Å; I426-F428 HydrophobicContact CG2-CG 3.97Å; I426-F428 HydrophobicContact CG2-CZ 3.7Å; F428-Y442 HydrophobicContact CD1-CD2 4.11Å; F428-Y442 HydrophobicContact CD1-CG 4.13Å; F428-Y442 HydrophobicContact CE1-CD1 4.34Å; F428-Y442 AromaticContact CE1-CD2 3.78Å; F428-Y442 HydrophobicContact CE1-CD2 3.78Å; F428-Y442 HydrophobicContact CE1-CE2 4.5Å; F428-Y442 AromaticContact CE1-CG 3.72Å; F428-Y442 HydrophobicContact CE1-CG 3.72Å; F428-A443 WeakPolarHBondContact CA-O 3.5Å
429	A	95.9	Very high	93.7	Very high	9 Å²	9	21.6 Å²	21.6	7%	0.074	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-43.4	171.5	0	0	0	0	0	112.4	N427 A443 E445 R472	N427-A429 PolarHBondContact O-N 3.48Å; A429-A443 HydrophobicContact CB-CB 4.3Å; A429-A443 PolarHBondContact N-O 3.02Å; A429-E445 HydrophobicContact CB-CB 3.98Å; A429-R472 HydrophobicContact CB-CB 4.41Å; A429-R472 HydrophobicContact CB-CG 4.28Å
430	N	97.6	Very high	93.9	Very high	8 Å²	8	19.4 Å²	19.4	4%	0.043	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	161.8	176.3	-151.5	-33.9	0	0	0	110.8	Y442 A443 R472 D560	N430-Y442 WeakPolarHBondContact O-CA 3.14Å; N430-A443 PolarHBondContact O-N 2.95Å; N430-R472 WeakPolarHBondContact CB-O 3.45Å; N430-D560 PolarHBondContact ND2-OD1 2.86Å
431	I	97.9	Very high	94.1	Very high	3 Å²	3	19.3 Å²	19.3	2%	0.015	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	153.9	173.9	65.9	177.3	0	0	0	109.9	D394 T405 V410 Y441	D394-I431 HydrophobicContact CB-CG1 4.45Å; T405-I431 HydrophobicContact CG2-CD1 4.45Å; T405-I431 HydrophobicContact CG2-CG2 3.59Å; V410-I431 HydrophobicContact CG2-CG2 4.33Å; I431-Y441 CarbonylContact C-O 3.54Å; I431-Y441 VanDerWaalsContact CA-O 3.23Å; I431-Y441 WeakPolarHBondContact CA-O 3.38Å
432	A	98.4	Very high	94.2	Very high	6 Å²	6	19.2 Å²	19.2	5%	0.05	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	141.7	168.7	0	0	0	0	0	110	D394 Y441 I474 L476	D394-A432 WeakPolarHBondContact OD2-CA 3.35Å; A432-Y441 PolarHBondContact N-O 2.83Å; A432-Y441 WeakPolarHBondContact O-CA 3.28Å; A432-Y441 WeakPolarHBondContact O-CB 3.44Å; A432-Y441 PolarHBondContact O-N 2.86Å; A432-I474 HydrophobicContact CB-CB 4.23Å; A432-I474 HydrophobicContact CB-CG2 3.7Å; A432-L476 HydrophobicContact CB-CD1 3.88Å; A432-L476 HydrophobicContact CB-CD2 4.27Å; A432-L476 HydrophobicContact CB-CG 3.64Å
433	V	98.1	Very high	94.3	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.006	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.8	-170.6	-173.9	0	0	0	0	110.1	D394 V396 Y403 W435 I440 L476	D394-V433 HydrophobicContact CB-CG2 4.19Å; D394-V433 WeakPolarHBondContact OD2-CB 3.47Å; D394-V433 PolarHBondContact OD2-N 3.03Å; V396-V433 HydrophobicContact CG2-CB 4.13Å; V396-V433 HydrophobicContact CG2-CG1 3.64Å; Y403-V433 HydrophobicContact CD1-CG2 4.5Å; Y403-V433 HydrophobicContact CD2-CB 4.48Å; Y403-V433 HydrophobicContact CD2-CG1 4.31Å; Y403-V433 HydrophobicContact CD2-CG2 3.74Å; Y403-V433 HydrophobicContact CE2-CG1 4.12Å; Y403-V433 HydrophobicContact CE2-CG2 4.36Å; Y403-V433 HydrophobicContact CG-CG2 3.81Å; V433-W435 PolarHBondContact O-N 3.39Å; V433-W435 VanDerWaalsContact O-N 3.08Å; V433-I440 HydrophobicContact CG1-CG1 4.4Å; V433-I440 HydrophobicContact CG2-CG1 4.31Å; V433-I440 HydrophobicContact CG2-CG2 4.37Å; V433-L476 VanDerWaalsContact C-CD1 3.41Å
434	D	96.7	Very high	94.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.101	C	C	.	.			trans	-73.1	100.9	171.6	-178.8	-20.9	0	0	0	108.9	I436 I437 G438 N439 Y441 L476 M499	D434-I436 PolarHBondContact O-N 3.38Å; D434-I436 WeakPolarHBondContact OD1-CA 3.37Å; D434-I436 WeakPolarHBondContact OD1-CB 3.26Å; D434-I436 PolarHBondContact OD1-N 2.88Å; D434-I437 PolarHBondContact OD1-N 3.13Å; D434-I437 WeakPolarHBondContact OD2-CB 3.26Å; D434-I437 VanDerWaalsContact OD2-CD1 3.25Å; D434-I437 WeakPolarHBondContact OD2-CD1 3.25Å; D434-I437 WeakPolarHBondContact OD2-CG1 3.2Å; D434-G438 WeakPolarHBondContact O-CA 3.06Å; D434-G438 PolarHBondContact O-N 2.9Å; D434-N439 HydrophobicContact CB-CB 4.43Å; D434-N439 PolarHBondContact N-O 2.94Å; D434-Y441 HydrophobicContact CB-CE2 4.32Å; D434-L476 HydrophobicContact CB-CD1 4.15Å; D434-M499 HydrophobicContact CB-CE 4.05Å; D434-M499 WeakPolarHBondContact OD2-CE 3.29Å
435	W	95.4	Very high	95.2	Very high	11 Å²	11	18.3 Å²	18.3	4%	0.042	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.4	-179.8	59.9	89.1	0	0	0	114.4	V396 R398 V433 P478 Y522 Q610 W614	V396-W435 HydrophobicContact CG1-CB 4.03Å; V396-W435 HydrophobicContact CG2-CB 4.42Å; R398-W435 PolarHBondContact NH2-O 3.03Å; V433-W435 PolarHBondContact O-N 3.39Å; V433-W435 VanDerWaalsContact O-N 3.08Å; W435-P478 HydrophobicContact CH2-CG 4.15Å; W435-P478 HydrophobicContact CZ2-CG 4.08Å; W435-P478 HydrophobicContact CZ3-CG 4.46Å; W435-Y522 HydrophobicContact CH2-CE1 4.06Å; W435-Y522 HydrophobicContact CH2-CE2 4.1Å; W435-Y522 AromaticContact CH2-CZ 3.61Å; W435-Y522 WeakPolarHBondContact CH2-OH 3.38Å; W435-Q610 HydrophobicContact CD2-CB 4.03Å; W435-Q610 HydrophobicContact CD2-CG 3.69Å; W435-Q610 HydrophobicContact CE3-CG 4.02Å; W435-Q610 HydrophobicContact CG-CB 3.87Å; W435-Q610 HydrophobicContact CG-CG 3.9Å; W435-Q610 HydrophobicContact CZ2-CG 4.44Å; W435-W614 AromaticContact CZ2-CZ3 3.95Å; W435-W614 HydrophobicContact CZ2-CZ3 3.95Å
436	I	94.2	Very high	95.7	Very high	14 Å²	14	14.4 Å²	14.4	7%	0.072	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-49.5	175.8	-55	-60.3	0	0	0	110.8	D434 P478 W614 N616	D434-I436 PolarHBondContact O-N 3.38Å; D434-I436 WeakPolarHBondContact OD1-CA 3.37Å; D434-I436 WeakPolarHBondContact OD1-CB 3.26Å; D434-I436 PolarHBondContact OD1-N 2.88Å; I436-P478 HydrophobicContact CG1-CB 3.97Å; I436-P478 HydrophobicContact CG1-CG 4.45Å; I436-W614 HydrophobicContact CD1-CB 4.29Å; I436-W614 HydrophobicContact CD1-CE3 4.16Å; I436-W614 HydrophobicContact CG1-CE3 4.14Å; I436-N616 HydrophobicContact CG2-CB 4.06Å; I436-N616 PolarHBondContact O-ND2 3.34Å
437	I	93.3	Very high	95.8	Very high	32 Å²	32	20.1 Å²	20.1	16%	0.164	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-36.4	-176.2	-57.7	176.8	0	0	0	112.3	D434 C618 V629	D434-I437 PolarHBondContact OD1-N 3.13Å; D434-I437 WeakPolarHBondContact OD2-CB 3.26Å; D434-I437 VanDerWaalsContact OD2-CD1 3.25Å; D434-I437 WeakPolarHBondContact OD2-CD1 3.25Å; D434-I437 WeakPolarHBondContact OD2-CG1 3.2Å; I437-C618 HydrophobicContact CG2-CB 4.3Å; I437-V629 HydrophobicContact CD1-CB 4.11Å; I437-V629 HydrophobicContact CD1-CG1 3.63Å; I437-V629 HydrophobicContact CD1-CG2 3.8Å
438	G	94.2	Very high	96	Very high	11 Å²	11	16.4 Å²	16.4	11%	0.113	10%	0.095	C	C	.	.			trans	95.6	11.9	-174.8	0	0	0	0	0	114.7	D434 S455	D434-G438 WeakPolarHBondContact O-CA 3.06Å; D434-G438 PolarHBondContact O-N 2.9Å; G438-S455 WeakPolarHBondContact O-CA 3.32Å; G438-S455 WeakPolarHBondContact O-CB 3.4Å; G438-S455 PolarHBondContact O-N 3.14Å
439	N	97.4	Very high	95.9	Very high	10 Å²	10	17.2 Å²	17.2	5%	0.053	10%	0.098	C	C	.	.			trans	-77.1	142.9	175.6	-67.7	-27.2	0	0	0	110.9	D434 Y441 F452 C453 C627	D434-N439 HydrophobicContact CB-CB 4.43Å; D434-N439 PolarHBondContact N-O 2.94Å; N439-Y441 HydrophobicContact CB-CD2 4.38Å; N439-Y441 HydrophobicContact CB-CE2 3.82Å; N439-F452 HydrophobicContact CB-CD2 3.89Å; N439-F452 HydrophobicContact CB-CE2 4.45Å; N439-C453 CarbonylContact C-O 3.52Å; N439-C453 WeakPolarHBondContact CA-O 3.44Å; N439-C627 PolarHBondContact ND2-O 2.87Å
440	I	98.2	Very high	96	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	107.7	177.6	-56.3	163.5	0	0	0	108	Y403 L421 F422 V433 F452 C453	Y403-I440 HydrophobicContact CD1-CD1 3.74Å; Y403-I440 HydrophobicContact CD1-CG1 4.3Å; Y403-I440 HydrophobicContact CE1-CD1 3.68Å; Y403-I440 HydrophobicContact CE1-CG1 4.29Å; L421-I440 HydrophobicContact CD1-CD1 3.6Å; F422-I440 HydrophobicContact CE1-CB 4.14Å; F422-I440 HydrophobicContact CE1-CD1 3.88Å; F422-I440 HydrophobicContact CE1-CG2 4.12Å; F422-I440 HydrophobicContact CZ-CB 4.2Å; F422-I440 HydrophobicContact CZ-CG2 3.89Å; V433-I440 HydrophobicContact CG1-CG1 4.4Å; V433-I440 HydrophobicContact CG2-CG1 4.31Å; V433-I440 HydrophobicContact CG2-CG2 4.37Å; I440-F452 CarbonylContact O-C 3.52Å; I440-F452 WeakPolarHBondContact O-CA 3.49Å; I440-F452 WeakPolarHBondContact O-CB 3.07Å; I440-C453 PolarHBondContact N-O 2.93Å; I440-C453 PolarHBondContact O-N 3.41Å
441	Y	98.4	Very high	95.9	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	147.3	175.2	-69.3	-100	0	0	0	110.4	I431 A432 D434 N439 G451 F452 F463 L476 L483 M499	I431-Y441 CarbonylContact C-O 3.54Å; I431-Y441 VanDerWaalsContact CA-O 3.23Å; I431-Y441 WeakPolarHBondContact CA-O 3.38Å; A432-Y441 PolarHBondContact N-O 2.83Å; A432-Y441 WeakPolarHBondContact O-CA 3.28Å; A432-Y441 WeakPolarHBondContact O-CB 3.44Å; A432-Y441 PolarHBondContact O-N 2.86Å; D434-Y441 HydrophobicContact CB-CE2 4.32Å; N439-Y441 HydrophobicContact CB-CD2 4.38Å; N439-Y441 HydrophobicContact CB-CE2 3.82Å; Y441-G451 WeakPolarHBondContact CA-O 3.37Å; Y441-F452 HydrophobicContact CD1-CB 3.63Å; Y441-F452 HydrophobicContact CD1-CD1 4.31Å; Y441-F452 HydrophobicContact CD1-CG 4.28Å; Y441-F452 HydrophobicContact CD2-CB 4.14Å; Y441-F452 HydrophobicContact CE1-CB 3.81Å; Y441-F452 AromaticContact CE1-CD1 3.74Å; Y441-F452 HydrophobicContact CE1-CD1 3.74Å; Y441-F452 AromaticContact CE1-CG 3.94Å; Y441-F452 HydrophobicContact CE1-CG 3.94Å; Y441-F452 HydrophobicContact CE2-CB 4.3Å; Y441-F452 HydrophobicContact CG-CB 3.8Å; Y441-F463 HydrophobicContact CE1-CE2 4.49Å; Y441-F463 HydrophobicContact CE1-CZ 4.11Å; Y441-L476 HydrophobicContact CD1-CD2 4.43Å; Y441-L476 HydrophobicContact CD2-CD1 3.68Å; Y441-L476 HydrophobicContact CD2-CD2 3.84Å; Y441-L476 HydrophobicContact CD2-CG 4.43Å; Y441-L476 HydrophobicContact CE2-CD1 4.27Å; Y441-L476 HydrophobicContact CE2-CD2 4.38Å; Y441-L476 HydrophobicContact CG-CD1 4.4Å; Y441-L476 HydrophobicContact CG-CD2 3.88Å; Y441-L483 HydrophobicContact CD1-CD2 3.45Å; Y441-L483 VanDerWaalsContact CD1-CD2 3.45Å; Y441-L483 HydrophobicContact CE1-CD2 3.52Å; Y441-L483 HydrophobicContact CG-CD2 4.29Å; Y441-M499 WeakPolarHBondContact CE1-O 3.08Å; Y441-M499 HydrophobicContact CE2-CE 3.9Å; Y441-M499 PolarHBondContact OH-O 3.17Å
442	Y	97.6	Very high	95.9	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.008	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	150.8	-179.6	63	-93.8	0	0	0	112.5	F422 I426 F428 N430 D444 G451 V462 I669	F422-Y442 AromaticContact CE2-CD1 3.94Å; F422-Y442 HydrophobicContact CE2-CD1 3.94Å; F422-Y442 HydrophobicContact CE2-CE1 4.18Å; F422-Y442 HydrophobicContact CZ-CD1 4.25Å; I426-Y442 HydrophobicContact CG2-CD2 4.5Å; F428-Y442 HydrophobicContact CD1-CD2 4.11Å; F428-Y442 HydrophobicContact CD1-CG 4.13Å; F428-Y442 HydrophobicContact CE1-CD1 4.34Å; F428-Y442 AromaticContact CE1-CD2 3.78Å; F428-Y442 HydrophobicContact CE1-CD2 3.78Å; F428-Y442 HydrophobicContact CE1-CE2 4.5Å; F428-Y442 AromaticContact CE1-CG 3.72Å; F428-Y442 HydrophobicContact CE1-CG 3.72Å; N430-Y442 WeakPolarHBondContact O-CA 3.14Å; Y442-D444 HydrophobicContact CE2-CB 4.48Å; Y442-G451 WeakPolarHBondContact CD1-O 3.04Å; Y442-G451 PolarHBondContact N-O 3.03Å; Y442-G451 PolarHBondContact O-N 2.85Å; Y442-V462 WeakPolarHBondContact OH-CG2 3.29Å; Y442-I669 HydrophobicContact CE1-CD1 4.3Å; Y442-I669 HydrophobicContact CE2-CD1 4.47Å; Y442-I669 WeakPolarHBondContact OH-CD1 3.49Å
443	A	97.3	Very high	95.8	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120	170.2	0	0	0	0	0	109.7	F428 A429 N430 I450 P471 I474	F428-A443 WeakPolarHBondContact CA-O 3.5Å; A429-A443 HydrophobicContact CB-CB 4.3Å; A429-A443 PolarHBondContact N-O 3.02Å; N430-A443 PolarHBondContact O-N 2.95Å; A443-I450 HydrophobicContact CB-CD1 3.88Å; A443-P471 HydrophobicContact CB-CB 4.17Å; A443-P471 HydrophobicContact CB-CG 4.41Å; A443-I474 HydrophobicContact CB-CD1 3.64Å; A443-I474 HydrophobicContact CB-CG1 4.09Å
444	D	95.5	Very high	95.6	Very high	6 Å²	6	16.7 Å²	16.7	3%	0.032	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	98.1	169.3	-174.9	-14.3	0	0	0	108.7	I426 N427 Y442 G446 R447 G448 K449	I426-D444 HydrophobicContact CG2-CB 4.04Å; N427-D444 WeakPolarHBondContact O-CA 3.46Å; Y442-D444 HydrophobicContact CE2-CB 4.48Å; D444-G446 VanDerWaalsContact C-N 3.31Å; D444-G446 PolarHBondContact OD1-N 2.77Å; D444-G446 VanDerWaalsContact OD1-N 3.13Å; D444-R447 HydrophobicContact CB-CB 4.46Å; D444-R447 PolarHBondContact OD1-N 2.95Å; D444-R447 WeakPolarHBondContact OD2-CB 3.02Å; D444-R447 VanDerWaalsContact OD2-CD 3.22Å; D444-R447 WeakPolarHBondContact OD2-CD 3.4Å; D444-R447 VanDerWaalsContact OD2-CG 3.28Å; D444-R447 WeakPolarHBondContact OD2-CG 3.25Å; D444-R447 IonicContact OD2-NE 3.88Å; D444-G448 PolarHBondContact O-N 3.37Å; D444-K449 PolarHBondContact N-O 3.09Å; D444-K449 PolarHBondContact O-N 3.09Å; D444-K449 VanDerWaalsContact O-N 3.1Å
445	E	94.6	Very high	95.4	Very high	41 Å²	41	19.4 Å²	19.4	19%	0.192	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-37.8	-179.9	-172.1	-176	130.3	0	0	111.2	N427 A429 R447 G448 M470 R472 W488	N427-E445 PolarHBondContact O-N 3.22Å; A429-E445 HydrophobicContact CB-CB 3.98Å; E445-R447 VanDerWaalsContact C-N 3.33Å; E445-R447 PolarHBondContact O-N 3.3Å; E445-G448 PolarHBondContact O-N 2.9Å; E445-M470 HydrophobicContact CG-CB 4.14Å; E445-M470 HydrophobicContact CG-CG 4.45Å; E445-R472 IonicContact OE2-NH2 2.94Å; E445-W488 WeakPolarHBondContact OE1-CZ2 3.45Å
446	G	91.5	Very high	95.2	Very high	58 Å²	58	21.9 Å²	21.9	60%	0.598	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-29.2	-176.6	0	0	0	0	0	113.5	D444	D444-G446 VanDerWaalsContact C-N 3.31Å; D444-G446 PolarHBondContact OD1-N 2.77Å; D444-G446 VanDerWaalsContact OD1-N 3.13Å
447	R	92	Very high	95	Very high	127 Å²	127	21.3 Å²	21.3	48%	0.479	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-8.1	176.9	-62	-173.3	-175.6	152.9	6	114.2	F425 D444 E445 K449	F425-R447 PolarHBondContact O-NH2 2.98Å; F425-R447 VanDerWaalsContact O-NH2 3.07Å; D444-R447 HydrophobicContact CB-CB 4.46Å; D444-R447 PolarHBondContact OD1-N 2.95Å; D444-R447 WeakPolarHBondContact OD2-CB 3.02Å; D444-R447 VanDerWaalsContact OD2-CD 3.22Å; D444-R447 WeakPolarHBondContact OD2-CD 3.4Å; D444-R447 VanDerWaalsContact OD2-CG 3.28Å; D444-R447 WeakPolarHBondContact OD2-CG 3.25Å; D444-R447 IonicContact OD2-NE 3.88Å; E445-R447 VanDerWaalsContact C-N 3.33Å; E445-R447 PolarHBondContact O-N 3.3Å; R447-K449 HydrophobicContact CB-CB 4.37Å; R447-K449 HydrophobicContact CB-CG 4.1Å
448	G	95.6	Very high	94.9	Very high	3 Å²	3	20.6 Å²	20.6	3%	0.031	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	65	39.5	-174.7	0	0	0	0	0	112.6	D444 E445 F468	D444-G448 PolarHBondContact O-N 3.37Å; E445-G448 PolarHBondContact O-N 2.9Å; G448-F468 WeakPolarHBondContact CA-O 3.48Å; G448-F468 PolarHBondContact O-N 3.05Å
449	K	94.9	Very high	94.7	Very high	20 Å²	20	21.4 Å²	21.4	9%	0.087	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	151	-171.1	-69.3	-64.7	178	178.9	0	113	D444 R447 V462 E464 I466 H467	D444-K449 PolarHBondContact N-O 3.09Å; D444-K449 PolarHBondContact O-N 3.09Å; D444-K449 VanDerWaalsContact O-N 3.1Å; R447-K449 HydrophobicContact CB-CB 4.37Å; R447-K449 HydrophobicContact CB-CG 4.1Å; K449-V462 HydrophobicContact CB-CG1 3.84Å; K449-V462 HydrophobicContact CD-CG1 4.11Å; K449-V462 HydrophobicContact CG-CG1 4.03Å; K449-E464 PolarHBondContact NZ-O 3.5Å; K449-I466 WeakPolarHBondContact CD-O 3.44Å; K449-I466 PolarHBondContact NZ-O 3.44Å; K449-H467 PolarHBondContact NZ-CD2 2.78Å; K449-H467 PolarHBondContact NZ-CE1 2.88Å; K449-H467 VanDerWaalsContact NZ-CE1 3.3Å; K449-H467 PolarHBondContact NZ-NE2 2.78Å
450	I	97.1	Very high	94.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.8	168.3	-55.6	-59.1	0	0	0	108.4	A443 F463 F468 P471 I474 V485 I497	A443-I450 HydrophobicContact CB-CD1 3.88Å; I450-F463 HydrophobicContact CB-CD2 4.07Å; I450-F463 HydrophobicContact CG2-CD2 3.97Å; I450-F463 HydrophobicContact CG2-CE2 4.08Å; I450-F463 PolarHBondContact O-N 2.84Å; I450-F468 HydrophobicContact CD1-CE2 4.5Å; I450-F468 HydrophobicContact CG1-CD2 3.98Å; I450-F468 HydrophobicContact CG1-CE2 3.69Å; I450-P471 HydrophobicContact CD1-CB 3.93Å; I450-P471 HydrophobicContact CD1-CG 4.41Å; I450-I474 HydrophobicContact CD1-CD1 4.11Å; I450-V485 HydrophobicContact CD1-CG1 3.91Å; I450-V485 HydrophobicContact CD1-CG2 4.04Å; I450-V485 HydrophobicContact CG1-CG1 4.42Å; I450-V485 HydrophobicContact CG1-CG2 4.14Å; I450-I497 HydrophobicContact CG1-CD1 4.49Å
451	G	95.6	Very high	94.3	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	178.6	173	0	0	0	0	0	111.5	Y441 Y442 T461	Y441-G451 WeakPolarHBondContact CA-O 3.37Å; Y442-G451 WeakPolarHBondContact CD1-O 3.04Å; Y442-G451 PolarHBondContact N-O 3.03Å; Y442-G451 PolarHBondContact O-N 2.85Å; G451-T461 CarbonylContact C-O 3.55Å; G451-T461 WeakPolarHBondContact CA-O 3.38Å
452	F	97.1	Very high	94.1	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	158.9	172.6	74.4	-91.3	0	0	0	112.1	N439 I440 Y441 C460 T461 F463 L626 A628 L644	N439-F452 HydrophobicContact CB-CD2 3.89Å; N439-F452 HydrophobicContact CB-CE2 4.45Å; I440-F452 CarbonylContact O-C 3.52Å; I440-F452 WeakPolarHBondContact O-CA 3.49Å; I440-F452 WeakPolarHBondContact O-CB 3.07Å; Y441-F452 HydrophobicContact CD1-CB 3.63Å; Y441-F452 HydrophobicContact CD1-CD1 4.31Å; Y441-F452 HydrophobicContact CD1-CG 4.28Å; Y441-F452 HydrophobicContact CD2-CB 4.14Å; Y441-F452 HydrophobicContact CE1-CB 3.81Å; Y441-F452 AromaticContact CE1-CD1 3.74Å; Y441-F452 HydrophobicContact CE1-CD1 3.74Å; Y441-F452 AromaticContact CE1-CG 3.94Å; Y441-F452 HydrophobicContact CE1-CG 3.94Å; Y441-F452 HydrophobicContact CE2-CB 4.3Å; Y441-F452 HydrophobicContact CG-CB 3.8Å; F452-C460 CarbonylContact O-C 3.48Å; F452-C460 WeakPolarHBondContact O-CA 3.45Å; F452-T461 HydrophobicContact CD1-CG2 3.71Å; F452-T461 HydrophobicContact CE1-CG2 3.27Å; F452-T461 HydrophobicContact CE2-CG2 4.21Å; F452-T461 HydrophobicContact CG-CG2 4.34Å; F452-T461 HydrophobicContact CZ-CG2 3.54Å; F452-T461 PolarHBondContact N-O 2.71Å; F452-T461 PolarHBondContact O-N 3.21Å; F452-F463 AromaticContact CD1-CE1 3.99Å; F452-F463 HydrophobicContact CD1-CE1 3.99Å; F452-F463 HydrophobicContact CD1-CZ 4.02Å; F452-F463 AromaticContact CE1-CE1 3.91Å; F452-F463 HydrophobicContact CE1-CE1 3.91Å; F452-F463 HydrophobicContact CE1-CZ 4.23Å; F452-L626 HydrophobicContact CE2-CB 4.03Å; F452-L626 HydrophobicContact CE2-CD1 3.95Å; F452-L626 HydrophobicContact CE2-CD2 4.05Å; F452-L626 HydrophobicContact CE2-CG 4.23Å; F452-L626 HydrophobicContact CZ-CB 4.21Å; F452-L626 HydrophobicContact CZ-CD1 4.19Å; F452-A628 HydrophobicContact CE1-CB 4.44Å; F452-A628 HydrophobicContact CZ-CB 4.12Å; F452-L644 HydrophobicContact CE1-CD1 4.44Å; F452-L644 HydrophobicContact CE1-CD2 4.13Å; F452-L644 HydrophobicContact CZ-CB 4.31Å; F452-L644 HydrophobicContact CZ-CD1 3.99Å; F452-L644 HydrophobicContact CZ-CD2 4.29Å; F452-L644 HydrophobicContact CZ-CG 4.43Å
453	C	96.2	Very high	93.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	161.2	175.9	-59.3	0	0	0	0	111.8	F422 N439 I440 Y459 C460	F422-C453 HydrophobicContact CD1-CB 3.9Å; F422-C453 HydrophobicContact CD2-CB 4.42Å; F422-C453 WeakPolarHBondContact CD2-SG 3.34Å; F422-C453 HydrophobicContact CE1-CB 3.63Å; F422-C453 HydrophobicContact CE2-CB 4.18Å; F422-C453 WeakPolarHBondContact CE2-SG 3.06Å; F422-C453 HydrophobicContact CG-CB 4.27Å; F422-C453 HydrophobicContact CZ-CB 3.77Å; F422-C453 VanDerWaalsContact CZ-SG 3.57Å; N439-C453 CarbonylContact C-O 3.52Å; N439-C453 WeakPolarHBondContact CA-O 3.44Å; I440-C453 PolarHBondContact N-O 2.93Å; I440-C453 PolarHBondContact O-N 3.41Å; C453-Y459 CarbonylContact C-O 3.56Å; C453-Y459 WeakPolarHBondContact CA-O 3.25Å; C453-C460 HydrophobicContact CB-CB 4.07Å; C453-C460 WeakPolarHBondContact CB-SG 3.2Å; C453-C460 WeakPolarHBondContact SG-CB 2.99Å; C453-C460 CovalentContact SG-SG 2.03Å; C453-C460 PolarHBondContact SG-SG 3.28Å
454	S	94.4	Very high	93.6	Very high	15 Å²	15	28.5 Å²	28.5	11%	0.105	16%	0.156	C	C	.	.			trans	-60.4	158.7	165.5	54	0	0	0	0	111.3	D456 G457 R458 Y459	S454-D456 WeakPolarHBondContact CB-OD1 3.26Å; S454-D456 PolarHBondContact O-N 3.3Å; S454-D456 VanDerWaalsContact O-N 3.07Å; S454-D456 PolarHBondContact OG-OD1 2.67Å; S454-G457 PolarHBondContact O-N 3.35Å; S454-R458 PolarHBondContact OG-N 2.81Å; S454-Y459 PolarHBondContact N-O 2.61Å; S454-Y459 PolarHBondContact OG-N 2.98Å; S454-Y459 VanDerWaalsContact OG-N 3.13Å; S454-Y459 PolarHBondContact OG-O 3.02Å
455	S	92.8	Very high	93.4	Very high	57 Å²	57	36.4 Å²	36.4	40%	0.399	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-28	-178.6	51.8	0	0	0	0	114.8	G438	G438-S455 WeakPolarHBondContact O-CA 3.32Å; G438-S455 WeakPolarHBondContact O-CB 3.4Å; G438-S455 PolarHBondContact O-N 3.14Å
456	D	90.4	Very high	93.4	Very high	64 Å²	64	35 Å²	35	34%	0.342	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-4.4	177.6	67.2	-9.8	0	0	0	114	S454 R458 W671	S454-D456 WeakPolarHBondContact CB-OD1 3.26Å; S454-D456 PolarHBondContact O-N 3.3Å; S454-D456 VanDerWaalsContact O-N 3.07Å; S454-D456 PolarHBondContact OG-OD1 2.67Å; D456-R458 VanDerWaalsContact C-N 3.27Å; D456-R458 PolarHBondContact O-N 3.32Å; D456-R458 WeakPolarHBondContact OD1-CB 3.35Å; D456-R458 PolarHBondContact OD1-N 3.1Å; D456-R458 WeakPolarHBondContact OD2-CB 3.4Å; D456-W671 PolarHBondContact O-NE1 2.95Å
457	G	92	Very high	93.5	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.01	19%	0.187	C	C	.	.	S	Bend	trans	75	7.3	-176.4	0	0	0	0	0	115.5	F422 S454	F422-G457 VanDerWaalsContact CD1-CA 3.41Å; S454-G457 PolarHBondContact O-N 3.35Å
458	R	89.6	Confident	93.7	Very high	17 Å²	17	33.7 Å²	33.7	6%	0.064	17%	0.169	C	C	.	.	S	Bend	trans	-72.3	-39.7	-173.4	-178	-178.5	176.2	122.4	5.2	113.4	S454 D456 A685 Y727	S454-R458 PolarHBondContact OG-N 2.81Å; D456-R458 VanDerWaalsContact C-N 3.27Å; D456-R458 PolarHBondContact O-N 3.32Å; D456-R458 WeakPolarHBondContact OD1-CB 3.35Å; D456-R458 PolarHBondContact OD1-N 3.1Å; D456-R458 WeakPolarHBondContact OD2-CB 3.4Å; R458-A685 PolarHBondContact NH1-O 2.82Å; R458-A685 PolarHBondContact NH2-O 2.6Å; R458-Y727 HydrophobicContact CG-CD2 4.04Å; R458-Y727 HydrophobicContact CG-CE2 3.6Å; R458-Y727 WeakPolarHBondContact O-CE2 3.31Å; R458-Y727 PolarHBondContact O-OH 3.34Å
459	Y	91.3	Very high	93.6	Very high	29 Å²	29	35.7 Å²	35.7	11%	0.114	19%	0.19	C	C	.	.	S	Bend	trans	-122.2	128	-176.3	-60.9	-54.2	0	0	0	109.5	C453 S454 H625 P646 Y727 E729	C453-Y459 CarbonylContact C-O 3.56Å; C453-Y459 WeakPolarHBondContact CA-O 3.25Å; S454-Y459 PolarHBondContact N-O 2.61Å; S454-Y459 PolarHBondContact OG-N 2.98Å; S454-Y459 VanDerWaalsContact OG-N 3.13Å; S454-Y459 PolarHBondContact OG-O 3.02Å; Y459-H625 AromaticContact CD1-CD2 3.75Å; Y459-H625 HydrophobicContact CD2-CB 4.44Å; Y459-H625 AromaticContact CE1-CD2 3.51Å; Y459-H625 HydrophobicContact CG-CB 4.43Å; Y459-H625 AromaticContact CZ-CD2 3.75Å; Y459-P646 HydrophobicContact CD1-CG 3.75Å; Y459-P646 HydrophobicContact CG-CG 4.16Å; Y459-Y727 HydrophobicContact CD1-CE2 4.38Å; Y459-Y727 AromaticContact CE1-CD2 3.87Å; Y459-Y727 HydrophobicContact CE1-CD2 3.87Å; Y459-Y727 HydrophobicContact CE1-CE2 4.02Å; Y459-E729 HydrophobicContact CE1-CG 4.26Å; Y459-E729 WeakPolarHBondContact OH-CG 3.33Å
460	C	93.6	Very high	93.7	Very high	8 Å²	8	38.4 Å²	38.4	5%	0.054	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.2	-177.1	-61.3	0	0	0	0	111.3	F452 C453 P646 N647 I669	F452-C460 CarbonylContact O-C 3.48Å; F452-C460 WeakPolarHBondContact O-CA 3.45Å; C453-C460 HydrophobicContact CB-CB 4.07Å; C453-C460 WeakPolarHBondContact CB-SG 3.2Å; C453-C460 WeakPolarHBondContact SG-CB 2.99Å; C453-C460 CovalentContact SG-SG 2.03Å; C453-C460 PolarHBondContact SG-SG 3.28Å; C460-P646 CarbonylContact O-C 3.4Å; C460-P646 WeakPolarHBondContact O-CA 3.45Å; C460-N647 PolarHBondContact O-N 2.03Å; C460-I669 HydrophobicContact CB-CB 3.89Å; C460-I669 HydrophobicContact CB-CD1 3.91Å; C460-I669 HydrophobicContact CB-CG1 4.35Å; C460-I669 HydrophobicContact CB-CG2 4.24Å
461	T	93	Very high	93.8	Very high	15 Å²	15	38.4 Å²	38.4	9%	0.092	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	154.1	177.5	-160.7	0	0	0	0	111	G451 F452 L626 L644 C645 N647	G451-T461 CarbonylContact C-O 3.55Å; G451-T461 WeakPolarHBondContact CA-O 3.38Å; F452-T461 HydrophobicContact CD1-CG2 3.71Å; F452-T461 HydrophobicContact CE1-CG2 3.27Å; F452-T461 HydrophobicContact CE2-CG2 4.21Å; F452-T461 HydrophobicContact CG-CG2 4.34Å; F452-T461 HydrophobicContact CZ-CG2 3.54Å; F452-T461 PolarHBondContact N-O 2.71Å; F452-T461 PolarHBondContact O-N 3.21Å; T461-L626 HydrophobicContact CG2-CD1 3.81Å; T461-L644 HydrophobicContact CG2-CD2 4.35Å; T461-C645 WeakPolarHBondContact CB-O 3.29Å; T461-C645 PolarHBondContact OG1-O 2.77Å; T461-N647 WeakPolarHBondContact CA-OD1 3.41Å
462	V	93.2	Very high	93.8	Very high	20 Å²	20	40 Å²	40	12%	0.121	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.2	179.9	175.1	0	0	0	0	109.6	Y442 K449 E464 N647 I669	Y442-V462 WeakPolarHBondContact OH-CG2 3.29Å; K449-V462 HydrophobicContact CB-CG1 3.84Å; K449-V462 HydrophobicContact CD-CG1 4.11Å; K449-V462 HydrophobicContact CG-CG1 4.03Å; V462-E464 VanDerWaalsContact C-N 3.3Å; V462-E464 PolarHBondContact O-N 2.69Å; V462-N647 PolarHBondContact N-OD1 2.71Å; V462-I669 HydrophobicContact CG2-CD1 4.37Å
463	F	94.4	Very high	93.8	Very high	13 Å²	13	40 Å²	40	6%	0.057	21%	0.209	C	C	.	.			trans	-75.6	81.6	175	-61.7	-24.5	0	0	0	111.2	Y441 I450 F452 Q465 I466 L483 I497	Y441-F463 HydrophobicContact CE1-CE2 4.49Å; Y441-F463 HydrophobicContact CE1-CZ 4.11Å; I450-F463 HydrophobicContact CB-CD2 4.07Å; I450-F463 HydrophobicContact CG2-CD2 3.97Å; I450-F463 HydrophobicContact CG2-CE2 4.08Å; I450-F463 PolarHBondContact O-N 2.84Å; F452-F463 AromaticContact CD1-CE1 3.99Å; F452-F463 HydrophobicContact CD1-CE1 3.99Å; F452-F463 HydrophobicContact CD1-CZ 4.02Å; F452-F463 AromaticContact CE1-CE1 3.91Å; F452-F463 HydrophobicContact CE1-CE1 3.91Å; F452-F463 HydrophobicContact CE1-CZ 4.23Å; F463-Q465 PolarHBondContact O-N 3.47Å; F463-Q465 VanDerWaalsContact O-N 3.17Å; F463-I466 HydrophobicContact CB-CB 4.17Å; F463-I466 HydrophobicContact CB-CD1 4.05Å; F463-I466 HydrophobicContact CB-CG1 4.27Å; F463-I466 HydrophobicContact CD2-CD1 4.06Å; F463-I466 HydrophobicContact CG-CD1 4.32Å; F463-I466 PolarHBondContact O-N 2.87Å; F463-I466 VanDerWaalsContact O-N 3.09Å; F463-I466 VanDerWaalsContact O-O 3.12Å; F463-L483 HydrophobicContact CE2-CD2 4.29Å; F463-I497 HydrophobicContact CD2-CG2 4.22Å; F463-I497 HydrophobicContact CE2-CG2 4.05Å
464	E	90.8	Very high	93.9	Very high	105 Å²	105	40.5 Å²	40.5	49%	0.491	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-31.1	-174.5	-67.9	-66.4	-179.4	0	0	113.9	K449 V462 I466 H467	K449-E464 PolarHBondContact NZ-O 3.5Å; V462-E464 VanDerWaalsContact C-N 3.3Å; V462-E464 PolarHBondContact O-N 2.69Å; E464-I466 VanDerWaalsContact C-N 3.34Å; E464-H467 PolarHBondContact O-CE1 3.49Å
465	Q	91	Very high	94.1	Very high	172 Å²	172	40.2 Å²	40.2	80%	0.804	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-15.4	-178.8	-57.8	-56.8	-28.3	0	0	113.6	F463 H467	F463-Q465 PolarHBondContact O-N 3.47Å; F463-Q465 VanDerWaalsContact O-N 3.17Å; Q465-H467 PolarHBondContact O-ND1 3Å
466	I	94	Very high	94.4	Very high	12 Å²	12	37.6 Å²	37.6	6%	0.062	19%	0.192	C	C	.	.			trans	-99.3	130.8	-179.5	-58.6	175.8	0	0	0	108	K449 F463 E464 F468 I497 M504	K449-I466 WeakPolarHBondContact CD-O 3.44Å; K449-I466 PolarHBondContact NZ-O 3.44Å; F463-I466 HydrophobicContact CB-CB 4.17Å; F463-I466 HydrophobicContact CB-CD1 4.05Å; F463-I466 HydrophobicContact CB-CG1 4.27Å; F463-I466 HydrophobicContact CD2-CD1 4.06Å; F463-I466 HydrophobicContact CG-CD1 4.32Å; F463-I466 PolarHBondContact O-N 2.87Å; F463-I466 VanDerWaalsContact O-N 3.09Å; F463-I466 VanDerWaalsContact O-O 3.12Å; E464-I466 VanDerWaalsContact C-N 3.34Å; I466-F468 HydrophobicContact CG2-CD2 4Å; I466-F468 HydrophobicContact CG2-CE2 3.39Å; I466-F468 HydrophobicContact CG2-CZ 3.93Å; I466-I497 HydrophobicContact CD1-CD1 4.33Å; I466-I497 HydrophobicContact CD1-CG1 4.16Å; I466-I497 HydrophobicContact CD1-CG2 3.54Å; I466-I497 HydrophobicContact CG2-CD1 4.25Å; I466-M504 HydrophobicContact CD1-CB 3.99Å; I466-M504 HydrophobicContact CD1-CG 4.44Å; I466-M504 HydrophobicContact CG1-CB 4.2Å; I466-M504 HydrophobicContact CG2-CG 4.31Å
467	H	93.9	Very high	94.7	Very high	135 Å²	135	34.6 Å²	34.6	63%	0.625	18%	0.176	S	C	*	.			trans	-131.2	128	-176.5	-63.8	79.9	0	0	0	109.2	K449 E464 Q465	K449-H467 PolarHBondContact NZ-CD2 2.78Å; K449-H467 PolarHBondContact NZ-CE1 2.88Å; K449-H467 VanDerWaalsContact NZ-CE1 3.3Å; K449-H467 PolarHBondContact NZ-NE2 2.78Å; E464-H467 PolarHBondContact O-CE1 3.49Å; Q465-H467 PolarHBondContact O-ND1 3Å
468	F	96.2	Very high	94.8	Very high	22 Å²	22	35 Å²	35	10%	0.096	18%	0.178	C	C	.	.			trans	-118.1	162.5	174.5	-70.3	-72.7	0	0	0	110.1	G448 I450 I466 P471 V485 D487 I497 M504	G448-F468 WeakPolarHBondContact CA-O 3.48Å; G448-F468 PolarHBondContact O-N 3.05Å; I450-F468 HydrophobicContact CD1-CE2 4.5Å; I450-F468 HydrophobicContact CG1-CD2 3.98Å; I450-F468 HydrophobicContact CG1-CE2 3.69Å; I466-F468 HydrophobicContact CG2-CD2 4Å; I466-F468 HydrophobicContact CG2-CE2 3.39Å; I466-F468 HydrophobicContact CG2-CZ 3.93Å; F468-P471 HydrophobicContact CB-CB 4.02Å; F468-P471 HydrophobicContact CB-CG 3.98Å; F468-P471 HydrophobicContact CD2-CB 4.25Å; F468-P471 HydrophobicContact CG-CB 4.17Å; F468-V485 HydrophobicContact CE1-CG1 4.45Å; F468-V485 HydrophobicContact CE2-CG1 4.23Å; F468-V485 HydrophobicContact CZ-CB 4.22Å; F468-V485 HydrophobicContact CZ-CG1 4.11Å; F468-D487 WeakPolarHBondContact CA-OD2 3.18Å; F468-D487 WeakPolarHBondContact CB-OD2 3.16Å; F468-D487 HydrophobicContact CD1-CB 3.8Å; F468-D487 WeakPolarHBondContact CD1-OD2 3.28Å; F468-D487 HydrophobicContact CE1-CB 4.44Å; F468-I497 HydrophobicContact CE2-CD1 3.75Å; F468-I497 HydrophobicContact CZ-CD1 3.64Å; F468-M504 HydrophobicContact CE1-CE 3.87Å; F468-M504 HydrophobicContact CZ-CE 3.94Å
469	G	94.5	Very high	94.9	Very high	45 Å²	45	37.9 Å²	37.9	46%	0.464	19%	0.191	S	C	.	.	S	Bend	trans	-75.4	-67.8	168	0	0	0	0	0	110.3	D487	G469-D487 PolarHBondContact N-OD2 2.79Å
470	M	97	Very high	94.9	Very high	76 Å²	76	38.9 Å²	38.9	37%	0.374	20%	0.199	S	C	.	.	S	Bend	trans	-141.3	80.2	-177.7	-66.7	176	162.7	0	0	109.2	E445 D487 W488	E445-M470 HydrophobicContact CG-CB 4.14Å; E445-M470 HydrophobicContact CG-CG 4.45Å; M470-D487 VanDerWaalsContact C-OD1 3.25Å; M470-D487 WeakPolarHBondContact CA-OD1 3.18Å; M470-D487 PolarHBondContact N-OD1 2.89Å; M470-D487 WeakPolarHBondContact O-CA 3.43Å; M470-D487 VanDerWaalsContact O-OD1 3.13Å; M470-W488 HydrophobicContact CB-CD2 4.1Å; M470-W488 HydrophobicContact CB-CG 4.22Å; M470-W488 HydrophobicContact CB-CZ2 4.13Å; M470-W488 HydrophobicContact CG-CZ2 4.34Å; M470-W488 PolarHBondContact O-N 2.01Å; M470-W488 VanDerWaalsContact O-N 3.09Å; M470-W488 PolarHBondContact O-NE1 2.78Å; M470-W488 HydrophobicContact SD-CD2 4.23Å; M470-W488 HydrophobicContact SD-CE3 4.19Å; M470-W488 HydrophobicContact SD-CH2 3.52Å; M470-W488 VanDerWaalsContact SD-CH2 3.52Å; M470-W488 HydrophobicContact SD-CZ2 3.55Å; M470-W488 VanDerWaalsContact SD-CZ2 3.55Å; M470-W488 HydrophobicContact SD-CZ3 3.86Å
471	P	97.9	Very high	95	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	140.5	178.1	29.2	-34.5	0	0	0	110.7	A443 I450 F468 V485 T486	A443-P471 HydrophobicContact CB-CB 4.17Å; A443-P471 HydrophobicContact CB-CG 4.41Å; I450-P471 HydrophobicContact CD1-CB 3.93Å; I450-P471 HydrophobicContact CD1-CG 4.41Å; F468-P471 HydrophobicContact CB-CB 4.02Å; F468-P471 HydrophobicContact CB-CG 3.98Å; F468-P471 HydrophobicContact CD2-CB 4.25Å; F468-P471 HydrophobicContact CG-CB 4.17Å; P471-V485 HydrophobicContact CB-CG1 3.98Å; P471-T486 CarbonylContact C-O 3.55Å; P471-T486 WeakPolarHBondContact CA-O 3.48Å
472	R	96.9	Very high	95.2	Very high	33 Å²	33	40.4 Å²	40.4	13%	0.125	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	-84.6	-178.8	-173	179.5	-74	-108.1	-1.8	112.6	A429 N430 E445 T486 N516	A429-R472 HydrophobicContact CB-CB 4.41Å; A429-R472 HydrophobicContact CB-CG 4.28Å; N430-R472 WeakPolarHBondContact CB-O 3.45Å; E445-R472 IonicContact OE2-NH2 2.94Å; R472-T486 PolarHBondContact N-O 2.74Å; R472-N516 WeakPolarHBondContact CD-O 3.39Å; R472-N516 WeakPolarHBondContact CG-O 3.36Å
473	G	97.7	Very high	95.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	139.6	-176.4	0	0	0	0	0	112.1	V485 T486 N516	G473-V485 VanDerWaalsContact O-CA 3.28Å; G473-V485 WeakPolarHBondContact O-CA 3.36Å; G473-T486 WeakPolarHBondContact CA-OG1 3.46Å; G473-T486 PolarHBondContact N-OG1 2.95Å; G473-T486 PolarHBondContact O-N 3.25Å; G473-N516 PolarHBondContact N-O 2.86Å
474	I	98.4	Very high	95.6	Very high	12 Å²	12	38.9 Å²	38.9	6%	0.062	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	130.6	174.5	-59.4	-178.3	0	0	0	109.4	A432 A443 I450 L476 F484 V485	A432-I474 HydrophobicContact CB-CB 4.23Å; A432-I474 HydrophobicContact CB-CG2 3.7Å; A443-I474 HydrophobicContact CB-CD1 3.64Å; A443-I474 HydrophobicContact CB-CG1 4.09Å; I450-I474 HydrophobicContact CD1-CD1 4.11Å; I474-L476 HydrophobicContact CG2-CD2 4.2Å; I474-F484 WeakPolarHBondContact CA-O 3.16Å; I474-V485 HydrophobicContact CG1-CG2 4.33Å
475	A	98.4	Very high	96	Very high	8 Å²	8	33.9 Å²	33.9	7%	0.066	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.2	167.5	0	0	0	0	0	111.1	L483 F484 V518 I520	A475-L483 CarbonylContact O-C 3.6Å; A475-L483 VanDerWaalsContact O-CA 3.27Å; A475-L483 WeakPolarHBondContact O-CA 3.33Å; A475-F484 PolarHBondContact N-O 3.32Å; A475-F484 PolarHBondContact O-N 3.01Å; A475-V518 HydrophobicContact CB-CG1 4.18Å; A475-I520 HydrophobicContact CB-CD1 3.7Å; A475-I520 HydrophobicContact CB-CG1 3.75Å
476	L	97.9	Very high	96.3	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.016	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	143.8	-179.9	-57.2	-179.9	0	0	0	111.4	A432 V433 D434 Y441 I474 L483 Y522	A432-L476 HydrophobicContact CB-CD1 3.88Å; A432-L476 HydrophobicContact CB-CD2 4.27Å; A432-L476 HydrophobicContact CB-CG 3.64Å; V433-L476 VanDerWaalsContact C-CD1 3.41Å; D434-L476 HydrophobicContact CB-CD1 4.15Å; Y441-L476 HydrophobicContact CD1-CD2 4.43Å; Y441-L476 HydrophobicContact CD2-CD1 3.68Å; Y441-L476 HydrophobicContact CD2-CD2 3.84Å; Y441-L476 HydrophobicContact CD2-CG 4.43Å; Y441-L476 HydrophobicContact CE2-CD1 4.27Å; Y441-L476 HydrophobicContact CE2-CD2 4.38Å; Y441-L476 HydrophobicContact CG-CD1 4.4Å; Y441-L476 HydrophobicContact CG-CD2 3.88Å; I474-L476 HydrophobicContact CG2-CD2 4.2Å; L476-L483 HydrophobicContact CD2-CB 3.44Å; L476-L483 VanDerWaalsContact CD2-CB 3.44Å; L476-L483 HydrophobicContact CD2-CD2 4.07Å; L476-L483 HydrophobicContact CD2-CG 4.39Å; L476-Y522 VanDerWaalsContact O-CE1 3.25Å; L476-Y522 WeakPolarHBondContact O-CE1 3.38Å; L476-Y522 PolarHBondContact O-OH 2.87Å
477	Y	96.4	Very high	96.5	Very high	1 Å²	1	25.5 Å²	25.5	0%	0.004	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	80.6	169.3	-155.9	163.8	0	0	0	112.1	K479 L480 G481 Y482 I520 Y522 D525 L542 W614	Y477-K479 VanDerWaalsContact C-N 3.29Å; Y477-K479 HydrophobicContact CD2-CB 3.72Å; Y477-K479 HydrophobicContact CE2-CB 3.37Å; Y477-K479 HydrophobicContact CE2-CD 3.64Å; Y477-K479 HydrophobicContact CE2-CG 4.16Å; Y477-K479 PolarHBondContact O-N 3.12Å; Y477-K479 WeakPolarHBondContact OH-CD 3.38Å; Y477-K479 PolarHBondContact OH-NZ 3.3Å; Y477-L480 HydrophobicContact CD1-CD1 3.92Å; Y477-L480 HydrophobicContact CD1-CG 4.34Å; Y477-L480 HydrophobicContact CE1-CD1 3.82Å; Y477-L480 HydrophobicContact CE1-CG 4.3Å; Y477-L480 HydrophobicContact CG-CG 4.48Å; Y477-L480 PolarHBondContact O-N 3.09Å; Y477-L480 VanDerWaalsContact O-N 3.08Å; Y477-G481 PolarHBondContact O-N 3.47Å; Y477-Y482 CarbonylContact C-O 3.55Å; Y477-Y482 WeakPolarHBondContact CA-O 3.39Å; Y477-Y482 PolarHBondContact N-O 3.26Å; Y477-Y482 PolarHBondContact O-N 2.85Å; Y477-I520 HydrophobicContact CD1-CD1 4.47Å; Y477-I520 HydrophobicContact CD1-CG2 3.98Å; Y477-I520 HydrophobicContact CE1-CG2 4.19Å; Y477-Y522 HydrophobicContact CD1-CD1 4.36Å; Y477-Y522 AromaticContact CD2-CD1 3.8Å; Y477-Y522 HydrophobicContact CD2-CD1 3.8Å; Y477-Y522 HydrophobicContact CD2-CE1 4.02Å; Y477-Y522 HydrophobicContact CE1-CD1 4.3Å; Y477-Y522 AromaticContact CE2-CD1 3.72Å; Y477-Y522 HydrophobicContact CE2-CD1 3.72Å; Y477-Y522 HydrophobicContact CE2-CE1 4.4Å; Y477-Y522 HydrophobicContact CG-CD1 4.15Å; Y477-Y522 HydrophobicContact CG-CE1 4.14Å; Y477-Y522 PolarHBondContact OH-O 2.7Å; Y477-D525 VanDerWaalsContact CE1-OD1 3.22Å; Y477-D525 WeakPolarHBondContact CE1-OD1 3.02Å; Y477-D525 VanDerWaalsContact CZ-OD1 3.23Å; Y477-D525 PolarHBondContact OH-OD1 3.21Å; Y477-L542 HydrophobicContact CD1-CD1 3.83Å; Y477-L542 HydrophobicContact CE1-CD1 3.69Å; Y477-W614 HydrophobicContact CE2-CH2 4.09Å
478	P	94.5	Very high	96.6	Very high	8 Å²	8	21.8 Å²	21.8	5%	0.052	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-33.6	-177	-26.6	35.1	0	0	0	115.1	W435 I436 L480 G481 M499 W614	W435-P478 HydrophobicContact CH2-CG 4.15Å; W435-P478 HydrophobicContact CZ2-CG 4.08Å; W435-P478 HydrophobicContact CZ3-CG 4.46Å; I436-P478 HydrophobicContact CG1-CB 3.97Å; I436-P478 HydrophobicContact CG1-CG 4.45Å; P478-L480 PolarHBondContact O-N 3.14Å; P478-G481 PolarHBondContact O-N 3.16Å; P478-M499 HydrophobicContact CG-CE 4.3Å; P478-W614 HydrophobicContact CB-CE3 4.38Å; P478-W614 HydrophobicContact CB-CZ3 4.42Å
479	K	91.1	Very high	96.4	Very high	78 Å²	78	21.4 Å²	21.4	34%	0.339	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.6	176.7	-173.5	-166.1	174	-169.5	0	113.4	Y477 D525 W614 L639	Y477-K479 VanDerWaalsContact C-N 3.29Å; Y477-K479 HydrophobicContact CD2-CB 3.72Å; Y477-K479 HydrophobicContact CE2-CB 3.37Å; Y477-K479 HydrophobicContact CE2-CD 3.64Å; Y477-K479 HydrophobicContact CE2-CG 4.16Å; Y477-K479 PolarHBondContact O-N 3.12Å; Y477-K479 WeakPolarHBondContact OH-CD 3.38Å; Y477-K479 PolarHBondContact OH-NZ 3.3Å; K479-D525 IonicContact NZ-OD1 3.81Å; K479-W614 HydrophobicContact CB-CD2 3.98Å; K479-W614 HydrophobicContact CB-CE3 3.97Å; K479-W614 HydrophobicContact CB-CH2 3.73Å; K479-W614 HydrophobicContact CB-CZ2 3.73Å; K479-W614 HydrophobicContact CB-CZ3 3.85Å; K479-W614 HydrophobicContact CD-CH2 4.39Å; K479-W614 HydrophobicContact CD-CZ2 3.78Å; K479-W614 HydrophobicContact CG-CD2 4.34Å; K479-W614 HydrophobicContact CG-CH2 4.43Å; K479-W614 HydrophobicContact CG-CZ2 3.92Å; K479-L639 WeakPolarHBondContact O-CD1 3.46Å
480	L	92.4	Very high	96	Very high	51 Å²	51	29.4 Å²	29.4	27%	0.267	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-8	-179	-60.8	-178.1	0	0	0	112.8	Y477 P478 Y482 L542 P631	Y477-L480 HydrophobicContact CD1-CD1 3.92Å; Y477-L480 HydrophobicContact CD1-CG 4.34Å; Y477-L480 HydrophobicContact CE1-CD1 3.82Å; Y477-L480 HydrophobicContact CE1-CG 4.3Å; Y477-L480 HydrophobicContact CG-CG 4.48Å; Y477-L480 PolarHBondContact O-N 3.09Å; Y477-L480 VanDerWaalsContact O-N 3.08Å; P478-L480 PolarHBondContact O-N 3.14Å; L480-Y482 VanDerWaalsContact C-N 3.35Å; L480-Y482 HydrophobicContact CB-CD2 3.81Å; L480-Y482 HydrophobicContact CB-CE2 4.42Å; L480-Y482 WeakPolarHBondContact O-CD2 3.34Å; L480-L542 HydrophobicContact CD1-CD1 3.68Å; L480-P631 WeakPolarHBondContact O-CA 3.36Å
481	G	94.8	Very high	95.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	28.7	-178.6	0	0	0	0	0	113.5	Y477 P478 M499	Y477-G481 PolarHBondContact O-N 3.47Å; P478-G481 PolarHBondContact O-N 3.16Å; G481-M499 PolarHBondContact O-N 2.66Å
482	Y	97.5	Very high	95.6	Very high	55 Å²	55	32.9 Å²	32.9	22%	0.216	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	154.1	179.4	-68	-62.6	0	0	0	112	Y477 L480 R496 I497 M499 P631	Y477-Y482 CarbonylContact C-O 3.55Å; Y477-Y482 WeakPolarHBondContact CA-O 3.39Å; Y477-Y482 PolarHBondContact N-O 3.26Å; Y477-Y482 PolarHBondContact O-N 2.85Å; L480-Y482 VanDerWaalsContact C-N 3.35Å; L480-Y482 HydrophobicContact CB-CD2 3.81Å; L480-Y482 HydrophobicContact CB-CE2 4.42Å; L480-Y482 WeakPolarHBondContact O-CD2 3.34Å; Y482-R496 HydrophobicContact CD1-CG 3.69Å; Y482-R496 HydrophobicContact CE1-CG 4.26Å; Y482-R496 HydrophobicContact CG-CG 3.85Å; Y482-I497 CarbonylContact C-O 3.55Å; Y482-I497 VanDerWaalsContact CA-O 3.31Å; Y482-I497 WeakPolarHBondContact CA-O 3.41Å; Y482-M499 VanDerWaalsContact C-CG 3.5Å; Y482-P631 HydrophobicContact CD1-CB 4.46Å; Y482-P631 HydrophobicContact CE1-CB 3.69Å; Y482-P631 HydrophobicContact CE1-CG 3.69Å; Y482-P631 HydrophobicContact CE2-CB 3.86Å; Y482-P631 VanDerWaalsContact OH-CB 3.25Å; Y482-P631 WeakPolarHBondContact OH-CB 3.47Å
483	L	98.1	Very high	95.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	152.6	163.4	63.7	89.9	0	0	0	109.8	Y441 F463 A475 L476 V485 R496 I497 M499	Y441-L483 HydrophobicContact CD1-CD2 3.45Å; Y441-L483 VanDerWaalsContact CD1-CD2 3.45Å; Y441-L483 HydrophobicContact CE1-CD2 3.52Å; Y441-L483 HydrophobicContact CG-CD2 4.29Å; F463-L483 HydrophobicContact CE2-CD2 4.29Å; A475-L483 CarbonylContact O-C 3.6Å; A475-L483 VanDerWaalsContact O-CA 3.27Å; A475-L483 WeakPolarHBondContact O-CA 3.33Å; L476-L483 HydrophobicContact CD2-CB 3.44Å; L476-L483 VanDerWaalsContact CD2-CB 3.44Å; L476-L483 HydrophobicContact CD2-CD2 4.07Å; L476-L483 HydrophobicContact CD2-CG 4.39Å; L483-V485 HydrophobicContact CD1-CG2 3.41Å; L483-V485 VanDerWaalsContact CD1-CG2 3.41Å; L483-R496 WeakPolarHBondContact O-CA 3.34Å; L483-I497 HydrophobicContact CD1-CB 3.71Å; L483-I497 HydrophobicContact CD1-CD1 3.87Å; L483-I497 HydrophobicContact CD1-CG1 4.32Å; L483-I497 HydrophobicContact CD1-CG2 4.22Å; L483-I497 HydrophobicContact CG-CB 3.99Å; L483-I497 HydrophobicContact CG-CG2 4.32Å; L483-I497 PolarHBondContact N-O 2.86Å; L483-I497 PolarHBondContact O-N 3.47Å; L483-M499 HydrophobicContact CB-CG 4.26Å; L483-M499 HydrophobicContact CD2-CG 4.25Å
484	F	98.7	Very high	95.6	Very high	1 Å²	1	31.5 Å²	31.5	0%	0.004	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.2	-179.9	-64.6	-98.1	0	0	0	109.2	I474 A475 S495 R496 V507 V518 I520 L527 L542	I474-F484 WeakPolarHBondContact CA-O 3.16Å; A475-F484 PolarHBondContact N-O 3.32Å; A475-F484 PolarHBondContact O-N 3.01Å; F484-S495 CarbonylContact C-O 3.42Å; F484-S495 VanDerWaalsContact CA-O 3.26Å; F484-S495 WeakPolarHBondContact CA-O 3.36Å; F484-R496 HydrophobicContact CD1-CB 4.04Å; F484-R496 HydrophobicContact CD1-CG 4.33Å; F484-R496 HydrophobicContact CE1-CB 3.77Å; F484-R496 HydrophobicContact CE1-CG 3.77Å; F484-R496 HydrophobicContact CZ-CB 4.4Å; F484-R496 HydrophobicContact CZ-CG 3.88Å; F484-V507 HydrophobicContact CD1-CG2 4.14Å; F484-V507 HydrophobicContact CE1-CG2 4.02Å; F484-V518 HydrophobicContact CB-CG2 4.42Å; F484-I520 HydrophobicContact CD2-CD1 3.62Å; F484-I520 HydrophobicContact CD2-CG1 4.37Å; F484-I520 HydrophobicContact CE2-CD1 4.01Å; F484-L527 HydrophobicContact CB-CD1 4.01Å; F484-L527 HydrophobicContact CD1-CD1 3.91Å; F484-L527 HydrophobicContact CD1-CD2 3.95Å; F484-L527 HydrophobicContact CD2-CD1 4.29Å; F484-L527 HydrophobicContact CE1-CD1 4.46Å; F484-L527 HydrophobicContact CE1-CD2 4.46Å; F484-L527 HydrophobicContact CG-CD1 3.8Å; F484-L542 HydrophobicContact CE1-CD2 4.48Å; F484-L542 HydrophobicContact CE2-CD2 4.19Å; F484-L542 HydrophobicContact CZ-CB 4.05Å; F484-L542 HydrophobicContact CZ-CD2 3.85Å; F484-L542 HydrophobicContact CZ-CG 4.39Å
485	V	98.6	Very high	95.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	135.8	-175.8	178.8	0	0	0	0	109.8	I450 F468 P471 G473 I474 L483 I494 S495 I497	I450-V485 HydrophobicContact CD1-CG1 3.91Å; I450-V485 HydrophobicContact CD1-CG2 4.04Å; I450-V485 HydrophobicContact CG1-CG1 4.42Å; I450-V485 HydrophobicContact CG1-CG2 4.14Å; F468-V485 HydrophobicContact CE1-CG1 4.45Å; F468-V485 HydrophobicContact CE2-CG1 4.23Å; F468-V485 HydrophobicContact CZ-CB 4.22Å; F468-V485 HydrophobicContact CZ-CG1 4.11Å; P471-V485 HydrophobicContact CB-CG1 3.98Å; G473-V485 VanDerWaalsContact O-CA 3.28Å; G473-V485 WeakPolarHBondContact O-CA 3.36Å; I474-V485 HydrophobicContact CG1-CG2 4.33Å; L483-V485 HydrophobicContact CD1-CG2 3.41Å; L483-V485 VanDerWaalsContact CD1-CG2 3.41Å; V485-I494 WeakPolarHBondContact O-CA 3.49Å; V485-S495 PolarHBondContact N-O 3.28Å; V485-S495 PolarHBondContact O-N 3.24Å; V485-I497 HydrophobicContact CB-CD1 4.37Å; V485-I497 HydrophobicContact CG2-CD1 3.82Å
486	T	98.6	Very high	95.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	139.3	167.1	68.7	0	0	0	0	111	P471 R472 G473 S493 I494 P515 V518	P471-T486 CarbonylContact C-O 3.55Å; P471-T486 WeakPolarHBondContact CA-O 3.48Å; R472-T486 PolarHBondContact N-O 2.74Å; G473-T486 WeakPolarHBondContact CA-OG1 3.46Å; G473-T486 PolarHBondContact N-OG1 2.95Å; G473-T486 PolarHBondContact O-N 3.25Å; T486-S493 WeakPolarHBondContact CA-O 3.48Å; T486-I494 HydrophobicContact CG2-CG1 4.29Å; T486-P515 WeakPolarHBondContact CB-O 3.46Å; T486-P515 HydrophobicContact CG2-CB 4.08Å; T486-P515 PolarHBondContact OG1-O 2.86Å; T486-V518 HydrophobicContact CG2-CB 3.6Å; T486-V518 HydrophobicContact CG2-CG1 3.81Å
487	D	98	Very high	95.6	Very high	8 Å²	8	33.2 Å²	33.2	4%	0.043	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.3	172.2	-174.9	-4.9	0	0	0	107.9	F468 G469 M470 G489 A492 S493 P515	F468-D487 WeakPolarHBondContact CA-OD2 3.18Å; F468-D487 WeakPolarHBondContact CB-OD2 3.16Å; F468-D487 HydrophobicContact CD1-CB 3.8Å; F468-D487 WeakPolarHBondContact CD1-OD2 3.28Å; F468-D487 HydrophobicContact CE1-CB 4.44Å; G469-D487 PolarHBondContact N-OD2 2.79Å; M470-D487 VanDerWaalsContact C-OD1 3.25Å; M470-D487 WeakPolarHBondContact CA-OD1 3.18Å; M470-D487 PolarHBondContact N-OD1 2.89Å; M470-D487 WeakPolarHBondContact O-CA 3.43Å; M470-D487 VanDerWaalsContact O-OD1 3.13Å; D487-G489 PolarHBondContact OD1-N 3.16Å; D487-A492 CarbonylContact O-C 3.59Å; D487-A492 WeakPolarHBondContact O-CA 3.35Å; D487-S493 PolarHBondContact N-O 2.81Å; D487-S493 PolarHBondContact O-N 3.48Å; D487-P515 VanDerWaalsContact O-CG 3.31Å; D487-P515 WeakPolarHBondContact O-CG 3.35Å
488	W	95.8	Very high	95.6	Very high	57 Å²	57	33.2 Å²	33.2	22%	0.216	16%	0.156	C	C	.	.			trans	-107.1	11.5	179.3	68.7	-82.7	0	0	0	112.7	E445 M470	E445-W488 WeakPolarHBondContact OE1-CZ2 3.45Å; M470-W488 HydrophobicContact CB-CD2 4.1Å; M470-W488 HydrophobicContact CB-CG 4.22Å; M470-W488 HydrophobicContact CB-CZ2 4.13Å; M470-W488 HydrophobicContact CG-CZ2 4.34Å; M470-W488 PolarHBondContact O-N 2.01Å; M470-W488 VanDerWaalsContact O-N 3.09Å; M470-W488 PolarHBondContact O-NE1 2.78Å; M470-W488 HydrophobicContact SD-CD2 4.23Å; M470-W488 HydrophobicContact SD-CE3 4.19Å; M470-W488 HydrophobicContact SD-CH2 3.52Å; M470-W488 VanDerWaalsContact SD-CH2 3.52Å; M470-W488 HydrophobicContact SD-CZ2 3.55Å; M470-W488 VanDerWaalsContact SD-CZ2 3.55Å; M470-W488 HydrophobicContact SD-CZ3 3.86Å
489	G	92.6	Very high	95.7	Very high	13 Å²	13	32.8 Å²	32.8	13%	0.134	15%	0.154	C	C	.	.	S	Bend	trans	-69.1	-169.6	173.8	0	0	0	0	0	112.9	D487 N491 A492	D487-G489 PolarHBondContact OD1-N 3.16Å; G489-N491 PolarHBondContact O-N 3.11Å; G489-A492 PolarHBondContact O-N 3.15Å
490	K	85	Confident	95.9	Very high	213 Å²	213	29.6 Å²	29.6	93%	0.926	14%	0.14	S	C	*	.	S	Bend	trans	-53.7	-31	-177.4	-65.8	-175.4	179.5	-177.3	0	114.6
491	N	90.3	Very high	96.1	Very high	139 Å²	139	28.1 Å²	28.1	74%	0.743	14%	0.137	S	C	*	.	S	Bend	trans	-111.7	70.1	176.1	-65	-14.5	0	0	0	108.3	G489 S493	G489-N491 PolarHBondContact O-N 3.11Å; N491-S493 PolarHBondContact O-N 2.64Å
492	A	95.2	Very high	96	Very high	11 Å²	11	31.4 Å²	31.4	9%	0.091	16%	0.16	C	C	.	.			trans	-56.1	133.7	-177.6	0	0	0	0	0	110.6	D487 G489 L512 A513	D487-A492 CarbonylContact O-C 3.59Å; D487-A492 WeakPolarHBondContact O-CA 3.35Å; G489-A492 PolarHBondContact O-N 3.15Å; A492-L512 HydrophobicContact CB-CB 3.89Å; A492-A513 WeakPolarHBondContact CB-O 3.33Å
493	S	97.8	Very high	95.8	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	158.9	-174.5	68.6	0	0	0	0	112.8	T486 D487 N491 H508	T486-S493 WeakPolarHBondContact CA-O 3.48Å; D487-S493 PolarHBondContact N-O 2.81Å; D487-S493 PolarHBondContact O-N 3.48Å; N491-S493 PolarHBondContact O-N 2.64Å; S493-H508 WeakPolarHBondContact CA-O 3.5Å; S493-H508 WeakPolarHBondContact CB-O 3.02Å
494	I	98.5	Very high	95.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.5	167.4	-58.9	174.8	0	0	0	106.8	V485 T486 V507 H508 L512 L527 W529	V485-I494 WeakPolarHBondContact O-CA 3.49Å; T486-I494 HydrophobicContact CG2-CG1 4.29Å; I494-V507 HydrophobicContact CG2-CB 4.37Å; I494-V507 WeakPolarHBondContact O-CA 3.48Å; I494-V507 WeakPolarHBondContact O-CB 3.46Å; I494-V507 PolarHBondContact O-N 2.74Å; I494-H508 HydrophobicContact CB-CB 4.28Å; I494-H508 PolarHBondContact N-O 3.42Å; I494-H508 PolarHBondContact O-N 2.9Å; I494-H508 VanDerWaalsContact O-N 3.13Å; I494-L512 HydrophobicContact CD1-CD1 4.25Å; I494-L512 HydrophobicContact CD1-CD2 3.96Å; I494-L512 HydrophobicContact CG1-CD1 3.87Å; I494-L512 HydrophobicContact CG1-CD2 4.33Å; I494-L527 HydrophobicContact CG2-CD2 3.65Å; I494-W529 HydrophobicContact CD1-CB 3.94Å; I494-W529 HydrophobicContact CD1-CD2 3.29Å; I494-W529 HydrophobicContact CD1-CE3 3.87Å; I494-W529 HydrophobicContact CD1-CG 3.33Å; I494-W529 HydrophobicContact CD1-CZ2 4.28Å
495	S	98.4	Very high	95.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.8	-170.1	-65.5	0	0	0	0	111.7	F484 V485 M504 F506	F484-S495 CarbonylContact C-O 3.42Å; F484-S495 VanDerWaalsContact CA-O 3.26Å; F484-S495 WeakPolarHBondContact CA-O 3.36Å; V485-S495 PolarHBondContact N-O 3.28Å; V485-S495 PolarHBondContact O-N 3.24Å; S495-M504 WeakPolarHBondContact OG-CE 3.35Å; S495-F506 WeakPolarHBondContact OG-CD1 3.16Å
496	R	97.6	Very high	95.4	Very high	60 Å²	60	41.2 Å²	41.2	23%	0.226	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	125.1	170.9	-177.4	-179.9	66	-161.5	0.3	109.3	Y482 L483 F484 M504 T505 V507 L542	Y482-R496 HydrophobicContact CD1-CG 3.69Å; Y482-R496 HydrophobicContact CE1-CG 4.26Å; Y482-R496 HydrophobicContact CG-CG 3.85Å; L483-R496 WeakPolarHBondContact O-CA 3.34Å; F484-R496 HydrophobicContact CD1-CB 4.04Å; F484-R496 HydrophobicContact CD1-CG 4.33Å; F484-R496 HydrophobicContact CE1-CB 3.77Å; F484-R496 HydrophobicContact CE1-CG 3.77Å; F484-R496 HydrophobicContact CZ-CB 4.4Å; F484-R496 HydrophobicContact CZ-CG 3.88Å; R496-M504 WeakPolarHBondContact O-CA 3.32Å; R496-T505 PolarHBondContact N-O 3.04Å; R496-T505 PolarHBondContact NE-OG1 2.84Å; R496-T505 PolarHBondContact NH2-OG1 3.14Å; R496-T505 PolarHBondContact O-N 2.6Å; R496-V507 HydrophobicContact CB-CG2 3.72Å; R496-L542 PolarHBondContact NH1-O 3.38Å
497	I	97.9	Very high	95.3	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	137.9	-176.8	-64.3	161.2	0	0	0	108.7	I450 F463 I466 F468 Y482 L483 V485 M499 S503 M504	I450-I497 HydrophobicContact CG1-CD1 4.49Å; F463-I497 HydrophobicContact CD2-CG2 4.22Å; F463-I497 HydrophobicContact CE2-CG2 4.05Å; I466-I497 HydrophobicContact CD1-CD1 4.33Å; I466-I497 HydrophobicContact CD1-CG1 4.16Å; I466-I497 HydrophobicContact CD1-CG2 3.54Å; I466-I497 HydrophobicContact CG2-CD1 4.25Å; F468-I497 HydrophobicContact CE2-CD1 3.75Å; F468-I497 HydrophobicContact CZ-CD1 3.64Å; Y482-I497 CarbonylContact C-O 3.55Å; Y482-I497 VanDerWaalsContact CA-O 3.31Å; Y482-I497 WeakPolarHBondContact CA-O 3.41Å; L483-I497 HydrophobicContact CD1-CB 3.71Å; L483-I497 HydrophobicContact CD1-CD1 3.87Å; L483-I497 HydrophobicContact CD1-CG1 4.32Å; L483-I497 HydrophobicContact CD1-CG2 4.22Å; L483-I497 HydrophobicContact CG-CB 3.99Å; L483-I497 HydrophobicContact CG-CG2 4.32Å; L483-I497 PolarHBondContact N-O 2.86Å; L483-I497 PolarHBondContact O-N 3.47Å; V485-I497 HydrophobicContact CB-CD1 4.37Å; V485-I497 HydrophobicContact CG2-CD1 3.82Å; I497-M499 PolarHBondContact O-N 2.81Å; I497-S503 WeakPolarHBondContact CA-O 3.45Å; I497-M504 HydrophobicContact CD1-CG 4.38Å; I497-M504 HydrophobicContact CG1-CB 4.08Å; I497-M504 HydrophobicContact CG1-CG 3.56Å
498	A	96.9	Very high	95.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	136.3	168.5	0	0	0	0	0	109.8	D500 G501 S502 S503 P631	A498-D500 WeakPolarHBondContact CB-OD1 3.2Å; A498-D500 PolarHBondContact O-N 2.95Å; A498-G501 WeakPolarHBondContact O-CA 3.09Å; A498-G501 PolarHBondContact O-N 2.82Å; A498-S502 WeakPolarHBondContact CB-OG 3.38Å; A498-S503 PolarHBondContact N-O 2.89Å; A498-P631 HydrophobicContact CB-CG 4.12Å
499	M	97.2	Very high	94.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.1	-177.7	-76.5	175.7	74.7	0	0	113.7	D434 Y441 P478 G481 Y482 L483 I497 V629	D434-M499 HydrophobicContact CB-CE 4.05Å; D434-M499 WeakPolarHBondContact OD2-CE 3.29Å; Y441-M499 WeakPolarHBondContact CE1-O 3.08Å; Y441-M499 HydrophobicContact CE2-CE 3.9Å; Y441-M499 PolarHBondContact OH-O 3.17Å; P478-M499 HydrophobicContact CG-CE 4.3Å; G481-M499 PolarHBondContact O-N 2.66Å; Y482-M499 VanDerWaalsContact C-CG 3.5Å; L483-M499 HydrophobicContact CB-CG 4.26Å; L483-M499 HydrophobicContact CD2-CG 4.25Å; I497-M499 PolarHBondContact O-N 2.81Å; M499-V629 CarbonylContact C-O 3.5Å; M499-V629 HydrophobicContact CB-CG2 4.29Å; M499-V629 WeakPolarHBondContact CB-O 3.03Å; M499-V629 HydrophobicContact CE-CG2 4.06Å; M499-V629 HydrophobicContact SD-CG2 3.84Å
500	D	95.1	Very high	94.6	Very high	11 Å²	11	52.4 Å²	52.4	6%	0.059	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	5.8	170.9	71.3	-11.6	0	0	0	114.3	A498 S502 A628 V629 S642 L644	A498-D500 WeakPolarHBondContact CB-OD1 3.2Å; A498-D500 PolarHBondContact O-N 2.95Å; D500-S502 PolarHBondContact O-N 3.5Å; D500-S502 WeakPolarHBondContact OD1-CB 3.2Å; D500-S502 PolarHBondContact OD1-N 2.77Å; D500-S502 VanDerWaalsContact OD1-N 3.14Å; D500-S502 PolarHBondContact OD1-OG 3.03Å; D500-A628 HydrophobicContact CB-CB 3.96Å; D500-V629 PolarHBondContact N-O 2.96Å; D500-V629 VanDerWaalsContact N-O 3.16Å; D500-S642 VanDerWaalsContact OD2-CB 3.28Å; D500-S642 WeakPolarHBondContact OD2-CB 3.38Å; D500-S642 PolarHBondContact OD2-OG 3.33Å; D500-L644 HydrophobicContact CB-CD1 4.26Å
501	G	95.2	Very high	94.6	Very high	20 Å²	20	43.5 Å²	43.5	21%	0.206	23%	0.229	C	C	.	.	S	Bend	trans	70.7	10.5	-179.5	0	0	0	0	0	114.7	A498	A498-G501 WeakPolarHBondContact O-CA 3.09Å; A498-G501 PolarHBondContact O-N 2.82Å
502	S	93.3	Very high	94.6	Very high	68 Å²	68	37.8 Å²	37.8	48%	0.476	20%	0.198	S	C	.	.	S	Bend	trans	-73.7	-24.7	-173.6	61.3	0	0	0	0	114.7	A498 D500	A498-S502 WeakPolarHBondContact CB-OG 3.38Å; D500-S502 PolarHBondContact O-N 3.5Å; D500-S502 WeakPolarHBondContact OD1-CB 3.2Å; D500-S502 PolarHBondContact OD1-N 2.77Å; D500-S502 VanDerWaalsContact OD1-N 3.14Å; D500-S502 PolarHBondContact OD1-OG 3.03Å
503	S	93.9	Very high	94.3	Very high	52 Å²	52	38.3 Å²	38.3	36%	0.364	20%	0.202	S	C	.	.			trans	-148.7	154	178.3	67.3	0	0	0	0	111.7	I497 A498	I497-S503 WeakPolarHBondContact CA-O 3.45Å; A498-S503 PolarHBondContact N-O 2.89Å
504	M	95.1	Very high	94.1	Very high	52 Å²	52	43.5 Å²	43.5	26%	0.256	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	134.5	176.8	-176.8	-81.9	-156.6	0	0	108.8	I466 F468 S495 R496 I497 F506	I466-M504 HydrophobicContact CD1-CB 3.99Å; I466-M504 HydrophobicContact CD1-CG 4.44Å; I466-M504 HydrophobicContact CG1-CB 4.2Å; I466-M504 HydrophobicContact CG2-CG 4.31Å; F468-M504 HydrophobicContact CE1-CE 3.87Å; F468-M504 HydrophobicContact CZ-CE 3.94Å; S495-M504 WeakPolarHBondContact OG-CE 3.35Å; R496-M504 WeakPolarHBondContact O-CA 3.32Å; I497-M504 HydrophobicContact CD1-CG 4.38Å; I497-M504 HydrophobicContact CG1-CB 4.08Å; I497-M504 HydrophobicContact CG1-CG 3.56Å; M504-F506 HydrophobicContact CE-CD1 3.95Å; M504-F506 HydrophobicContact CE-CD2 4.47Å; M504-F506 HydrophobicContact CE-CE1 3.57Å; M504-F506 HydrophobicContact CE-CE2 4.14Å; M504-F506 HydrophobicContact CE-CG 4.4Å; M504-F506 HydrophobicContact CE-CZ 3.68Å; M504-F506 HydrophobicContact SD-CD2 4.27Å; M504-F506 HydrophobicContact SD-CE2 4.14Å; M504-F506 HydrophobicContact SD-CZ 4.29Å
505	T	95.3	Very high	94	Very high	61 Å²	61	43.5 Å²	43.5	37%	0.374	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	140.7	174.8	55.9	0	0	0	0	109.2	R496	R496-T505 PolarHBondContact N-O 3.04Å; R496-T505 PolarHBondContact NE-OG1 2.84Å; R496-T505 PolarHBondContact NH2-OG1 3.14Å; R496-T505 PolarHBondContact O-N 2.6Å
506	F	95.7	Very high	93.9	Very high	97 Å²	97	43.9 Å²	43.9	43%	0.425	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	132.4	172.6	-59.5	-89.2	0	0	0	110	S495 M504 K509	S495-F506 WeakPolarHBondContact OG-CD1 3.16Å; M504-F506 HydrophobicContact CE-CD1 3.95Å; M504-F506 HydrophobicContact CE-CD2 4.47Å; M504-F506 HydrophobicContact CE-CE1 3.57Å; M504-F506 HydrophobicContact CE-CE2 4.14Å; M504-F506 HydrophobicContact CE-CG 4.4Å; M504-F506 HydrophobicContact CE-CZ 3.68Å; M504-F506 HydrophobicContact SD-CD2 4.27Å; M504-F506 HydrophobicContact SD-CE2 4.14Å; M504-F506 HydrophobicContact SD-CZ 4.29Å; F506-K509 HydrophobicContact CB-CD 4.17Å; F506-K509 VanDerWaalsContact CB-CE 3.4Å; F506-K509 HydrophobicContact CB-CG 3.74Å; F506-K509 HydrophobicContact CD1-CD 4.37Å; F506-K509 VanDerWaalsContact CD1-CE 3.49Å; F506-K509 HydrophobicContact CD1-CG 3.98Å; F506-K509 HydrophobicContact CD2-CD 4.36Å; F506-K509 VanDerWaalsContact CD2-NZ 3.34Å; F506-K509 HydrophobicContact CG-CD 4.07Å; F506-K509 HydrophobicContact CG-CG 3.92Å
507	V	96.3	Very high	94	Very high	20 Å²	20	41 Å²	41	12%	0.121	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-50	171.5	-175.7	0	0	0	0	108.8	F484 I494 R496 G544	F484-V507 HydrophobicContact CD1-CG2 4.14Å; F484-V507 HydrophobicContact CE1-CG2 4.02Å; I494-V507 HydrophobicContact CG2-CB 4.37Å; I494-V507 WeakPolarHBondContact O-CA 3.48Å; I494-V507 WeakPolarHBondContact O-CB 3.46Å; I494-V507 PolarHBondContact O-N 2.74Å; R496-V507 HydrophobicContact CB-CG2 3.72Å; V507-G544 VanDerWaalsContact CG1-CA 3.45Å
508	H	95.2	Very high	94	Very high	17 Å²	17	41.3 Å²	41.3	8%	0.079	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.2	176.4	-64.4	-61.4	0	0	0	110.4	S493 I494 L512 W529 S540 G544	S493-H508 WeakPolarHBondContact CA-O 3.5Å; S493-H508 WeakPolarHBondContact CB-O 3.02Å; I494-H508 HydrophobicContact CB-CB 4.28Å; I494-H508 PolarHBondContact N-O 3.42Å; I494-H508 PolarHBondContact O-N 2.9Å; I494-H508 VanDerWaalsContact O-N 3.13Å; H508-L512 HydrophobicContact CB-CD1 3.79Å; H508-W529 AromaticContact CD2-CH2 3.64Å; H508-W529 AromaticContact CD2-CZ2 3.96Å; H508-W529 AromaticContact NE2-CH2 3.47Å; H508-W529 WeakPolarHBondContact NE2-CH2 3.49Å; H508-S540 WeakPolarHBondContact NE2-CB 3.29Å; H508-S540 PolarHBondContact NE2-OG 3.46Å; H508-G544 PolarHBondContact CE1-O 2.52Å; H508-G544 VanDerWaalsContact CE1-O 3.24Å
509	K	90.7	Very high	94.1	Very high	127 Å²	127	41.5 Å²	41.5	55%	0.552	22%	0.216	S	C	*	.			trans	-129.9	-10.3	175.2	-69.9	-171.2	175.8	-177	0	113.7	F506	F506-K509 HydrophobicContact CB-CD 4.17Å; F506-K509 VanDerWaalsContact CB-CE 3.4Å; F506-K509 HydrophobicContact CB-CG 3.74Å; F506-K509 HydrophobicContact CD1-CD 4.37Å; F506-K509 VanDerWaalsContact CD1-CE 3.49Å; F506-K509 HydrophobicContact CD1-CG 3.98Å; F506-K509 HydrophobicContact CD2-CD 4.36Å; F506-K509 VanDerWaalsContact CD2-NZ 3.34Å; F506-K509 HydrophobicContact CG-CD 4.07Å; F506-K509 HydrophobicContact CG-CG 3.92Å
510	E	85.6	Confident	94.1	Very high	150 Å²	150	41.5 Å²	41.5	70%	0.701	22%	0.216	S	C	*	.	S	Bend	trans	-120.8	154.9	-171.7	-64.6	177.9	-173.2	0	0	107.9	L512 R547	E510-L512 VanDerWaalsContact C-N 3.29Å; E510-L512 PolarHBondContact O-N 2.89Å; E510-R547 PolarHBondContact O-NH1 2.81Å
511	K	84.5	Confident	94.1	Very high	26 Å²	26	41.4 Å²	41.4	11%	0.113	22%	0.216	C	C	.	.	S	Bend	trans	54.6	45.5	-177	-46.7	-167	-173.1	-175.8	0	113	W218 D221 D225 R547	W218-K511 HydrophobicContact CD2-CD 3.8Å; W218-K511 HydrophobicContact CD2-CG 4.06Å; W218-K511 HydrophobicContact CE3-CD 4.04Å; W218-K511 HydrophobicContact CE3-CG 4.49Å; W218-K511 HydrophobicContact CG-CD 4.3Å; W218-K511 HydrophobicContact CH2-CB 3.45Å; W218-K511 VanDerWaalsContact CH2-CB 3.45Å; W218-K511 HydrophobicContact CH2-CD 4.38Å; W218-K511 HydrophobicContact CH2-CG 4.05Å; W218-K511 HydrophobicContact CZ2-CB 3.38Å; W218-K511 HydrophobicContact CZ2-CD 4.2Å; W218-K511 HydrophobicContact CZ2-CG 3.59Å; W218-K511 HydrophobicContact CZ3-CB 4.05Å; W218-K511 HydrophobicContact CZ3-CD 4.29Å; W218-K511 HydrophobicContact CZ3-CG 4.45Å; D221-K511 IonicContact OD1-NZ 3.75Å; D221-K511 PolarHBondContact OD1-NZ 3.15Å; D221-K511 WeakPolarHBondContact OD2-CE 3.01Å; D221-K511 IonicContact OD2-NZ 2.7Å; D221-K511 PolarHBondContact OD2-NZ 3.02Å; D225-K511 VanDerWaalsContact OD1-CD 3.28Å; D225-K511 WeakPolarHBondContact OD1-CD 3.18Å; D225-K511 IonicContact OD1-NZ 3.5Å; D225-K511 PolarHBondContact OD1-NZ 3.25Å; D225-K511 WeakPolarHBondContact OD2-CE 3.23Å; D225-K511 IonicContact OD2-NZ 4Å; D225-K511 PolarHBondContact OD2-NZ 3.08Å; K511-R547 PolarHBondContact O-NH2 3.32Å
512	L	90.7	Very high	94	Very high	19 Å²	19	42 Å²	42	10%	0.099	21%	0.212	C	C	.	.			trans	-137.5	137.7	177.7	-66.8	170.7	0	0	0	108.6	A492 I494 H508 E510 P515	A492-L512 HydrophobicContact CB-CB 3.89Å; I494-L512 HydrophobicContact CD1-CD1 4.25Å; I494-L512 HydrophobicContact CD1-CD2 3.96Å; I494-L512 HydrophobicContact CG1-CD1 3.87Å; I494-L512 HydrophobicContact CG1-CD2 4.33Å; H508-L512 HydrophobicContact CB-CD1 3.79Å; E510-L512 VanDerWaalsContact C-N 3.29Å; E510-L512 PolarHBondContact O-N 2.89Å; L512-P515 HydrophobicContact CD2-CB 4.27Å
513	A	88.5	Confident	93.9	Very high	21 Å²	21	40.2 Å²	40.2	17%	0.174	20%	0.198	C	C	.	.	S	Bend	trans	-128	-68.2	175.3	0	0	0	0	0	109.8	A492 P515 D531 R533 Y534	A492-A513 WeakPolarHBondContact CB-O 3.33Å; A513-P515 WeakPolarHBondContact O-CD 3.17Å; A513-D531 PolarHBondContact N-OD2 3.44Å; A513-R533 HydrophobicContact CB-CB 3.6Å; A513-R533 HydrophobicContact CB-CG 3.69Å; A513-Y534 HydrophobicContact CB-CD2 4.07Å; A513-Y534 HydrophobicContact CB-CE2 3.55Å
514	W	94.3	Very high	93.7	Very high	112 Å²	112	40.7 Å²	40.7	42%	0.424	19%	0.192	S	C	.	.			trans	-122.8	68.4	178.1	-60.7	-22.6	0	0	0	112	N516 D531 A532 R533	W514-N516 PolarHBondContact O-N 3.22Å; W514-D531 PolarHBondContact N-OD1 3.29Å; W514-D531 VanDerWaalsContact N-OD1 3.13Å; W514-D531 PolarHBondContact N-OD2 2.84Å; W514-D531 VanDerWaalsContact N-OD2 3.08Å; W514-D531 CarbonylContact O-C 3.55Å; W514-D531 WeakPolarHBondContact O-CA 3.42Å; W514-A532 HydrophobicContact CB-CB 4.13Å; W514-A532 HydrophobicContact CE3-CB 4.41Å; W514-A532 PolarHBondContact O-N 2.91Å; W514-R533 HydrophobicContact CB-CB 4.14Å; W514-R533 HydrophobicContact CD2-CB 3.71Å; W514-R533 HydrophobicContact CE3-CB 3.7Å; W514-R533 HydrophobicContact CG-CB 3.93Å; W514-R533 HydrophobicContact CZ3-CB 4.33Å
515	P	97.1	Very high	93.5	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	93.6	176.3	29.9	-35.4	0	0	0	109.9	T486 D487 L512 A513 V530	T486-P515 WeakPolarHBondContact CB-O 3.46Å; T486-P515 HydrophobicContact CG2-CB 4.08Å; T486-P515 PolarHBondContact OG1-O 2.86Å; D487-P515 VanDerWaalsContact O-CG 3.31Å; D487-P515 WeakPolarHBondContact O-CG 3.35Å; L512-P515 HydrophobicContact CD2-CB 4.27Å; A513-P515 WeakPolarHBondContact O-CD 3.17Å; P515-V530 CarbonylContact C-O 3.58Å; P515-V530 WeakPolarHBondContact CA-O 3.3Å
516	N	96.6	Very high	93.4	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.048	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-41.2	-169	-87.8	-1.9	0	0	0	112.7	R472 G473 W514 V530 A532 P558	R472-N516 WeakPolarHBondContact CD-O 3.39Å; R472-N516 WeakPolarHBondContact CG-O 3.36Å; G473-N516 PolarHBondContact N-O 2.86Å; W514-N516 PolarHBondContact O-N 3.22Å; N516-V530 PolarHBondContact N-O 2.88Å; N516-A532 HydrophobicContact CB-CB 4.45Å; N516-A532 WeakPolarHBondContact ND2-CB 3.27Å; N516-P558 PolarHBondContact ND2-O 3.01Å
517	A	98.2	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	152.9	-177.1	0	0	0	0	0	111.6	W529 V530 M561	A517-W529 VanDerWaalsContact O-CA 3.23Å; A517-W529 WeakPolarHBondContact O-CA 3.34Å; A517-W529 VanDerWaalsContact O-CB 3.29Å; A517-W529 WeakPolarHBondContact O-CB 3.32Å; A517-V530 HydrophobicContact CB-CG1 3.76Å; A517-V530 PolarHBondContact O-N 2.83Å; A517-V530 VanDerWaalsContact O-N 3.15Å; A517-M561 HydrophobicContact CB-CB 3.68Å
518	V	98.5	Very high	93.6	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.03	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	138.2	174	62.4	0	0	0	0	109.3	A475 F484 T486 L527 Y528 W529	A475-V518 HydrophobicContact CB-CG1 4.18Å; F484-V518 HydrophobicContact CB-CG2 4.42Å; T486-V518 HydrophobicContact CG2-CB 3.6Å; T486-V518 HydrophobicContact CG2-CG1 3.81Å; V518-L527 HydrophobicContact CG2-CD1 3.38Å; V518-L527 HydrophobicContact CG2-CD2 4.1Å; V518-L527 HydrophobicContact CG2-CG 3.71Å; V518-Y528 CarbonylContact C-O 3.5Å; V518-Y528 VanDerWaalsContact CA-O 3.32Å; V518-Y528 WeakPolarHBondContact CA-O 3.45Å; V518-Y528 WeakPolarHBondContact CG2-O 3.43Å; V518-W529 HydrophobicContact CB-CB 4.47Å
519	A	98.5	Very high	93.8	Very high	4 Å²	4	33.7 Å²	33.7	3%	0.033	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	155.9	179.7	0	0	0	0	0	110.4	Y528 M561 V563	A519-Y528 PolarHBondContact N-O 3.38Å; A519-Y528 PolarHBondContact O-N 2.94Å; A519-M561 HydrophobicContact CB-CE 4.21Å; A519-M561 HydrophobicContact CB-CG 4.48Å; A519-V563 HydrophobicContact CB-CG2 3.79Å
520	I	97.8	Very high	94	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.6	-178.2	-60	170.1	0	0	0	108.8	A475 Y477 F484 Y522 L527 L542	A475-I520 HydrophobicContact CB-CD1 3.7Å; A475-I520 HydrophobicContact CB-CG1 3.75Å; Y477-I520 HydrophobicContact CD1-CD1 4.47Å; Y477-I520 HydrophobicContact CD1-CG2 3.98Å; Y477-I520 HydrophobicContact CE1-CG2 4.19Å; F484-I520 HydrophobicContact CD2-CD1 3.62Å; F484-I520 HydrophobicContact CD2-CG1 4.37Å; F484-I520 HydrophobicContact CE2-CD1 4.01Å; I520-Y522 HydrophobicContact CB-CD1 4.2Å; I520-Y522 HydrophobicContact CB-CE1 3.79Å; I520-Y522 HydrophobicContact CD1-CE1 4.19Å; I520-Y522 HydrophobicContact CG2-CD1 3.6Å; I520-Y522 HydrophobicContact CG2-CE1 3.66Å; I520-Y522 HydrophobicContact CG2-CG 4.31Å; I520-Y522 PolarHBondContact O-N 2.87Å; I520-L527 HydrophobicContact CG1-CD1 3.87Å; I520-L542 HydrophobicContact CG2-CD2 4.47Å
521	D	95.5	Very high	94.4	Very high	10 Å²	10	20.5 Å²	20.5	5%	0.053	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	101.6	159.1	-174.7	-29.1	0	0	0	108.5	V523 R524 D525 R526 Y528 V563	D521-V523 PolarHBondContact O-N 2.87Å; D521-V523 WeakPolarHBondContact OD1-CA 3.15Å; D521-V523 WeakPolarHBondContact OD1-CB 3.33Å; D521-V523 PolarHBondContact OD1-N 3.36Å; D521-R524 HydrophobicContact CB-CB 4.31Å; D521-R524 PolarHBondContact O-N 2.85Å; D521-R524 PolarHBondContact OD1-N 2.89Å; D521-R524 WeakPolarHBondContact OD2-CD 3.48Å; D521-R524 WeakPolarHBondContact OD2-CG 3.4Å; D521-R524 IonicContact OD2-CZ 3.67Å; D521-R524 IonicContact OD2-NE 2.7Å; D521-R524 IonicContact OD2-NH1 3.38Å; D521-R524 PolarHBondContact OD2-NH1 2.99Å; D521-D525 WeakPolarHBondContact O-CA 3.24Å; D521-D525 PolarHBondContact O-N 2.81Å; D521-R526 HydrophobicContact CB-CB 4.4Å; D521-R526 PolarHBondContact N-O 2.92Å; D521-R526 PolarHBondContact O-N 3.11Å; D521-Y528 HydrophobicContact CB-CD2 4.41Å; D521-Y528 HydrophobicContact CB-CE2 3.91Å; D521-V563 HydrophobicContact CB-CG1 4.18Å
522	Y	93.2	Very high	94.7	Very high	33 Å²	33	19.5 Å²	19.5	13%	0.129	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.5	-179	-60.6	-62.5	0	0	0	114	W435 L476 Y477 I520 Y609	W435-Y522 HydrophobicContact CH2-CE1 4.06Å; W435-Y522 HydrophobicContact CH2-CE2 4.1Å; W435-Y522 AromaticContact CH2-CZ 3.61Å; W435-Y522 WeakPolarHBondContact CH2-OH 3.38Å; L476-Y522 VanDerWaalsContact O-CE1 3.25Å; L476-Y522 WeakPolarHBondContact O-CE1 3.38Å; L476-Y522 PolarHBondContact O-OH 2.87Å; Y477-Y522 HydrophobicContact CD1-CD1 4.36Å; Y477-Y522 AromaticContact CD2-CD1 3.8Å; Y477-Y522 HydrophobicContact CD2-CD1 3.8Å; Y477-Y522 HydrophobicContact CD2-CE1 4.02Å; Y477-Y522 HydrophobicContact CE1-CD1 4.3Å; Y477-Y522 AromaticContact CE2-CD1 3.72Å; Y477-Y522 HydrophobicContact CE2-CD1 3.72Å; Y477-Y522 HydrophobicContact CE2-CE1 4.4Å; Y477-Y522 HydrophobicContact CG-CD1 4.15Å; Y477-Y522 HydrophobicContact CG-CE1 4.14Å; Y477-Y522 PolarHBondContact OH-O 2.7Å; I520-Y522 HydrophobicContact CB-CD1 4.2Å; I520-Y522 HydrophobicContact CB-CE1 3.79Å; I520-Y522 HydrophobicContact CD1-CE1 4.19Å; I520-Y522 HydrophobicContact CG2-CD1 3.6Å; I520-Y522 HydrophobicContact CG2-CE1 3.66Å; I520-Y522 HydrophobicContact CG2-CG 4.31Å; I520-Y522 PolarHBondContact O-N 2.87Å; Y522-Y609 HydrophobicContact CD2-CD2 4.24Å; Y522-Y609 AromaticContact CD2-CE2 3.91Å; Y522-Y609 HydrophobicContact CD2-CE2 3.91Å; Y522-Y609 HydrophobicContact CE2-CD2 4.36Å; Y522-Y609 HydrophobicContact CE2-CE1 4.39Å; Y522-Y609 AromaticContact CE2-CE2 3.74Å; Y522-Y609 HydrophobicContact CE2-CE2 3.74Å; Y522-Y609 AromaticContact CE2-CZ 3.76Å
523	V	90.6	Very high	94.5	Very high	30 Å²	30	22.2 Å²	22.2	18%	0.182	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-44.5	178	174	0	0	0	0	109.8	H321 F322 A335 D521	H321-V523 HydrophobicContact CB-CG1 3.86Å; H321-V523 VanDerWaalsContact CG-CG1 3.47Å; H321-V523 WeakPolarHBondContact ND1-CG1 3.47Å; F322-V523 HydrophobicContact CE1-CG1 4.44Å; F322-V523 VanDerWaalsContact CE1-O 3.25Å; F322-V523 WeakPolarHBondContact CE1-O 3.39Å; F322-V523 HydrophobicContact CZ-CG1 4.16Å; A335-V523 HydrophobicContact CB-CG1 3.84Å; A335-V523 HydrophobicContact CB-CG2 4.09Å; D521-V523 PolarHBondContact O-N 2.87Å; D521-V523 WeakPolarHBondContact OD1-CA 3.15Å; D521-V523 WeakPolarHBondContact OD1-CB 3.33Å; D521-V523 PolarHBondContact OD1-N 3.36Å
524	R	88.9	Confident	94.3	Very high	61 Å²	61	22.8 Å²	22.8	23%	0.23	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-3.7	-174.9	-60.2	-177.7	178.4	90.6	3.3	114.4	S320 D521 R526 D566	S320-R524 PolarHBondContact O-NE 2.94Å; S320-R524 PolarHBondContact O-NH2 3.15Å; S320-R524 PolarHBondContact OG-NH2 3.48Å; S320-R524 VanDerWaalsContact OG-NH2 3.08Å; D521-R524 HydrophobicContact CB-CB 4.31Å; D521-R524 PolarHBondContact O-N 2.85Å; D521-R524 PolarHBondContact OD1-N 2.89Å; D521-R524 WeakPolarHBondContact OD2-CD 3.48Å; D521-R524 WeakPolarHBondContact OD2-CG 3.4Å; D521-R524 IonicContact OD2-CZ 3.67Å; D521-R524 IonicContact OD2-NE 2.7Å; D521-R524 IonicContact OD2-NH1 3.38Å; D521-R524 PolarHBondContact OD2-NH1 2.99Å; R524-R526 VanDerWaalsContact C-N 3.29Å; R524-R526 HydrophobicContact CB-CB 4.25Å; R524-R526 PolarHBondContact O-N 3.15Å; R524-D566 IonicContact CZ-OD1 2.83Å; R524-D566 IonicContact NH1-OD1 3.89Å; R524-D566 PolarHBondContact NH1-OD1 3.05Å; R524-D566 IonicContact NH2-OD1 3.19Å; R524-D566 PolarHBondContact NH2-OD1 2.81Å; R524-D566 IonicContact NH2-OD2 2.74Å
525	D	91.7	Very high	93.9	Very high	60 Å²	60	19.7 Å²	19.7	32%	0.321	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	52	-172.3	-68.1	-32.5	0	0	0	110.6	Y477 K479 D521 L542	Y477-D525 VanDerWaalsContact CE1-OD1 3.22Å; Y477-D525 WeakPolarHBondContact CE1-OD1 3.02Å; Y477-D525 VanDerWaalsContact CZ-OD1 3.23Å; Y477-D525 PolarHBondContact OH-OD1 3.21Å; K479-D525 IonicContact NZ-OD1 3.81Å; D521-D525 WeakPolarHBondContact O-CA 3.24Å; D521-D525 PolarHBondContact O-N 2.81Å; D525-L542 HydrophobicContact CB-CD1 3.9Å; D525-L542 HydrophobicContact CB-CG 4.33Å; D525-L542 WeakPolarHBondContact O-CG 3.22Å
526	R	93.4	Very high	93.5	Very high	30 Å²	30	19.9 Å²	19.9	11%	0.113	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139	-176.5	-178.9	164.3	-76.6	-91.3	-1.9	111.1	D521 R524 Y528 S539 S540 D546	D521-R526 HydrophobicContact CB-CB 4.4Å; D521-R526 PolarHBondContact N-O 2.92Å; D521-R526 PolarHBondContact O-N 3.11Å; R524-R526 VanDerWaalsContact C-N 3.29Å; R524-R526 HydrophobicContact CB-CB 4.25Å; R524-R526 PolarHBondContact O-N 3.15Å; R526-Y528 HydrophobicContact CB-CE2 4.1Å; R526-Y528 WeakPolarHBondContact CD-OH 3.17Å; R526-Y528 HydrophobicContact CG-CD2 4.24Å; R526-Y528 HydrophobicContact CG-CE2 3.66Å; R526-S539 PolarHBondContact NH1-OG 2.87Å; R526-S540 WeakPolarHBondContact CG-O 3.42Å; R526-D546 IonicContact CZ-OD2 2.81Å; R526-D546 PolarHBondContact NH1-O 2.86Å; R526-D546 IonicContact NH2-OD2 3.96Å; R526-D546 PolarHBondContact NH2-OD2 3.37Å
527	L	97.9	Very high	93.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	135.8	176.3	-163.1	70.2	0	0	0	109.2	F484 I494 V518 I520 W529 S539 S540 L542	F484-L527 HydrophobicContact CB-CD1 4.01Å; F484-L527 HydrophobicContact CD1-CD1 3.91Å; F484-L527 HydrophobicContact CD1-CD2 3.95Å; F484-L527 HydrophobicContact CD2-CD1 4.29Å; F484-L527 HydrophobicContact CE1-CD1 4.46Å; F484-L527 HydrophobicContact CE1-CD2 4.46Å; F484-L527 HydrophobicContact CG-CD1 3.8Å; I494-L527 HydrophobicContact CG2-CD2 3.65Å; V518-L527 HydrophobicContact CG2-CD1 3.38Å; V518-L527 HydrophobicContact CG2-CD2 4.1Å; V518-L527 HydrophobicContact CG2-CG 3.71Å; I520-L527 HydrophobicContact CG1-CD1 3.87Å; L527-W529 HydrophobicContact CD2-CE3 4.33Å; L527-W529 HydrophobicContact CG-CE3 4.35Å; L527-S539 CarbonylContact O-C 3.59Å; L527-S539 WeakPolarHBondContact O-CA 3.26Å; L527-S539 WeakPolarHBondContact O-CB 3.32Å; L527-S540 PolarHBondContact N-O 2.93Å; L527-S540 PolarHBondContact O-N 3.03Å; L527-L542 HydrophobicContact CB-CD2 4.42Å
528	Y	98.5	Very high	93.2	Very high	11 Å²	11	19.7 Å²	19.7	4%	0.043	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	138.9	170.7	-69	-95.8	0	0	0	109	V518 A519 D521 R526 E538 S539 L550 M561 V563 V568 V583	V518-Y528 CarbonylContact C-O 3.5Å; V518-Y528 VanDerWaalsContact CA-O 3.32Å; V518-Y528 WeakPolarHBondContact CA-O 3.45Å; V518-Y528 WeakPolarHBondContact CG2-O 3.43Å; A519-Y528 PolarHBondContact N-O 3.38Å; A519-Y528 PolarHBondContact O-N 2.94Å; D521-Y528 HydrophobicContact CB-CD2 4.41Å; D521-Y528 HydrophobicContact CB-CE2 3.91Å; R526-Y528 HydrophobicContact CB-CE2 4.1Å; R526-Y528 WeakPolarHBondContact CD-OH 3.17Å; R526-Y528 HydrophobicContact CG-CD2 4.24Å; R526-Y528 HydrophobicContact CG-CE2 3.66Å; Y528-E538 VanDerWaalsContact CA-O 3.28Å; Y528-E538 WeakPolarHBondContact CA-O 3.25Å; Y528-S539 VanDerWaalsContact CD1-CB 3.48Å; Y528-L550 HydrophobicContact CD1-CD2 3.94Å; Y528-L550 HydrophobicContact CE1-CD2 3.79Å; Y528-M561 VanDerWaalsContact C-CE 3.46Å; Y528-M561 WeakPolarHBondContact O-CE 3.16Å; Y528-V563 HydrophobicContact CD2-CG2 3.8Å; Y528-V563 HydrophobicContact CE2-CG1 4.48Å; Y528-V563 HydrophobicContact CE2-CG2 4.5Å; Y528-V563 HydrophobicContact CG-CG2 4.01Å; Y528-V568 HydrophobicContact CD1-CG2 4.05Å; Y528-V568 HydrophobicContact CE1-CG2 4.32Å; Y528-V568 HydrophobicContact CG-CG2 4.46Å; Y528-V583 HydrophobicContact CE1-CG1 4.13Å
529	W	98.3	Very high	93	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	159.4	172.9	64.5	93.5	0	0	0	110.6	I494 H508 A517 V518 L527 I537 E538 S540 R547 M561	I494-W529 HydrophobicContact CD1-CB 3.94Å; I494-W529 HydrophobicContact CD1-CD2 3.29Å; I494-W529 HydrophobicContact CD1-CE3 3.87Å; I494-W529 HydrophobicContact CD1-CG 3.33Å; I494-W529 HydrophobicContact CD1-CZ2 4.28Å; H508-W529 AromaticContact CD2-CH2 3.64Å; H508-W529 AromaticContact CD2-CZ2 3.96Å; H508-W529 AromaticContact NE2-CH2 3.47Å; H508-W529 WeakPolarHBondContact NE2-CH2 3.49Å; A517-W529 VanDerWaalsContact O-CA 3.23Å; A517-W529 WeakPolarHBondContact O-CA 3.34Å; A517-W529 VanDerWaalsContact O-CB 3.29Å; A517-W529 WeakPolarHBondContact O-CB 3.32Å; V518-W529 HydrophobicContact CB-CB 4.47Å; L527-W529 HydrophobicContact CD2-CE3 4.33Å; L527-W529 HydrophobicContact CG-CE3 4.35Å; W529-I537 CarbonylContact O-C 3.58Å; W529-I537 VanDerWaalsContact O-CA 3.3Å; W529-I537 WeakPolarHBondContact O-CA 3.36Å; W529-E538 HydrophobicContact CD2-CB 4.08Å; W529-E538 VanDerWaalsContact CE2-CB 3.45Å; W529-E538 HydrophobicContact CH2-CB 3.87Å; W529-E538 HydrophobicContact CZ2-CB 3.35Å; W529-E538 HydrophobicContact CZ2-CG 4.12Å; W529-E538 HydrophobicContact CZ3-CB 4.42Å; W529-E538 PolarHBondContact N-O 3.2Å; W529-E538 PolarHBondContact NE1-OE2 2.9Å; W529-E538 PolarHBondContact O-N 3.02Å; W529-S540 VanDerWaalsContact CZ3-OG 3.3Å; W529-S540 WeakPolarHBondContact CZ3-OG 3.34Å; W529-R547 HydrophobicContact CH2-CG 4.06Å; W529-R547 HydrophobicContact CZ2-CG 4.26Å; W529-M561 VanDerWaalsContact CA-CE 3.45Å
530	V	96.8	Very high	92.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.2	175.9	68.1	0	0	0	0	109.8	P515 N516 A517 L536 I537 I555 P558 M561	P515-V530 CarbonylContact C-O 3.58Å; P515-V530 WeakPolarHBondContact CA-O 3.3Å; N516-V530 PolarHBondContact N-O 2.88Å; A517-V530 HydrophobicContact CB-CG1 3.76Å; A517-V530 PolarHBondContact O-N 2.83Å; A517-V530 VanDerWaalsContact O-N 3.15Å; V530-L536 WeakPolarHBondContact CA-O 3.46Å; V530-L536 WeakPolarHBondContact CG2-O 3.34Å; V530-I537 HydrophobicContact CB-CG1 3.99Å; V530-I537 HydrophobicContact CG2-CG1 3.7Å; V530-I555 HydrophobicContact CG2-CG2 4.23Å; V530-P558 HydrophobicContact CB-CB 4.35Å; V530-P558 HydrophobicContact CB-CG 4.37Å; V530-P558 HydrophobicContact CG1-CB 3.82Å; V530-P558 HydrophobicContact CG1-CG 4.08Å; V530-P558 HydrophobicContact CG2-CB 3.6Å; V530-P558 HydrophobicContact CG2-CG 3.41Å; V530-P558 VanDerWaalsContact CG2-CG 3.41Å; V530-M561 HydrophobicContact CB-SD 4.24Å
531	D	93.4	Very high	92.5	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.5	174.5	-165.4	-58	0	0	0	109.8	A513 W514 R533 Y534 L535 L536	A513-D531 PolarHBondContact N-OD2 3.44Å; W514-D531 PolarHBondContact N-OD1 3.29Å; W514-D531 VanDerWaalsContact N-OD1 3.13Å; W514-D531 PolarHBondContact N-OD2 2.84Å; W514-D531 VanDerWaalsContact N-OD2 3.08Å; W514-D531 CarbonylContact O-C 3.55Å; W514-D531 WeakPolarHBondContact O-CA 3.42Å; D531-R533 VanDerWaalsContact C-N 3.34Å; D531-R533 WeakPolarHBondContact OD1-CA 3.3Å; D531-R533 WeakPolarHBondContact OD1-CB 3.23Å; D531-R533 PolarHBondContact OD1-N 3.11Å; D531-Y534 HydrophobicContact CB-CD2 4.36Å; D531-Y534 PolarHBondContact OD1-N 2.96Å; D531-L535 WeakPolarHBondContact O-CA 3.31Å; D531-L535 PolarHBondContact O-N 3.18Å; D531-L536 PolarHBondContact N-O 3.16Å; D531-L536 PolarHBondContact O-N 3.05Å
532	A	91	Very high	92.3	Very high	5 Å²	5	24.4 Å²	24.4	4%	0.041	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-11.5	-177	0	0	0	0	0	113.9	W514 N516 L535 P558	W514-A532 HydrophobicContact CB-CB 4.13Å; W514-A532 HydrophobicContact CE3-CB 4.41Å; W514-A532 PolarHBondContact O-N 2.91Å; N516-A532 HydrophobicContact CB-CB 4.45Å; N516-A532 WeakPolarHBondContact ND2-CB 3.27Å; A532-L535 VanDerWaalsContact O-CD2 3.24Å; A532-L535 WeakPolarHBondContact O-CD2 3.42Å; A532-P558 HydrophobicContact CB-CG 3.91Å
533	R	85.1	Confident	92.1	Very high	76 Å²	76	27.4 Å²	27.4	29%	0.287	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-39.4	173.6	173.4	58.6	-176.3	83.9	3.2	111.4	E204 A513 W514 D531	E204-R533 IonicContact OE1-CZ 3.21Å; E204-R533 IonicContact OE1-NH2 3.98Å; E204-R533 PolarHBondContact OE1-NH2 3.18Å; A513-R533 HydrophobicContact CB-CB 3.6Å; A513-R533 HydrophobicContact CB-CG 3.69Å; W514-R533 HydrophobicContact CB-CB 4.14Å; W514-R533 HydrophobicContact CD2-CB 3.71Å; W514-R533 HydrophobicContact CE3-CB 3.7Å; W514-R533 HydrophobicContact CG-CB 3.93Å; W514-R533 HydrophobicContact CZ3-CB 4.33Å; D531-R533 VanDerWaalsContact C-N 3.34Å; D531-R533 WeakPolarHBondContact OD1-CA 3.3Å; D531-R533 WeakPolarHBondContact OD1-CB 3.23Å; D531-R533 PolarHBondContact OD1-N 3.11Å
534	Y	84.9	Confident	92.1	Very high	33 Å²	33	26.8 Å²	26.8	13%	0.129	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-6.5	176.2	-61.6	-54.4	0	0	0	113.4	V212 M214 P215 W218 A513 D531 L536	V212-Y534 WeakPolarHBondContact CG1-O 3.47Å; M214-Y534 HydrophobicContact SD-CD1 4.49Å; P215-Y534 HydrophobicContact CG-CE1 4.02Å; W218-Y534 HydrophobicContact CH2-CD1 4.24Å; W218-Y534 AromaticContact CH2-CD2 3.87Å; W218-Y534 HydrophobicContact CH2-CD2 3.87Å; W218-Y534 AromaticContact CH2-CE1 3.89Å; W218-Y534 HydrophobicContact CH2-CE1 3.89Å; W218-Y534 AromaticContact CH2-CE2 3.47Å; W218-Y534 HydrophobicContact CH2-CE2 3.47Å; W218-Y534 VanDerWaalsContact CH2-CE2 3.47Å; W218-Y534 HydrophobicContact CH2-CG 4.23Å; W218-Y534 AromaticContact CH2-CZ 3.47Å; W218-Y534 VanDerWaalsContact CH2-CZ 3.47Å; W218-Y534 HydrophobicContact CZ2-CE1 4.33Å; W218-Y534 HydrophobicContact CZ2-CE2 4.02Å; W218-Y534 AromaticContact CZ2-CZ 3.73Å; A513-Y534 HydrophobicContact CB-CD2 4.07Å; A513-Y534 HydrophobicContact CB-CE2 3.55Å; D531-Y534 HydrophobicContact CB-CD2 4.36Å; D531-Y534 PolarHBondContact OD1-N 2.96Å; Y534-L536 WeakPolarHBondContact O-CD2 3.17Å; Y534-L536 PolarHBondContact O-N 3.17Å
535	L	86	Confident	91.8	Very high	47 Å²	47	27.2 Å²	27.2	25%	0.246	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	44.8	173.3	-55.2	-179.6	0	0	0	113.5	D531 A532 I555 L556	D531-L535 WeakPolarHBondContact O-CA 3.31Å; D531-L535 PolarHBondContact O-N 3.18Å; A532-L535 VanDerWaalsContact O-CD2 3.24Å; A532-L535 WeakPolarHBondContact O-CD2 3.42Å; L535-I555 HydrophobicContact CB-CB 4.44Å; L535-I555 HydrophobicContact CB-CG2 4.3Å; L535-I555 HydrophobicContact CD2-CG2 4.4Å; L535-L556 VanDerWaalsContact CD2-O 3.31Å; L535-L556 WeakPolarHBondContact CD2-O 3.31Å
536	L	88.8	Confident	91.4	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.016	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	153.3	-174.6	57.4	87.7	0	0	0	112.4	M214 V530 D531 Y534 E538 V549 F551	M214-L536 HydrophobicContact CE-CD2 3.11Å; M214-L536 HydrophobicContact SD-CD2 3.99Å; V530-L536 WeakPolarHBondContact CA-O 3.46Å; V530-L536 WeakPolarHBondContact CG2-O 3.34Å; D531-L536 PolarHBondContact N-O 3.16Å; D531-L536 PolarHBondContact O-N 3.05Å; Y534-L536 WeakPolarHBondContact O-CD2 3.17Å; Y534-L536 PolarHBondContact O-N 3.17Å; L536-E538 HydrophobicContact CD1-CG 3.2Å; L536-V549 HydrophobicContact CB-CG1 4.36Å; L536-F551 CarbonylContact C-O 3.57Å; L536-F551 WeakPolarHBondContact CA-O 3.44Å
537	I	94.5	Very high	91	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.3	171.8	-62.3	166	0	0	0	107.5	W529 V530 L550 F551 I555 M561 V568 W570 V581	W529-I537 CarbonylContact O-C 3.58Å; W529-I537 VanDerWaalsContact O-CA 3.3Å; W529-I537 WeakPolarHBondContact O-CA 3.36Å; V530-I537 HydrophobicContact CB-CG1 3.99Å; V530-I537 HydrophobicContact CG2-CG1 3.7Å; I537-L550 HydrophobicContact CG2-CB 4.2Å; I537-L550 HydrophobicContact CG2-CD2 3.88Å; I537-L550 WeakPolarHBondContact O-CB 3.48Å; I537-L550 PolarHBondContact O-N 3.05Å; I537-F551 HydrophobicContact CB-CB 4.45Å; I537-F551 HydrophobicContact CD1-CD1 4.41Å; I537-F551 PolarHBondContact N-O 3.08Å; I537-F551 PolarHBondContact O-N 3.48Å; I537-I555 HydrophobicContact CD1-CD1 4.01Å; I537-I555 HydrophobicContact CG1-CD1 3.74Å; I537-M561 HydrophobicContact CD1-SD 4.39Å; I537-M561 HydrophobicContact CG1-SD 4.37Å; I537-M561 HydrophobicContact CG2-SD 4.22Å; I537-V568 HydrophobicContact CD1-CG1 4.25Å; I537-W570 HydrophobicContact CD1-CD2 4.06Å; I537-W570 HydrophobicContact CD1-CE3 3.85Å; I537-W570 HydrophobicContact CD1-CH2 4.42Å; I537-W570 HydrophobicContact CD1-CZ3 4.05Å; I537-V581 HydrophobicContact CD1-CG1 4.41Å
538	E	94	Very high	90.3	Very high	5 Å²	5	32.7 Å²	32.7	2%	0.023	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	166.3	176.4	-57	-179.4	79.8	0	0	110.6	Y528 W529 L536 R547 Q548 V549	Y528-E538 VanDerWaalsContact CA-O 3.28Å; Y528-E538 WeakPolarHBondContact CA-O 3.25Å; W529-E538 HydrophobicContact CD2-CB 4.08Å; W529-E538 VanDerWaalsContact CE2-CB 3.45Å; W529-E538 HydrophobicContact CH2-CB 3.87Å; W529-E538 HydrophobicContact CZ2-CB 3.35Å; W529-E538 HydrophobicContact CZ2-CG 4.12Å; W529-E538 HydrophobicContact CZ3-CB 4.42Å; W529-E538 PolarHBondContact N-O 3.2Å; W529-E538 PolarHBondContact NE1-OE2 2.9Å; W529-E538 PolarHBondContact O-N 3.02Å; L536-E538 HydrophobicContact CD1-CG 3.2Å; E538-R547 IonicContact OE1-CZ 2.76Å; E538-R547 IonicContact OE1-NE 3.22Å; E538-R547 PolarHBondContact OE1-NE 2.85Å; E538-R547 IonicContact OE1-NH2 3.55Å; E538-R547 PolarHBondContact OE1-NH2 2.96Å; E538-R547 IonicContact OE2-CZ 3.73Å; E538-R547 IonicContact OE2-NE 2.58Å; E538-R547 IonicContact OE2-NH2 2.77Å; E538-R547 PolarHBondContact OE2-NH2 2.79Å; E538-Q548 CarbonylContact C-O 3.57Å; E538-Q548 WeakPolarHBondContact CA-O 3.48Å; E538-V549 HydrophobicContact CG-CG2 4.15Å
539	S	94.9	Very high	89.8	Confident	6 Å²	6	33 Å²	33	4%	0.042	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	154.4	173.5	82.1	0	0	0	0	112.1	R526 L527 Y528 R547 Q548	R526-S539 PolarHBondContact NH1-OG 2.87Å; L527-S539 CarbonylContact O-C 3.59Å; L527-S539 WeakPolarHBondContact O-CA 3.26Å; L527-S539 WeakPolarHBondContact O-CB 3.32Å; Y528-S539 VanDerWaalsContact CD1-CB 3.48Å; S539-R547 CarbonylContact O-C 3.49Å; S539-R547 WeakPolarHBondContact O-CA 3.1Å; S539-Q548 PolarHBondContact N-O 3.06Å; S539-Q548 PolarHBondContact O-N 3.4Å
540	S	94.2	Very high	89.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	163.2	170.1	65.5	0	0	0	0	110.7	H508 R526 L527 W529	H508-S540 WeakPolarHBondContact NE2-CB 3.29Å; H508-S540 PolarHBondContact NE2-OG 3.46Å; R526-S540 WeakPolarHBondContact CG-O 3.42Å; L527-S540 PolarHBondContact N-O 2.93Å; L527-S540 PolarHBondContact O-N 3.03Å; W529-S540 VanDerWaalsContact CZ3-OG 3.3Å; W529-S540 WeakPolarHBondContact CZ3-OG 3.34Å
541	R	90.1	Very high	89	Confident	95 Å²	95	34.3 Å²	34.3	36%	0.358	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	160.6	168.2	-67.4	170.6	-170.7	-92.4	-0	110.2	D543 G544 T545 D546	R541-D543 VanDerWaalsContact CB-OD1 3.31Å; R541-D543 WeakPolarHBondContact CB-OD1 3.23Å; R541-D543 PolarHBondContact O-N 3.19Å; R541-G544 PolarHBondContact O-N 3.36Å; R541-T545 WeakPolarHBondContact CB-O 3.34Å; R541-T545 VanDerWaalsContact CD-OG1 3.3Å; R541-T545 WeakPolarHBondContact CD-OG1 3.28Å; R541-T545 PolarHBondContact N-O 2.87Å; R541-D546 HydrophobicContact CG-CB 4.07Å; R541-D546 IonicContact CZ-OD2 3.47Å; R541-D546 IonicContact NE-OD2 3.35Å; R541-D546 PolarHBondContact NE-OD2 3.18Å; R541-D546 VanDerWaalsContact NE-OD2 3.08Å; R541-D546 IonicContact NH2-OD2 2.59Å; R541-D546 PolarHBondContact NH2-OD2 2.98Å; R541-D546 VanDerWaalsContact NH2-OD2 3.11Å
542	L	91.6	Very high	88.7	Confident	18 Å²	18	34.7 Å²	34.7	9%	0.094	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.3	-178.1	-57.7	178.2	0	0	0	115	Y477 L480 F484 R496 I520 D525 L527	Y477-L542 HydrophobicContact CD1-CD1 3.83Å; Y477-L542 HydrophobicContact CE1-CD1 3.69Å; L480-L542 HydrophobicContact CD1-CD1 3.68Å; F484-L542 HydrophobicContact CE1-CD2 4.48Å; F484-L542 HydrophobicContact CE2-CD2 4.19Å; F484-L542 HydrophobicContact CZ-CB 4.05Å; F484-L542 HydrophobicContact CZ-CD2 3.85Å; F484-L542 HydrophobicContact CZ-CG 4.39Å; R496-L542 PolarHBondContact NH1-O 3.38Å; I520-L542 HydrophobicContact CG2-CD2 4.47Å; D525-L542 HydrophobicContact CB-CD1 3.9Å; D525-L542 HydrophobicContact CB-CG 4.33Å; D525-L542 WeakPolarHBondContact O-CG 3.22Å; L527-L542 HydrophobicContact CB-CD2 4.42Å
543	D	88.8	Confident	88.1	Confident	96 Å²	96	37.4 Å²	37.4	51%	0.513	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-1.8	174.5	65.2	-2.8	0	0	0	113.6	R541 T545	R541-D543 VanDerWaalsContact CB-OD1 3.31Å; R541-D543 WeakPolarHBondContact CB-OD1 3.23Å; R541-D543 PolarHBondContact O-N 3.19Å; D543-T545 WeakPolarHBondContact OD1-CB 3.46Å; D543-T545 PolarHBondContact OD1-N 3.49Å; D543-T545 PolarHBondContact OD1-OG1 3.14Å; D543-T545 PolarHBondContact OD2-OG1 3.43Å
544	G	90.6	Very high	88	Confident	16 Å²	16	36.2 Å²	36.2	17%	0.165	20%	0.196	C	C	.	.	S	Bend	trans	90.9	-4	-178.9	0	0	0	0	0	114.3	V507 H508 R541	V507-G544 VanDerWaalsContact CG1-CA 3.45Å; H508-G544 PolarHBondContact CE1-O 2.52Å; H508-G544 VanDerWaalsContact CE1-O 3.24Å; R541-G544 PolarHBondContact O-N 3.36Å
545	T	84.1	Confident	88	Confident	70 Å²	70	35 Å²	35	43%	0.429	19%	0.192	S	C	.	.			trans	-77.3	162.5	176.2	63.7	0	0	0	0	111.6	R541 D543 R547	R541-T545 WeakPolarHBondContact CB-O 3.34Å; R541-T545 VanDerWaalsContact CD-OG1 3.3Å; R541-T545 WeakPolarHBondContact CD-OG1 3.28Å; R541-T545 PolarHBondContact N-O 2.87Å; D543-T545 WeakPolarHBondContact OD1-CB 3.46Å; D543-T545 PolarHBondContact OD1-N 3.49Å; D543-T545 PolarHBondContact OD1-OG1 3.14Å; D543-T545 PolarHBondContact OD2-OG1 3.43Å; T545-R547 VanDerWaalsContact C-N 3.31Å; T545-R547 PolarHBondContact O-N 2.93Å
546	D	82.5	Confident	88	Confident	59 Å²	59	35.4 Å²	35.4	32%	0.316	19%	0.194	S	C	.	.	S	Bend	trans	56.8	45.4	175.5	-167.8	21.4	0	0	0	112.2	R526 R541 Q548	R526-D546 IonicContact CZ-OD2 2.81Å; R526-D546 PolarHBondContact NH1-O 2.86Å; R526-D546 IonicContact NH2-OD2 3.96Å; R526-D546 PolarHBondContact NH2-OD2 3.37Å; R541-D546 HydrophobicContact CG-CB 4.07Å; R541-D546 IonicContact CZ-OD2 3.47Å; R541-D546 IonicContact NE-OD2 3.35Å; R541-D546 PolarHBondContact NE-OD2 3.18Å; R541-D546 VanDerWaalsContact NE-OD2 3.08Å; R541-D546 IonicContact NH2-OD2 2.59Å; R541-D546 PolarHBondContact NH2-OD2 2.98Å; R541-D546 VanDerWaalsContact NH2-OD2 3.11Å; D546-Q548 PolarHBondContact OD1-NE2 2.84Å
547	R	85.5	Confident	88	Confident	46 Å²	46	37.9 Å²	37.9	17%	0.174	21%	0.206	C	C	.	.			trans	-71.7	129.7	174.1	178.2	176.9	-179.5	173.1	3.2	109.6	E510 K511 W529 E538 S539 T545	E510-R547 PolarHBondContact O-NH1 2.81Å; K511-R547 PolarHBondContact O-NH2 3.32Å; W529-R547 HydrophobicContact CH2-CG 4.06Å; W529-R547 HydrophobicContact CZ2-CG 4.26Å; E538-R547 IonicContact OE1-CZ 2.76Å; E538-R547 IonicContact OE1-NE 3.22Å; E538-R547 PolarHBondContact OE1-NE 2.85Å; E538-R547 IonicContact OE1-NH2 3.55Å; E538-R547 PolarHBondContact OE1-NH2 2.96Å; E538-R547 IonicContact OE2-CZ 3.73Å; E538-R547 IonicContact OE2-NE 2.58Å; E538-R547 IonicContact OE2-NH2 2.77Å; E538-R547 PolarHBondContact OE2-NH2 2.79Å; S539-R547 CarbonylContact O-C 3.49Å; S539-R547 WeakPolarHBondContact O-CA 3.1Å; T545-R547 VanDerWaalsContact C-N 3.31Å; T545-R547 PolarHBondContact O-N 2.93Å
548	Q	83.7	Confident	88	Confident	100 Å²	100	37.9 Å²	37.9	47%	0.467	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	145.4	-177.2	-57.5	-178.8	7.3	0	0	110	E538 S539 D546	E538-Q548 CarbonylContact C-O 3.57Å; E538-Q548 WeakPolarHBondContact CA-O 3.48Å; S539-Q548 PolarHBondContact N-O 3.06Å; S539-Q548 PolarHBondContact O-N 3.4Å; D546-Q548 PolarHBondContact OD1-NE2 2.84Å
549	V	87.6	Confident	88	Confident	18 Å²	18	38.5 Å²	38.5	11%	0.109	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	125.2	169.6	-174	0	0	0	0	109.2	D225 Q227 L536 E538	D225-V549 WeakPolarHBondContact O-CG2 3.03Å; Q227-V549 PolarHBondContact OE1-O 3.4Å; L536-V549 HydrophobicContact CB-CG1 4.36Å; E538-V549 HydrophobicContact CG-CG2 4.15Å
550	L	89.6	Confident	88.2	Confident	16 Å²	16	38.7 Å²	38.7	8%	0.084	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-46.5	-179.7	175.8	70.9	0	0	0	111.5	Q227 Y528 I537 V568 V581 V583 V586	Q227-L550 VanDerWaalsContact CD-O 3.25Å; Q227-L550 PolarHBondContact NE2-O 3.08Å; Q227-L550 PolarHBondContact OE1-O 2.9Å; Y528-L550 HydrophobicContact CD1-CD2 3.94Å; Y528-L550 HydrophobicContact CE1-CD2 3.79Å; I537-L550 HydrophobicContact CG2-CB 4.2Å; I537-L550 HydrophobicContact CG2-CD2 3.88Å; I537-L550 WeakPolarHBondContact O-CB 3.48Å; I537-L550 PolarHBondContact O-N 3.05Å; L550-V568 HydrophobicContact CD2-CG2 3.68Å; L550-V581 HydrophobicContact CD2-CG1 4.26Å; L550-V583 HydrophobicContact CD1-CB 4.27Å; L550-V583 HydrophobicContact CD2-CG1 4.18Å; L550-V586 HydrophobicContact CD1-CG2 4.36Å
551	F	87.8	Confident	88.3	Confident	11 Å²	11	38.9 Å²	38.9	5%	0.048	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	138.9	-172.9	-171.5	-122.7	0	0	0	111.6	Q227 L536 I537 S553 I555 W570 V581 V586 V589	Q227-F551 VanDerWaalsContact OE1-CA 3.29Å; L536-F551 CarbonylContact C-O 3.57Å; L536-F551 WeakPolarHBondContact CA-O 3.44Å; I537-F551 HydrophobicContact CB-CB 4.45Å; I537-F551 HydrophobicContact CD1-CD1 4.41Å; I537-F551 PolarHBondContact N-O 3.08Å; I537-F551 PolarHBondContact O-N 3.48Å; F551-S553 WeakPolarHBondContact CD1-O 3.42Å; F551-S553 WeakPolarHBondContact CE1-O 3.31Å; F551-S553 WeakPolarHBondContact CZ-O 3.24Å; F551-I555 HydrophobicContact CD1-CD1 4.04Å; F551-I555 HydrophobicContact CD1-CG1 4.44Å; F551-W570 AromaticContact CD1-CH2 3.98Å; F551-W570 HydrophobicContact CD1-CH2 3.98Å; F551-W570 HydrophobicContact CD1-CZ2 4.4Å; F551-W570 AromaticContact CE1-CH2 3.77Å; F551-W570 HydrophobicContact CE1-CH2 3.77Å; F551-W570 HydrophobicContact CE1-CZ2 4.11Å; F551-V581 HydrophobicContact CB-CG1 4.31Å; F551-V581 HydrophobicContact CB-CG2 4.37Å; F551-V581 HydrophobicContact CD1-CB 4.3Å; F551-V581 HydrophobicContact CD1-CG1 4.28Å; F551-V581 HydrophobicContact CD1-CG2 4.3Å; F551-V581 HydrophobicContact CD2-CG2 4.02Å; F551-V581 HydrophobicContact CE2-CG2 4.38Å; F551-V581 HydrophobicContact CG-CB 4.43Å; F551-V581 HydrophobicContact CG-CG1 4.37Å; F551-V581 HydrophobicContact CG-CG2 3.99Å; F551-V586 HydrophobicContact CB-CG1 4.43Å; F551-V586 HydrophobicContact CD2-CG1 3.38Å; F551-V586 HydrophobicContact CE2-CG1 4.03Å; F551-V586 HydrophobicContact CG-CG1 4.29Å; F551-V589 HydrophobicContact CE1-CG2 3.82Å; F551-V589 HydrophobicContact CE2-CG2 4.35Å; F551-V589 HydrophobicContact CZ-CB 4.15Å; F551-V589 HydrophobicContact CZ-CG1 4.27Å; F551-V589 HydrophobicContact CZ-CG2 3.55Å
552	S	86.4	Confident	88.7	Confident	8 Å²	8	35 Å²	35	6%	0.056	20%	0.196	C	C	.	.			trans	-140.1	11.9	-176.8	66.6	0	0	0	0	113.9	V212 Q227	V212-S552 WeakPolarHBondContact CG2-O 3.25Å; Q227-S552 WeakPolarHBondContact CB-OG 3.38Å
553	S	80.2	Confident	89	Confident	63 Å²	63	34.3 Å²	34.3	44%	0.441	19%	0.193	S	C	.	.	S	Bend	trans	-103.6	157.8	174.9	-58.2	0	0	0	0	109.7	F551 I555	F551-S553 WeakPolarHBondContact CD1-O 3.42Å; F551-S553 WeakPolarHBondContact CE1-O 3.31Å; F551-S553 WeakPolarHBondContact CZ-O 3.24Å; S553-I555 VanDerWaalsContact C-N 3.27Å; S553-I555 PolarHBondContact O-N 2.92Å; S553-I555 VanDerWaalsContact O-N 3.13Å
554	A	81.2	Confident	89.3	Confident	50 Å²	50	30.3 Å²	30.3	41%	0.413	17%	0.171	S	C	.	.	S	Bend	trans	49.2	43.3	174.8	0	0	0	0	0	114.8	L575 M579	A554-L575 WeakPolarHBondContact O-CD1 3.34Å; A554-M579 HydrophobicContact CB-CE 4.33Å
555	I	85.8	Confident	89.3	Confident	7 Å²	7	31.5 Å²	31.5	4%	0.036	17%	0.174	C	C	.	.			trans	-126.6	121.9	170.5	-64.7	161.3	0	0	0	105.7	V530 L535 I537 F551 S553 P558 W570	V530-I555 HydrophobicContact CG2-CG2 4.23Å; L535-I555 HydrophobicContact CB-CB 4.44Å; L535-I555 HydrophobicContact CB-CG2 4.3Å; L535-I555 HydrophobicContact CD2-CG2 4.4Å; I537-I555 HydrophobicContact CD1-CD1 4.01Å; I537-I555 HydrophobicContact CG1-CD1 3.74Å; F551-I555 HydrophobicContact CD1-CD1 4.04Å; F551-I555 HydrophobicContact CD1-CG1 4.44Å; S553-I555 VanDerWaalsContact C-N 3.27Å; S553-I555 PolarHBondContact O-N 2.92Å; S553-I555 VanDerWaalsContact O-N 3.13Å; I555-P558 HydrophobicContact CG2-CB 4.22Å; I555-P558 HydrophobicContact CG2-CG 3.61Å; I555-W570 HydrophobicContact CG1-CZ2 4.08Å
556	L	85.2	Confident	89.6	Confident	56 Å²	56	28.9 Å²	28.9	29%	0.293	16%	0.157	S	C	.	.	S	Bend	trans	-124.5	-48.3	-176.7	-66.5	-176.8	0	0	0	111.6	L535 D572 R574 L575	L535-L556 VanDerWaalsContact CD2-O 3.31Å; L535-L556 WeakPolarHBondContact CD2-O 3.31Å; L556-D572 PolarHBondContact N-OD2 2.88Å; L556-R574 HydrophobicContact CB-CB 3.6Å; L556-R574 HydrophobicContact CB-CG 4.43Å; L556-R574 HydrophobicContact CD1-CB 3.91Å; L556-R574 HydrophobicContact CG-CB 4.44Å; L556-L575 HydrophobicContact CB-CG 4.37Å; L556-L575 HydrophobicContact CD1-CD2 3.49Å; L556-L575 VanDerWaalsContact CD1-CD2 3.49Å; L556-L575 HydrophobicContact CD1-CG 3.87Å; L556-L575 HydrophobicContact CG-CD2 3.97Å; L556-L575 HydrophobicContact CG-CG 4.05Å
557	H	88.8	Confident	90.2	Very high	56 Å²	56	28.5 Å²	28.5	26%	0.259	15%	0.152	S	C	.	.	S	Bend	trans	-151.9	70.5	177.2	-156.6	100.7	0	0	0	110.4	D572 W573 R574	H557-D572 PolarHBondContact N-OD1 3.32Å; H557-D572 PolarHBondContact N-OD2 3.04Å; H557-W573 HydrophobicContact CB-CB 4.12Å; H557-W573 AromaticContact CD2-CD2 3.72Å; H557-W573 AromaticContact CD2-CE3 3.28Å; H557-W573 AromaticContact CD2-CZ3 3.98Å; H557-W573 AromaticContact NE2-CE3 3.37Å; H557-W573 AromaticContact NE2-CZ3 3.6Å; H557-W573 PolarHBondContact O-N 2.84Å; H557-R574 HydrophobicContact CB-CB 4.13Å; H557-R574 HydrophobicContact CB-CG 3.74Å
558	P	95	Very high	90.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	142.2	-177.1	30.1	-35.5	0	0	0	110.8	N516 V530 A532 I555 S571	N516-P558 PolarHBondContact ND2-O 3.01Å; V530-P558 HydrophobicContact CB-CB 4.35Å; V530-P558 HydrophobicContact CB-CG 4.37Å; V530-P558 HydrophobicContact CG1-CB 3.82Å; V530-P558 HydrophobicContact CG1-CG 4.08Å; V530-P558 HydrophobicContact CG2-CB 3.6Å; V530-P558 HydrophobicContact CG2-CG 3.41Å; V530-P558 VanDerWaalsContact CG2-CG 3.41Å; A532-P558 HydrophobicContact CB-CG 3.91Å; I555-P558 HydrophobicContact CG2-CB 4.22Å; I555-P558 HydrophobicContact CG2-CG 3.61Å; P558-S571 CarbonylContact C-O 3.53Å; P558-S571 WeakPolarHBondContact CA-O 3.41Å
559	F	95.4	Very high	91.4	Very high	17 Å²	17	21.8 Å²	21.8	8%	0.075	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	-62.4	-176.9	-176.9	-91.4	0	0	0	113.3	L391 S571 W573 Y600	L391-F559 WeakPolarHBondContact O-CE1 3.47Å; L391-F559 WeakPolarHBondContact O-CZ 3.45Å; F559-S571 PolarHBondContact N-O 3.17Å; F559-W573 AromaticContact CD2-CE2 3.45Å; F559-W573 VanDerWaalsContact CD2-CE2 3.45Å; F559-W573 AromaticContact CD2-CH2 3.97Å; F559-W573 HydrophobicContact CD2-CH2 3.97Å; F559-W573 AromaticContact CD2-CZ2 3.11Å; F559-W573 HydrophobicContact CD2-CZ2 3.11Å; F559-W573 AromaticContact CD2-NE1 3.6Å; F559-W573 HydrophobicContact CE2-CH2 4.12Å; F559-W573 AromaticContact CE2-CZ2 3.38Å; F559-W573 HydrophobicContact CE2-CZ2 3.38Å; F559-W573 AromaticContact CG-CE2 3.93Å; F559-W573 HydrophobicContact CG-CZ2 4.01Å; F559-W573 AromaticContact CG-NE1 3.56Å; F559-W573 HydrophobicContact CZ-CZ2 4.45Å; F559-Y600 VanDerWaalsContact CD1-CA 3.44Å; F559-Y600 HydrophobicContact CD1-CD1 4.38Å; F559-Y600 HydrophobicContact CD2-CD1 4.48Å; F559-Y600 HydrophobicContact CE1-CD1 4.09Å; F559-Y600 HydrophobicContact CE1-CG 4.43Å; F559-Y600 HydrophobicContact CE2-CD1 4.16Å; F559-Y600 AromaticContact CZ-CD1 3.96Å; F559-Y600 HydrophobicContact CZ-CD1 3.96Å
560	D	97.7	Very high	91.8	Very high	11 Å²	11	20.9 Å²	20.9	6%	0.059	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	161.4	178.6	-162.6	22.8	0	0	0	111.5	N430 W570 S571 G601 V602	N430-D560 PolarHBondContact ND2-OD1 2.86Å; D560-W570 VanDerWaalsContact O-CA 3.26Å; D560-W570 WeakPolarHBondContact O-CA 3.31Å; D560-W570 WeakPolarHBondContact O-CB 3.19Å; D560-S571 PolarHBondContact N-OG 3.04Å; D560-S571 PolarHBondContact O-N 2.92Å; D560-S571 PolarHBondContact O-OG 3.41Å; D560-G601 VanDerWaalsContact OD2-CA 3.28Å; D560-G601 WeakPolarHBondContact OD2-CA 3.36Å; D560-V602 HydrophobicContact CB-CG2 4.43Å; D560-V602 PolarHBondContact OD2-N 3.41Å
561	M	97.7	Very high	92.2	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.02	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	146.1	-172	-173.2	173.4	68.3	0	0	113.3	A517 A519 Y528 W529 V530 I537 V568 F569 W570	A517-M561 HydrophobicContact CB-CB 3.68Å; A519-M561 HydrophobicContact CB-CE 4.21Å; A519-M561 HydrophobicContact CB-CG 4.48Å; Y528-M561 VanDerWaalsContact C-CE 3.46Å; Y528-M561 WeakPolarHBondContact O-CE 3.16Å; W529-M561 VanDerWaalsContact CA-CE 3.45Å; V530-M561 HydrophobicContact CB-SD 4.24Å; I537-M561 HydrophobicContact CD1-SD 4.39Å; I537-M561 HydrophobicContact CG1-SD 4.37Å; I537-M561 HydrophobicContact CG2-SD 4.22Å; M561-V568 HydrophobicContact CE-CG1 4.48Å; M561-V568 HydrophobicContact CG-CG1 3.53Å; M561-V568 HydrophobicContact SD-CG1 3.23Å; M561-V568 WeakPolarHBondContact SD-CG1 3.29Å; M561-F569 CarbonylContact C-O 3.39Å; M561-F569 VanDerWaalsContact CA-O 3.23Å; M561-F569 WeakPolarHBondContact CA-O 3.06Å; M561-F569 VanDerWaalsContact CG-O 3.3Å; M561-F569 WeakPolarHBondContact CG-O 3.4Å; M561-W570 HydrophobicContact CB-CB 4.16Å; M561-W570 HydrophobicContact CG-CB 4.09Å
562	V	98.2	Very high	92.5	Very high	12 Å²	12	19.6 Å²	19.6	7%	0.073	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	156.5	173.1	-65.2	0	0	0	0	111.3	L357 F569 V602 I604	L357-V562 HydrophobicContact CD1-CG2 4.11Å; V562-F569 HydrophobicContact CG2-CB 3.88Å; V562-F569 HydrophobicContact CG2-CD2 4.22Å; V562-F569 HydrophobicContact CG2-CG 4.5Å; V562-F569 PolarHBondContact N-O 2.78Å; V562-F569 PolarHBondContact O-N 3.13Å; V562-V602 HydrophobicContact CG1-CB 4.49Å; V562-V602 HydrophobicContact CG1-CG1 4.48Å; V562-V602 WeakPolarHBondContact CG1-O 2.97Å; V562-V602 HydrophobicContact CG2-CB 4.41Å; V562-V602 HydrophobicContact CG2-CG1 3.61Å; V562-I604 HydrophobicContact CB-CG1 4.15Å; V562-I604 HydrophobicContact CG2-CD1 3.96Å; V562-I604 HydrophobicContact CG2-CG1 3.81Å
563	V	97.1	Very high	92.6	Very high	5 Å²	5	22 Å²	22	3%	0.03	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.6	176.7	-175.7	0	0	0	0	110	A519 D521 Y528 Y567 V568 Y609	A519-V563 HydrophobicContact CB-CG2 3.79Å; D521-V563 HydrophobicContact CB-CG1 4.18Å; Y528-V563 HydrophobicContact CD2-CG2 3.8Å; Y528-V563 HydrophobicContact CE2-CG1 4.48Å; Y528-V563 HydrophobicContact CE2-CG2 4.5Å; Y528-V563 HydrophobicContact CG-CG2 4.01Å; V563-Y567 WeakPolarHBondContact CA-O 3.38Å; V563-V568 HydrophobicContact CG2-CG2 3.98Å; V563-Y609 WeakPolarHBondContact O-CE2 3.32Å
564	F	94.8	Very high	92.8	Very high	11 Å²	11	22.6 Å²	22.6	5%	0.048	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	139.5	176.2	-176.2	-103.3	0	0	0	111.8	L349 L370 D566 Y567 F569 I604 H606 Y609	L349-F564 HydrophobicContact CD2-CE1 4.05Å; L349-F564 HydrophobicContact CD2-CZ 3.81Å; L370-F564 HydrophobicContact CD1-CD1 3.56Å; L370-F564 HydrophobicContact CD1-CE1 3.52Å; L370-F564 HydrophobicContact CD1-CZ 4.48Å; F564-D566 PolarHBondContact O-N 2.82Å; F564-Y567 PolarHBondContact N-O 2.92Å; F564-Y567 PolarHBondContact O-N 2.86Å; F564-F569 HydrophobicContact CB-CE2 4.32Å; F564-I604 HydrophobicContact CB-CD1 3.86Å; F564-I604 HydrophobicContact CB-CG1 3.99Å; F564-I604 HydrophobicContact CB-CG2 4.41Å; F564-I604 HydrophobicContact CD1-CG2 4.46Å; F564-I604 HydrophobicContact CD2-CG2 4.03Å; F564-I604 HydrophobicContact CE2-CG2 4.44Å; F564-I604 HydrophobicContact CG-CD1 4.35Å; F564-I604 HydrophobicContact CG-CG2 4.03Å; F564-H606 HydrophobicContact CE2-CB 4.09Å; F564-H606 AromaticContact CE2-ND1 3.85Å; F564-H606 HydrophobicContact CZ-CB 3.84Å; F564-H606 AromaticContact CZ-CG 3.56Å; F564-H606 AromaticContact CZ-ND1 3.48Å; F564-H606 WeakPolarHBondContact CZ-ND1 3.05Å; F564-Y609 AromaticContact CD2-CD2 3.71Å; F564-Y609 HydrophobicContact CD2-CD2 3.71Å; F564-Y609 HydrophobicContact CD2-CG 4.16Å; F564-Y609 HydrophobicContact CE2-CD2 4.43Å
565	D	91.1	Very high	93.2	Very high	42 Å²	42	22.8 Å²	22.8	23%	0.225	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.7	54.2	174.8	-161.4	30.8	0	0	0	113.9	Y338 Y567	Y338-D565 WeakPolarHBondContact CE1-OD1 3.4Å; D565-Y567 VanDerWaalsContact O-CD2 3.22Å; D565-Y567 WeakPolarHBondContact O-CD2 3.41Å; D565-Y567 PolarHBondContact O-N 3.13Å
566	D	91	Very high	93.4	Very high	15 Å²	15	26.2 Å²	26.2	8%	0.08	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	9.1	-179.4	-62.7	-0.9	0	0	0	115.7	S320 R524 F564 N582 V583 R584	S320-D566 PolarHBondContact OG-OD2 2.79Å; R524-D566 IonicContact CZ-OD1 2.83Å; R524-D566 IonicContact NH1-OD1 3.89Å; R524-D566 PolarHBondContact NH1-OD1 3.05Å; R524-D566 IonicContact NH2-OD1 3.19Å; R524-D566 PolarHBondContact NH2-OD1 2.81Å; R524-D566 IonicContact NH2-OD2 2.74Å; F564-D566 PolarHBondContact O-N 2.82Å; D566-N582 CarbonylContact O-C 3.58Å; D566-N582 VanDerWaalsContact O-CA 3.31Å; D566-N582 WeakPolarHBondContact O-CA 3.47Å; D566-N582 PolarHBondContact O-ND2 2.98Å; D566-V583 HydrophobicContact CB-CG2 4.14Å; D566-V583 WeakPolarHBondContact O-CG2 3.5Å; D566-V583 PolarHBondContact O-N 2.9Å; D566-R584 WeakPolarHBondContact OD2-CD 3.2Å
567	Y	94.3	Very high	93.7	Very high	51 Å²	51	23.5 Å²	23.5	20%	0.2	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	142	173.2	-69.1	-84.7	0	0	0	112.2	V563 F564 D565 F569 K580 V581 N582 D588	V563-Y567 WeakPolarHBondContact CA-O 3.38Å; F564-Y567 PolarHBondContact N-O 2.92Å; F564-Y567 PolarHBondContact O-N 2.86Å; D565-Y567 VanDerWaalsContact O-CD2 3.22Å; D565-Y567 WeakPolarHBondContact O-CD2 3.41Å; D565-Y567 PolarHBondContact O-N 3.13Å; Y567-F569 HydrophobicContact CD2-CZ 4.41Å; Y567-F569 HydrophobicContact CG-CE1 4.47Å; Y567-F569 HydrophobicContact CG-CZ 4.02Å; Y567-K580 HydrophobicContact CD1-CB 4.32Å; Y567-K580 HydrophobicContact CD1-CD 3.86Å; Y567-K580 HydrophobicContact CE1-CD 3.89Å; Y567-V581 WeakPolarHBondContact CA-O 3.37Å; Y567-N582 HydrophobicContact CD1-CB 3.91Å; Y567-N582 HydrophobicContact CE1-CB 3.6Å; Y567-D588 WeakPolarHBondContact CE1-OD2 3.44Å; Y567-D588 PolarHBondContact OH-OD2 2.93Å
568	V	97	Very high	94	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.4	161.2	-179.6	0	0	0	0	107.5	Y528 I537 L550 M561 V563 K580 V581 V583	Y528-V568 HydrophobicContact CD1-CG2 4.05Å; Y528-V568 HydrophobicContact CE1-CG2 4.32Å; Y528-V568 HydrophobicContact CG-CG2 4.46Å; I537-V568 HydrophobicContact CD1-CG1 4.25Å; L550-V568 HydrophobicContact CD2-CG2 3.68Å; M561-V568 HydrophobicContact CE-CG1 4.48Å; M561-V568 HydrophobicContact CG-CG1 3.53Å; M561-V568 HydrophobicContact SD-CG1 3.23Å; M561-V568 WeakPolarHBondContact SD-CG1 3.29Å; V563-V568 HydrophobicContact CG2-CG2 3.98Å; V568-K580 CarbonylContact O-C 3.48Å; V568-K580 VanDerWaalsContact O-CA 3.25Å; V568-K580 WeakPolarHBondContact O-CA 3.38Å; V568-V581 HydrophobicContact CB-CG1 4Å; V568-V581 PolarHBondContact N-O 2.83Å; V568-V581 PolarHBondContact O-N 2.97Å; V568-V583 HydrophobicContact CG2-CG1 3.63Å
569	F	97.1	Very high	93.9	Very high	4 Å²	4	21.6 Å²	21.6	2%	0.018	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.7	175.9	-57.9	-77.7	0	0	0	109.5	L357 L370 W372 M561 V562 F564 Y567 M579 K580 V592 I604	L357-F569 HydrophobicContact CD1-CB 4.2Å; L357-F569 HydrophobicContact CD1-CD2 4.3Å; L357-F569 HydrophobicContact CD1-CG 4.11Å; L357-F569 HydrophobicContact CD2-CD1 4.05Å; L357-F569 HydrophobicContact CD2-CG 4.29Å; L370-F569 HydrophobicContact CD2-CE2 4.4Å; L370-F569 HydrophobicContact CD2-CZ 4.22Å; W372-F569 AromaticContact CH2-CE1 3.65Å; W372-F569 HydrophobicContact CH2-CE1 3.65Å; W372-F569 HydrophobicContact CH2-CZ 4.24Å; W372-F569 HydrophobicContact CZ2-CE1 4.48Å; M561-F569 CarbonylContact C-O 3.39Å; M561-F569 VanDerWaalsContact CA-O 3.23Å; M561-F569 WeakPolarHBondContact CA-O 3.06Å; M561-F569 VanDerWaalsContact CG-O 3.3Å; M561-F569 WeakPolarHBondContact CG-O 3.4Å; V562-F569 HydrophobicContact CG2-CB 3.88Å; V562-F569 HydrophobicContact CG2-CD2 4.22Å; V562-F569 HydrophobicContact CG2-CG 4.5Å; V562-F569 PolarHBondContact N-O 2.78Å; V562-F569 PolarHBondContact O-N 3.13Å; F564-F569 HydrophobicContact CB-CE2 4.32Å; Y567-F569 HydrophobicContact CD2-CZ 4.41Å; Y567-F569 HydrophobicContact CG-CE1 4.47Å; Y567-F569 HydrophobicContact CG-CZ 4.02Å; F569-M579 VanDerWaalsContact CA-O 3.3Å; F569-M579 WeakPolarHBondContact CA-O 3.38Å; F569-K580 HydrophobicContact CD1-CB 3.57Å; F569-K580 HydrophobicContact CE1-CB 3.58Å; F569-K580 HydrophobicContact CE1-CD 4.25Å; F569-K580 HydrophobicContact CE1-CG 4.47Å; F569-V592 HydrophobicContact CD1-CG2 3.84Å; F569-V592 HydrophobicContact CE1-CG2 4.1Å; F569-I604 HydrophobicContact CD2-CD1 4.33Å
570	W	97.5	Very high	93.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.6	176.8	73	100.5	0	0	0	112	I537 F551 I555 D560 M561 V578 M579 K580 V581 V589	I537-W570 HydrophobicContact CD1-CD2 4.06Å; I537-W570 HydrophobicContact CD1-CE3 3.85Å; I537-W570 HydrophobicContact CD1-CH2 4.42Å; I537-W570 HydrophobicContact CD1-CZ3 4.05Å; F551-W570 AromaticContact CD1-CH2 3.98Å; F551-W570 HydrophobicContact CD1-CH2 3.98Å; F551-W570 HydrophobicContact CD1-CZ2 4.4Å; F551-W570 AromaticContact CE1-CH2 3.77Å; F551-W570 HydrophobicContact CE1-CH2 3.77Å; F551-W570 HydrophobicContact CE1-CZ2 4.11Å; I555-W570 HydrophobicContact CG1-CZ2 4.08Å; D560-W570 VanDerWaalsContact O-CA 3.26Å; D560-W570 WeakPolarHBondContact O-CA 3.31Å; D560-W570 WeakPolarHBondContact O-CB 3.19Å; M561-W570 HydrophobicContact CB-CB 4.16Å; M561-W570 HydrophobicContact CG-CB 4.09Å; W570-V578 CarbonylContact O-C 3.58Å; W570-V578 WeakPolarHBondContact O-CA 3.22Å; W570-M579 HydrophobicContact CD2-CB 3.65Å; W570-M579 HydrophobicContact CE3-CB 3.89Å; W570-M579 HydrophobicContact CG-CB 4.39Å; W570-M579 HydrophobicContact CH2-CB 3.51Å; W570-M579 HydrophobicContact CH2-CG 4.49Å; W570-M579 HydrophobicContact CZ2-CB 3.23Å; W570-M579 HydrophobicContact CZ2-CG 3.84Å; W570-M579 HydrophobicContact CZ3-CB 3.82Å; W570-M579 PolarHBondContact N-O 3.09Å; W570-M579 PolarHBondContact O-N 2.78Å; W570-K580 VanDerWaalsContact CZ3-C 3.43Å; W570-V581 HydrophobicContact CH2-CB 4.2Å; W570-V581 HydrophobicContact CH2-CG1 4.29Å; W570-V581 HydrophobicContact CZ3-CB 3.92Å; W570-V581 HydrophobicContact CZ3-CG1 3.71Å; W570-V589 HydrophobicContact CH2-CG2 4.35Å
571	S	96.3	Very high	93.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	134	170.9	59.9	0	0	0	0	110	P558 F559 D560 Y600	P558-S571 CarbonylContact C-O 3.53Å; P558-S571 WeakPolarHBondContact CA-O 3.41Å; F559-S571 PolarHBondContact N-O 3.17Å; D560-S571 PolarHBondContact N-OG 3.04Å; D560-S571 PolarHBondContact O-N 2.92Å; D560-S571 PolarHBondContact O-OG 3.41Å; S571-Y600 WeakPolarHBondContact CB-O 3.27Å; S571-Y600 PolarHBondContact OG-O 2.76Å
572	D	94.2	Very high	93.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125.8	177	-170.9	-56.4	0	0	0	111.7	L556 H557 R574 L575 K576 A577	L556-D572 PolarHBondContact N-OD2 2.88Å; H557-D572 PolarHBondContact N-OD1 3.32Å; H557-D572 PolarHBondContact N-OD2 3.04Å; D572-R574 PolarHBondContact OD1-N 3.41Å; D572-L575 HydrophobicContact CB-CB 3.97Å; D572-L575 HydrophobicContact CB-CD1 4.05Å; D572-L575 HydrophobicContact CB-CG 4.26Å; D572-L575 PolarHBondContact OD1-N 3.39Å; D572-K576 PolarHBondContact O-N 3.01Å; D572-K576 VanDerWaalsContact O-N 3.13Å; D572-A577 PolarHBondContact N-O 2.88Å; D572-A577 PolarHBondContact O-N 3.3Å
573	W	89	Confident	93.1	Very high	58 Å²	58	23 Å²	23	22%	0.22	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-32.2	-175.7	-72.4	1.2	0	0	0	114.1	H557 F559 K576 A599 Y600	H557-W573 HydrophobicContact CB-CB 4.12Å; H557-W573 AromaticContact CD2-CD2 3.72Å; H557-W573 AromaticContact CD2-CE3 3.28Å; H557-W573 AromaticContact CD2-CZ3 3.98Å; H557-W573 AromaticContact NE2-CE3 3.37Å; H557-W573 AromaticContact NE2-CZ3 3.6Å; H557-W573 PolarHBondContact O-N 2.84Å; F559-W573 AromaticContact CD2-CE2 3.45Å; F559-W573 VanDerWaalsContact CD2-CE2 3.45Å; F559-W573 AromaticContact CD2-CH2 3.97Å; F559-W573 HydrophobicContact CD2-CH2 3.97Å; F559-W573 AromaticContact CD2-CZ2 3.11Å; F559-W573 HydrophobicContact CD2-CZ2 3.11Å; F559-W573 AromaticContact CD2-NE1 3.6Å; F559-W573 HydrophobicContact CE2-CH2 4.12Å; F559-W573 AromaticContact CE2-CZ2 3.38Å; F559-W573 HydrophobicContact CE2-CZ2 3.38Å; F559-W573 AromaticContact CG-CE2 3.93Å; F559-W573 HydrophobicContact CG-CZ2 4.01Å; F559-W573 AromaticContact CG-NE1 3.56Å; F559-W573 HydrophobicContact CZ-CZ2 4.45Å; W573-K576 VanDerWaalsContact O-CD 3.27Å; W573-K576 WeakPolarHBondContact O-CD 3.44Å; W573-K576 WeakPolarHBondContact O-CE 3.36Å; W573-K576 PolarHBondContact O-NZ 2.74Å; W573-A599 PolarHBondContact NE1-O 2.94Å; W573-Y600 AromaticContact CE2-CE1 3.91Å; W573-Y600 AromaticContact CZ2-CD1 3.85Å; W573-Y600 HydrophobicContact CZ2-CD1 3.85Å; W573-Y600 AromaticContact CZ2-CE1 3.6Å; W573-Y600 HydrophobicContact CZ2-CE1 3.6Å; W573-Y600 AromaticContact NE1-CD1 3.75Å; W573-Y600 AromaticContact NE1-CE1 3.89Å
574	R	85.3	Confident	92.6	Very high	75 Å²	75	27.1 Å²	27.1	28%	0.283	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-37.6	-176.5	-78	-170.6	68.8	132.6	12.7	111	D180 I182 L556 H557 D572 K576	D180-R574 IonicContact OD1-NH2 3.55Å; D180-R574 PolarHBondContact OD1-NH2 2.81Å; D180-R574 IonicContact OD2-CZ 3.05Å; D180-R574 VanDerWaalsContact OD2-CZ 3.24Å; D180-R574 IonicContact OD2-NH1 3.44Å; D180-R574 PolarHBondContact OD2-NH1 3.08Å; D180-R574 IonicContact OD2-NH2 3.69Å; D180-R574 PolarHBondContact OD2-NH2 3.13Å; I182-R574 VanDerWaalsContact CG1-NH2 3.29Å; L556-R574 HydrophobicContact CB-CB 3.6Å; L556-R574 HydrophobicContact CB-CG 4.43Å; L556-R574 HydrophobicContact CD1-CB 3.91Å; L556-R574 HydrophobicContact CG-CB 4.44Å; H557-R574 HydrophobicContact CB-CB 4.13Å; H557-R574 HydrophobicContact CB-CG 3.74Å; D572-R574 PolarHBondContact OD1-N 3.41Å; R574-K576 PolarHBondContact O-N 3.45Å
575	L	88.1	Confident	92.2	Very high	54 Å²	54	30.4 Å²	30.4	28%	0.283	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-15	171.4	-64.5	173.9	0	0	0	113.1	A554 L556 D572 A577 M579	A554-L575 WeakPolarHBondContact O-CD1 3.34Å; L556-L575 HydrophobicContact CB-CG 4.37Å; L556-L575 HydrophobicContact CD1-CD2 3.49Å; L556-L575 VanDerWaalsContact CD1-CD2 3.49Å; L556-L575 HydrophobicContact CD1-CG 3.87Å; L556-L575 HydrophobicContact CG-CD2 3.97Å; L556-L575 HydrophobicContact CG-CG 4.05Å; D572-L575 HydrophobicContact CB-CB 3.97Å; D572-L575 HydrophobicContact CB-CD1 4.05Å; D572-L575 HydrophobicContact CB-CG 4.26Å; D572-L575 PolarHBondContact OD1-N 3.39Å; L575-A577 HydrophobicContact CB-CB 4.47Å; L575-A577 PolarHBondContact O-N 2.03Å; L575-M579 HydrophobicContact CD1-CE 4.41Å; L575-M579 HydrophobicContact CD1-CG 3.95Å; L575-M579 HydrophobicContact CD1-SD 4.23Å
576	K	90.3	Very high	91.9	Very high	79 Å²	79	30.4 Å²	30.4	34%	0.343	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	38.6	179.9	-56	-68.6	176.7	-156.3	0	111.8	D572 W573 R574 F595 G597	D572-K576 PolarHBondContact O-N 3.01Å; D572-K576 VanDerWaalsContact O-N 3.13Å; W573-K576 VanDerWaalsContact O-CD 3.27Å; W573-K576 WeakPolarHBondContact O-CD 3.44Å; W573-K576 WeakPolarHBondContact O-CE 3.36Å; W573-K576 PolarHBondContact O-NZ 2.74Å; R574-K576 PolarHBondContact O-N 3.45Å; K576-F595 HydrophobicContact CB-CD2 4.47Å; K576-F595 HydrophobicContact CB-CE2 4.36Å; K576-F595 WeakPolarHBondContact CB-O 3.28Å; K576-F595 WeakPolarHBondContact O-CD2 3.26Å; K576-F595 WeakPolarHBondContact O-CE2 3.41Å; K576-F595 WeakPolarHBondContact O-CZ 3.41Å; K576-F595 PolarHBondContact O-N 2.78Å; K576-G597 WeakPolarHBondContact CD-O 3.3Å
577	A	91.4	Very high	91.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	156.6	-174.9	0	0	0	0	0	112	D572 L575 M579 P591 Q593 N594 F595	D572-A577 PolarHBondContact N-O 2.88Å; D572-A577 PolarHBondContact O-N 3.3Å; L575-A577 HydrophobicContact CB-CB 4.47Å; L575-A577 PolarHBondContact O-N 2.03Å; A577-M579 HydrophobicContact CB-CG 4.35Å; A577-M579 HydrophobicContact CB-SD 3.76Å; A577-P591 HydrophobicContact CB-CB 4.22Å; A577-Q593 CarbonylContact C-O 3.59Å; A577-Q593 WeakPolarHBondContact CA-O 3.49Å; A577-Q593 WeakPolarHBondContact CB-O 2.72Å; A577-N594 WeakPolarHBondContact CB-OD1 3.35Å; A577-F595 VanDerWaalsContact CA-CE1 3.41Å
578	V	94.7	Very high	91.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	120.3	155	177	0	0	0	0	106.1	L357 F359 W570 V592 Q593 F595	L357-V578 HydrophobicContact CD2-CG1 3.9Å; F359-V578 HydrophobicContact CB-CG2 4Å; F359-V578 HydrophobicContact CD1-CG2 4.1Å; F359-V578 HydrophobicContact CD2-CG2 3.65Å; F359-V578 HydrophobicContact CE2-CG2 4.13Å; F359-V578 HydrophobicContact CG-CG2 3.65Å; W570-V578 CarbonylContact O-C 3.58Å; W570-V578 WeakPolarHBondContact O-CA 3.22Å; V578-V592 HydrophobicContact CB-CB 4.43Å; V578-V592 HydrophobicContact CG1-CB 4.31Å; V578-V592 HydrophobicContact CG1-CG2 4.25Å; V578-V592 WeakPolarHBondContact O-CA 3.25Å; V578-V592 WeakPolarHBondContact O-CB 3.23Å; V578-V592 PolarHBondContact O-N 2.87Å; V578-Q593 PolarHBondContact N-O 3.41Å; V578-Q593 PolarHBondContact O-N 2.87Å; V578-F595 HydrophobicContact CG2-CE1 4.1Å
579	M	93.4	Very high	91.1	Very high	15 Å²	15	37.4 Å²	37.4	7%	0.074	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	159.9	-176.7	-61.8	-61.6	-69.6	0	0	110.5	A554 F569 W570 L575 A577 P591	A554-M579 HydrophobicContact CB-CE 4.33Å; F569-M579 VanDerWaalsContact CA-O 3.3Å; F569-M579 WeakPolarHBondContact CA-O 3.38Å; W570-M579 HydrophobicContact CD2-CB 3.65Å; W570-M579 HydrophobicContact CE3-CB 3.89Å; W570-M579 HydrophobicContact CG-CB 4.39Å; W570-M579 HydrophobicContact CH2-CB 3.51Å; W570-M579 HydrophobicContact CH2-CG 4.49Å; W570-M579 HydrophobicContact CZ2-CB 3.23Å; W570-M579 HydrophobicContact CZ2-CG 3.84Å; W570-M579 HydrophobicContact CZ3-CB 3.82Å; W570-M579 PolarHBondContact N-O 3.09Å; W570-M579 PolarHBondContact O-N 2.78Å; L575-M579 HydrophobicContact CD1-CE 4.41Å; L575-M579 HydrophobicContact CD1-CG 3.95Å; L575-M579 HydrophobicContact CD1-SD 4.23Å; A577-M579 HydrophobicContact CB-CG 4.35Å; A577-M579 HydrophobicContact CB-SD 3.76Å; M579-P591 HydrophobicContact SD-CB 3.88Å
580	K	94	Very high	90.7	Very high	32 Å²	32	37.7 Å²	37.7	14%	0.139	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	151.5	171.4	63	158.3	-176.8	164.7	0	111.8	W372 Y567 V568 F569 W570 D588 V589 G590 V592	W372-K580 HydrophobicContact CH2-CD 4.36Å; W372-K580 HydrophobicContact CZ2-CD 3.78Å; Y567-K580 HydrophobicContact CD1-CB 4.32Å; Y567-K580 HydrophobicContact CD1-CD 3.86Å; Y567-K580 HydrophobicContact CE1-CD 3.89Å; V568-K580 CarbonylContact O-C 3.48Å; V568-K580 VanDerWaalsContact O-CA 3.25Å; V568-K580 WeakPolarHBondContact O-CA 3.38Å; F569-K580 HydrophobicContact CD1-CB 3.57Å; F569-K580 HydrophobicContact CE1-CB 3.58Å; F569-K580 HydrophobicContact CE1-CD 4.25Å; F569-K580 HydrophobicContact CE1-CG 4.47Å; W570-K580 VanDerWaalsContact CZ3-C 3.43Å; K580-D588 IonicContact NZ-OD1 2.83Å; K580-V589 VanDerWaalsContact O-CA 3.27Å; K580-V589 WeakPolarHBondContact O-CA 3.29Å; K580-V589 VanDerWaalsContact O-CG2 3.29Å; K580-V589 WeakPolarHBondContact O-CG2 3.22Å; K580-G590 WeakPolarHBondContact CG-O 3.48Å; K580-G590 PolarHBondContact N-O 2.76Å; K580-G590 PolarHBondContact O-N 3.07Å; K580-G590 VanDerWaalsContact O-N 3.08Å; K580-V592 HydrophobicContact CB-CG2 3.8Å; K580-V592 HydrophobicContact CD-CG2 4.4Å; K580-V592 HydrophobicContact CG-CG2 3.9Å
581	V	94	Very high	90.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	136.2	168.7	65.5	0	0	0	0	109.5	I537 L550 F551 Y567 V568 W570 V586 D588 V589	I537-V581 HydrophobicContact CD1-CG1 4.41Å; L550-V581 HydrophobicContact CD2-CG1 4.26Å; F551-V581 HydrophobicContact CB-CG1 4.31Å; F551-V581 HydrophobicContact CB-CG2 4.37Å; F551-V581 HydrophobicContact CD1-CB 4.3Å; F551-V581 HydrophobicContact CD1-CG1 4.28Å; F551-V581 HydrophobicContact CD1-CG2 4.3Å; F551-V581 HydrophobicContact CD2-CG2 4.02Å; F551-V581 HydrophobicContact CE2-CG2 4.38Å; F551-V581 HydrophobicContact CG-CB 4.43Å; F551-V581 HydrophobicContact CG-CG1 4.37Å; F551-V581 HydrophobicContact CG-CG2 3.99Å; Y567-V581 WeakPolarHBondContact CA-O 3.37Å; V568-V581 HydrophobicContact CB-CG1 4Å; V568-V581 PolarHBondContact N-O 2.83Å; V568-V581 PolarHBondContact O-N 2.97Å; W570-V581 HydrophobicContact CH2-CB 4.2Å; W570-V581 HydrophobicContact CH2-CG1 4.29Å; W570-V581 HydrophobicContact CZ3-CB 3.92Å; W570-V581 HydrophobicContact CZ3-CG1 3.71Å; V581-V586 HydrophobicContact CG2-CG1 4.01Å; V581-D588 WeakPolarHBondContact CA-O 3.5Å; V581-V589 HydrophobicContact CB-CB 4.39Å; V581-V589 HydrophobicContact CB-CG2 4.33Å; V581-V589 HydrophobicContact CG2-CB 4.21Å
582	N	92.9	Very high	90.1	Very high	19 Å²	19	39 Å²	39	10%	0.102	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	131.5	175.9	-171.8	-77.4	0	0	0	110.9	D566 Y567 R584 N585 V586 D588	D566-N582 CarbonylContact O-C 3.58Å; D566-N582 VanDerWaalsContact O-CA 3.31Å; D566-N582 WeakPolarHBondContact O-CA 3.47Å; D566-N582 PolarHBondContact O-ND2 2.98Å; Y567-N582 HydrophobicContact CD1-CB 3.91Å; Y567-N582 HydrophobicContact CE1-CB 3.6Å; N582-R584 VanDerWaalsContact C-N 3.27Å; N582-R584 PolarHBondContact O-N 2.84Å; N582-R584 WeakPolarHBondContact OD1-CA 3.44Å; N582-R584 PolarHBondContact OD1-N 2.83Å; N582-N585 WeakPolarHBondContact CB-O 3.25Å; N582-N585 CarbonylContact O-C 3.55Å; N582-N585 PolarHBondContact OD1-N 3.05Å; N582-V586 WeakPolarHBondContact O-CA 3.42Å; N582-V586 PolarHBondContact O-N 2.84Å; N582-D588 HydrophobicContact CB-CB 3.99Å; N582-D588 PolarHBondContact N-O 3.34Å
583	V	91.3	Very high	89.9	Confident	22 Å²	22	39.3 Å²	39.3	13%	0.133	20%	0.199	C	C	.	.	S	Bend	trans	-70.7	-20.3	-176	-56.6	0	0	0	0	114	Y528 L550 D566 V568	Y528-V583 HydrophobicContact CE1-CG1 4.13Å; L550-V583 HydrophobicContact CD1-CB 4.27Å; L550-V583 HydrophobicContact CD2-CG1 4.18Å; D566-V583 HydrophobicContact CB-CG2 4.14Å; D566-V583 WeakPolarHBondContact O-CG2 3.5Å; D566-V583 PolarHBondContact O-N 2.9Å; V568-V583 HydrophobicContact CG2-CG1 3.63Å
584	R	86.5	Confident	89.9	Confident	93 Å²	93	41.2 Å²	41.2	35%	0.351	21%	0.214	S	C	.	.	S	Bend	trans	-103.5	-35	-178.9	-55.8	-179.7	73.4	-150.6	-1.5	111.8	R318 S346 D566 N582	R318-R584 PolarHBondContact O-NH2 2.9Å; S346-R584 PolarHBondContact OG-NH1 3.24Å; D566-R584 WeakPolarHBondContact OD2-CD 3.2Å; N582-R584 VanDerWaalsContact C-N 3.27Å; N582-R584 PolarHBondContact O-N 2.84Å; N582-R584 WeakPolarHBondContact OD1-CA 3.44Å; N582-R584 PolarHBondContact OD1-N 2.83Å
585	N	86.5	Confident	89.9	Confident	80 Å²	80	38.2 Å²	38.2	43%	0.428	20%	0.203	S	C	.	.			trans	-121.2	82.1	175.1	-179.3	24.8	0	0	0	110.5	N582 T587 D588	N582-N585 WeakPolarHBondContact CB-O 3.25Å; N582-N585 CarbonylContact O-C 3.55Å; N582-N585 PolarHBondContact OD1-N 3.05Å; N585-T587 VanDerWaalsContact CG-OG1 3.31Å; N585-T587 PolarHBondContact ND2-OG1 3.26Å; N585-T587 PolarHBondContact O-N 3.34Å; N585-T587 PolarHBondContact OD1-OG1 3.29Å; N585-D588 WeakPolarHBondContact O-CB 3.27Å; N585-D588 PolarHBondContact O-N 2.93Å
586	V	86	Confident	89.6	Confident	41 Å²	41	44.2 Å²	44.2	25%	0.248	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-16.6	-176.1	-176.5	0	0	0	0	113.4	L550 F551 V581 N582 D588	L550-V586 HydrophobicContact CD1-CG2 4.36Å; F551-V586 HydrophobicContact CB-CG1 4.43Å; F551-V586 HydrophobicContact CD2-CG1 3.38Å; F551-V586 HydrophobicContact CE2-CG1 4.03Å; F551-V586 HydrophobicContact CG-CG1 4.29Å; V581-V586 HydrophobicContact CG2-CG1 4.01Å; N582-V586 WeakPolarHBondContact O-CA 3.42Å; N582-V586 PolarHBondContact O-N 2.84Å; V586-D588 VanDerWaalsContact C-N 3.29Å; V586-D588 PolarHBondContact O-N 3.17Å
587	T	85.5	Confident	89.4	Confident	114 Å²	114	41.1 Å²	41.1	70%	0.699	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-21.1	172.9	69.7	0	0	0	0	113.9	N585 V589	N585-T587 VanDerWaalsContact CG-OG1 3.31Å; N585-T587 PolarHBondContact ND2-OG1 3.26Å; N585-T587 PolarHBondContact O-N 3.34Å; N585-T587 PolarHBondContact OD1-OG1 3.29Å; T587-V589 VanDerWaalsContact C-N 3.32Å; T587-V589 PolarHBondContact O-N 2.49Å; T587-V589 VanDerWaalsContact O-N 3.12Å
588	D	89.7	Confident	89.3	Confident	51 Å²	51	44 Å²	44	27%	0.273	24%	0.239	S	C	.	.			trans	-83.3	81.7	171	179.9	10.5	0	0	0	109.2	Y567 K580 V581 N582 N585 V586	Y567-D588 WeakPolarHBondContact CE1-OD2 3.44Å; Y567-D588 PolarHBondContact OH-OD2 2.93Å; K580-D588 IonicContact NZ-OD1 2.83Å; V581-D588 WeakPolarHBondContact CA-O 3.5Å; N582-D588 HydrophobicContact CB-CB 3.99Å; N582-D588 PolarHBondContact N-O 3.34Å; N585-D588 WeakPolarHBondContact O-CB 3.27Å; N585-D588 PolarHBondContact O-N 2.93Å; V586-D588 VanDerWaalsContact C-N 3.29Å; V586-D588 PolarHBondContact O-N 3.17Å
589	V	89.8	Confident	89.1	Confident	49 Å²	49	44 Å²	44	30%	0.297	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	146.1	178	57.8	0	0	0	0	109.5	F551 W570 K580 V581 T587	F551-V589 HydrophobicContact CE1-CG2 3.82Å; F551-V589 HydrophobicContact CE2-CG2 4.35Å; F551-V589 HydrophobicContact CZ-CB 4.15Å; F551-V589 HydrophobicContact CZ-CG1 4.27Å; F551-V589 HydrophobicContact CZ-CG2 3.55Å; W570-V589 HydrophobicContact CH2-CG2 4.35Å; K580-V589 VanDerWaalsContact O-CA 3.27Å; K580-V589 WeakPolarHBondContact O-CA 3.29Å; K580-V589 VanDerWaalsContact O-CG2 3.29Å; K580-V589 WeakPolarHBondContact O-CG2 3.22Å; V581-V589 HydrophobicContact CB-CB 4.39Å; V581-V589 HydrophobicContact CB-CG2 4.33Å; V581-V589 HydrophobicContact CG2-CB 4.21Å; T587-V589 VanDerWaalsContact C-N 3.32Å; T587-V589 PolarHBondContact O-N 2.49Å; T587-V589 VanDerWaalsContact O-N 3.12Å
590	G	89.2	Confident	89.2	Confident	9 Å²	9	43.6 Å²	43.6	9%	0.093	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.9	174.4	171.7	0	0	0	0	0	113.5	K580	K580-G590 WeakPolarHBondContact CG-O 3.48Å; K580-G590 PolarHBondContact N-O 2.76Å; K580-G590 PolarHBondContact O-N 3.07Å; K580-G590 VanDerWaalsContact O-N 3.08Å
591	P	90.7	Very high	89.4	Confident	29 Å²	29	42.1 Å²	42.1	19%	0.188	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	129.8	174.2	29.7	-33.1	0	0	0	110.8	A577 M579 N594	A577-P591 HydrophobicContact CB-CB 4.22Å; M579-P591 HydrophobicContact SD-CB 3.88Å; P591-N594 WeakPolarHBondContact CB-OD1 3.5Å
592	V	90.6	Very high	89.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-48.1	165.4	-177.2	0	0	0	0	109.7	L357 V368 W372 A377 F569 V578 K580	L357-V592 HydrophobicContact CD2-CB 4.46Å; L357-V592 HydrophobicContact CD2-CG1 3.92Å; L357-V592 HydrophobicContact CD2-CG2 4.35Å; V368-V592 HydrophobicContact CG1-CG1 4.04Å; W372-V592 HydrophobicContact CH2-CB 4.22Å; W372-V592 HydrophobicContact CH2-CG1 3.53Å; W372-V592 HydrophobicContact CH2-CG2 3.79Å; W372-V592 HydrophobicContact CZ2-CB 3.98Å; W372-V592 HydrophobicContact CZ2-CG1 3.54Å; W372-V592 HydrophobicContact CZ2-CG2 3.67Å; W372-V592 HydrophobicContact CZ3-CG1 4.2Å; A377-V592 PolarHBondContact N-O 2.85Å; A377-V592 VanDerWaalsContact N-O 3.13Å; F569-V592 HydrophobicContact CD1-CG2 3.84Å; F569-V592 HydrophobicContact CE1-CG2 4.1Å; V578-V592 HydrophobicContact CB-CB 4.43Å; V578-V592 HydrophobicContact CG1-CB 4.31Å; V578-V592 HydrophobicContact CG1-CG2 4.25Å; V578-V592 WeakPolarHBondContact O-CA 3.25Å; V578-V592 WeakPolarHBondContact O-CB 3.23Å; V578-V592 PolarHBondContact O-N 2.87Å; K580-V592 HydrophobicContact CB-CG2 3.8Å; K580-V592 HydrophobicContact CD-CG2 4.4Å; K580-V592 HydrophobicContact CG-CG2 3.9Å
593	Q	89.5	Confident	89.8	Confident	5 Å²	5	41.4 Å²	41.4	2%	0.023	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	138	175.9	176.3	-178.6	106.7	0	0	109.8	F359 R366 A577 V578 F595	F359-Q593 HydrophobicContact CZ-CB 4.03Å; F359-Q593 VanDerWaalsContact CZ-CD 3.42Å; F359-Q593 HydrophobicContact CZ-CG 4.27Å; F359-Q593 VanDerWaalsContact CZ-OE1 3.29Å; R366-Q593 VanDerWaalsContact CD-OE1 3.3Å; A577-Q593 CarbonylContact C-O 3.59Å; A577-Q593 WeakPolarHBondContact CA-O 3.49Å; A577-Q593 WeakPolarHBondContact CB-O 2.72Å; V578-Q593 PolarHBondContact N-O 3.41Å; V578-Q593 PolarHBondContact O-N 2.87Å; Q593-F595 HydrophobicContact CG-CD1 4.33Å
594	N	89.4	Confident	90	Very high	99 Å²	99	40.5 Å²	40.5	53%	0.529	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	147.2	166.7	-56.9	-63.9	0	0	0	110.6	A577 P591	A577-N594 WeakPolarHBondContact CB-OD1 3.35Å; P591-N594 WeakPolarHBondContact CB-OD1 3.5Å
595	F	83.5	Confident	90.5	Very high	11 Å²	11	37.2 Å²	37.2	5%	0.048	21%	0.21	C	C	.	.			trans	-147.8	153.9	-179.4	43	-100.8	0	0	0	113	V361 K576 A577 V578 Q593 G597 A599	V361-F595 HydrophobicContact CG1-CB 4.2Å; V361-F595 HydrophobicContact CG1-CD2 3.8Å; V361-F595 HydrophobicContact CG1-CE2 4.42Å; V361-F595 HydrophobicContact CG1-CG 3.93Å; V361-F595 HydrophobicContact CG2-CD1 3.88Å; V361-F595 HydrophobicContact CG2-CD2 4.41Å; V361-F595 HydrophobicContact CG2-CE1 4.17Å; V361-F595 HydrophobicContact CG2-CG 4.04Å; K576-F595 HydrophobicContact CB-CD2 4.47Å; K576-F595 HydrophobicContact CB-CE2 4.36Å; K576-F595 WeakPolarHBondContact CB-O 3.28Å; K576-F595 WeakPolarHBondContact O-CD2 3.26Å; K576-F595 WeakPolarHBondContact O-CE2 3.41Å; K576-F595 WeakPolarHBondContact O-CZ 3.41Å; K576-F595 PolarHBondContact O-N 2.78Å; A577-F595 VanDerWaalsContact CA-CE1 3.41Å; V578-F595 HydrophobicContact CG2-CE1 4.1Å; Q593-F595 HydrophobicContact CG-CD1 4.33Å; F595-G597 WeakPolarHBondContact CD2-O 3.44Å; F595-G597 WeakPolarHBondContact CE2-O 3.48Å; F595-G597 PolarHBondContact O-N 2.59Å; F595-A599 HydrophobicContact CE1-CB 3.81Å; F595-A599 HydrophobicContact CE2-CB 3.68Å; F595-A599 HydrophobicContact CZ-CB 3.13Å
596	N	83	Confident	90.8	Very high	181 Å²	181	33.5 Å²	33.5	97%	0.968	19%	0.19	S	C	*	.	S	Bend	trans	-90.3	76.3	170.5	-70	-12.2	0	0	0	109.2
597	G	85.7	Confident	91	Very high	13 Å²	13	35.5 Å²	35.5	13%	0.134	20%	0.204	C	C	.	.	S	Bend	trans	178.5	-176.8	-173.5	0	0	0	0	0	113.4	D362 K576 F595	D362-G597 WeakPolarHBondContact OD2-CA 3.42Å; K576-G597 WeakPolarHBondContact CD-O 3.3Å; F595-G597 WeakPolarHBondContact CD2-O 3.44Å; F595-G597 WeakPolarHBondContact CE2-O 3.48Å; F595-G597 PolarHBondContact O-N 2.59Å
598	Q	89.3	Confident	91.2	Very high	60 Å²	60	32.1 Å²	32.1	28%	0.28	18%	0.184	S	C	.	.			trans	-102.2	126.6	170.5	-74.1	-178.6	-21.9	0	0	110.2	V361 D362 Y600	V361-Q598 CarbonylContact C-O 3.58Å; V361-Q598 WeakPolarHBondContact CA-O 3.22Å; D362-Q598 PolarHBondContact N-O 2.95Å; D362-Q598 PolarHBondContact OD2-N 2.94Å; Q598-Y600 HydrophobicContact CB-CE1 4.42Å; Q598-Y600 HydrophobicContact CB-CE2 3.96Å; Q598-Y600 WeakPolarHBondContact O-CD2 3.34Å; Q598-Y600 WeakPolarHBondContact O-CE2 3.47Å; Q598-Y600 PolarHBondContact OE1-OH 2.92Å
599	A	91.5	Very high	91.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	147.1	170.7	0	0	0	0	0	111.7	S360 V361 W573 F595	S360-A599 CarbonylContact O-C 3.54Å; S360-A599 VanDerWaalsContact O-CA 3.23Å; S360-A599 WeakPolarHBondContact O-CA 3.12Å; V361-A599 HydrophobicContact CG2-CB 4.37Å; W573-A599 PolarHBondContact NE1-O 2.94Å; F595-A599 HydrophobicContact CE1-CB 3.81Å; F595-A599 HydrophobicContact CE2-CB 3.68Å; F595-A599 HydrophobicContact CZ-CB 3.13Å
600	Y	95.5	Very high	91.5	Very high	8 Å²	8	29 Å²	29	3%	0.031	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	-114.1	-179.6	-54.1	-85	0	0	0	110.7	S360 R389 I390 L391 F559 S571 W573 Q598	S360-Y600 PolarHBondContact O-N 2.89Å; S360-Y600 WeakPolarHBondContact OG-CB 3.48Å; R389-Y600 HydrophobicContact CB-CE2 4.42Å; R389-Y600 WeakPolarHBondContact CD-OH 3.48Å; I390-Y600 WeakPolarHBondContact O-CB 3.46Å; I390-Y600 WeakPolarHBondContact O-CD2 3.35Å; L391-Y600 HydrophobicContact CD2-CD1 4.34Å; L391-Y600 HydrophobicContact CD2-CE1 4.18Å; L391-Y600 VanDerWaalsContact O-CB 3.31Å; L391-Y600 WeakPolarHBondContact O-CB 3.33Å; F559-Y600 VanDerWaalsContact CD1-CA 3.44Å; F559-Y600 HydrophobicContact CD1-CD1 4.38Å; F559-Y600 HydrophobicContact CD2-CD1 4.48Å; F559-Y600 HydrophobicContact CE1-CD1 4.09Å; F559-Y600 HydrophobicContact CE1-CG 4.43Å; F559-Y600 HydrophobicContact CE2-CD1 4.16Å; F559-Y600 AromaticContact CZ-CD1 3.96Å; F559-Y600 HydrophobicContact CZ-CD1 3.96Å; S571-Y600 WeakPolarHBondContact CB-O 3.27Å; S571-Y600 PolarHBondContact OG-O 2.76Å; W573-Y600 AromaticContact CE2-CE1 3.91Å; W573-Y600 AromaticContact CZ2-CD1 3.85Å; W573-Y600 HydrophobicContact CZ2-CD1 3.85Å; W573-Y600 AromaticContact CZ2-CE1 3.6Å; W573-Y600 HydrophobicContact CZ2-CE1 3.6Å; W573-Y600 AromaticContact NE1-CD1 3.75Å; W573-Y600 AromaticContact NE1-CE1 3.89Å; Q598-Y600 HydrophobicContact CB-CE1 4.42Å; Q598-Y600 HydrophobicContact CB-CE2 3.96Å; Q598-Y600 WeakPolarHBondContact O-CD2 3.34Å; Q598-Y600 WeakPolarHBondContact O-CE2 3.47Å; Q598-Y600 PolarHBondContact OE1-OH 2.92Å
601	G	96.7	Very high	91.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	145	-175.9	0	0	0	0	0	114.1	F359 S360 D560	F359-G601 CarbonylContact C-O 3.52Å; F359-G601 WeakPolarHBondContact CA-O 3.34Å; S360-G601 PolarHBondContact N-O 3.28Å; S360-G601 PolarHBondContact OG-N 3.48Å; D560-G601 VanDerWaalsContact OD2-CA 3.28Å; D560-G601 WeakPolarHBondContact OD2-CA 3.36Å
602	V	97.9	Very high	90.9	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	135.1	177.1	-172.3	0	0	0	0	109.2	L357 L358 F359 D560 V562	L357-V602 HydrophobicContact CD1-CG1 3.68Å; L357-V602 HydrophobicContact CG-CG1 4.4Å; L358-V602 CarbonylContact O-C 3.58Å; L358-V602 WeakPolarHBondContact O-CA 3.36Å; F359-V602 HydrophobicContact CB-CG2 4.25Å; D560-V602 HydrophobicContact CB-CG2 4.43Å; D560-V602 PolarHBondContact OD2-N 3.41Å; V562-V602 HydrophobicContact CG1-CB 4.49Å; V562-V602 HydrophobicContact CG1-CG1 4.48Å; V562-V602 WeakPolarHBondContact CG1-O 2.97Å; V562-V602 HydrophobicContact CG2-CB 4.41Å; V562-V602 HydrophobicContact CG2-CG1 3.61Å
603	A	97.9	Very high	90.6	Very high	2 Å²	2	36.6 Å²	36.6	2%	0.017	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	156.4	-178.2	0	0	0	0	0	112.1	L358 L393 H395	L358-A603 HydrophobicContact CB-CB 4.34Å; L358-A603 PolarHBondContact N-O 2.88Å; L358-A603 PolarHBondContact O-N 2.98Å; L393-A603 HydrophobicContact CD2-CB 4.41Å; L393-A603 HydrophobicContact CG-CB 4.25Å; H395-A603 HydrophobicContact CB-CB 4.17Å
604	I	96.7	Very high	90.3	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.5	177.7	-61.8	-70.1	0	0	0	110	L357 L370 V562 F564 F569 H606 Y609	L357-I604 HydrophobicContact CD1-CD1 3.52Å; L370-I604 HydrophobicContact CD1-CD1 4.39Å; L370-I604 HydrophobicContact CD1-CG2 4.41Å; L370-I604 HydrophobicContact CD2-CD1 4.35Å; V562-I604 HydrophobicContact CB-CG1 4.15Å; V562-I604 HydrophobicContact CG2-CD1 3.96Å; V562-I604 HydrophobicContact CG2-CG1 3.81Å; F564-I604 HydrophobicContact CB-CD1 3.86Å; F564-I604 HydrophobicContact CB-CG1 3.99Å; F564-I604 HydrophobicContact CB-CG2 4.41Å; F564-I604 HydrophobicContact CD1-CG2 4.46Å; F564-I604 HydrophobicContact CD2-CG2 4.03Å; F564-I604 HydrophobicContact CE2-CG2 4.44Å; F564-I604 HydrophobicContact CG-CD1 4.35Å; F564-I604 HydrophobicContact CG-CG2 4.03Å; F569-I604 HydrophobicContact CD2-CD1 4.33Å; I604-H606 HydrophobicContact CG2-CB 4.01Å; I604-Y609 HydrophobicContact CB-CD1 3.69Å; I604-Y609 HydrophobicContact CB-CE1 3.86Å; I604-Y609 HydrophobicContact CB-CG 4.04Å; I604-Y609 HydrophobicContact CG1-CE1 4.41Å; I604-Y609 HydrophobicContact CG2-CD1 3.88Å; I604-Y609 HydrophobicContact CG2-CD2 4.35Å; I604-Y609 HydrophobicContact CG2-CG 3.78Å
605	D	95.1	Very high	90.1	Very high	25 Å²	25	42 Å²	42	13%	0.134	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	98.8	166.7	174.6	21.6	0	0	0	108.5	R356 L358 H395	R356-D605 HydrophobicContact CB-CB 4.23Å; R356-D605 PolarHBondContact N-O 2.78Å; R356-D605 PolarHBondContact O-N 3.05Å; L358-D605 HydrophobicContact CD1-CB 4.24Å; L358-D605 HydrophobicContact CG-CB 4.39Å; H395-D605 IonicContact CD2-OD1 2.77Å; H395-D605 IonicContact NE2-OD1 3.61Å; H395-D605 PolarHBondContact NE2-OD1 2.97Å; H395-D605 IonicContact NE2-OD2 3.56Å
606	H	93.9	Very high	90.4	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.234	C	C	.	.			trans	-160.3	131.5	173.7	-168.9	-96.4	0	0	0	111.1	D351 S397 F564 I604 V608 Y609	D351-H606 PolarHBondContact O-NE2 2.91Å; S397-H606 PolarHBondContact OG-N 3.12Å; S397-H606 VanDerWaalsContact OG-N 3.14Å; S397-H606 PolarHBondContact OG-O 3.22Å; F564-H606 HydrophobicContact CE2-CB 4.09Å; F564-H606 AromaticContact CE2-ND1 3.85Å; F564-H606 HydrophobicContact CZ-CB 3.84Å; F564-H606 AromaticContact CZ-CG 3.56Å; F564-H606 AromaticContact CZ-ND1 3.48Å; F564-H606 WeakPolarHBondContact CZ-ND1 3.05Å; I604-H606 HydrophobicContact CG2-CB 4.01Å; H606-V608 VanDerWaalsContact C-N 3.27Å; H606-V608 VanDerWaalsContact CE1-CG2 3.45Å; H606-V608 WeakPolarHBondContact CE1-CG2 3.36Å; H606-V608 WeakPolarHBondContact ND1-CB 3.37Å; H606-V608 PolarHBondContact ND1-N 2.96Å; H606-V608 VanDerWaalsContact ND1-N 3.14Å; H606-V608 PolarHBondContact O-N 2.86Å; H606-V608 VanDerWaalsContact O-N 3.16Å; H606-Y609 WeakPolarHBondContact O-CB 3.49Å; H606-Y609 PolarHBondContact O-N 3.48Å
607	P	89.4	Confident	90.6	Very high	83 Å²	83	36.4 Å²	36.4	54%	0.539	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.6	-177.4	-26.6	34.9	0	0	0	115.3	Y609	P607-Y609 VanDerWaalsContact C-N 3.35Å
608	V	91	Very high	90.8	Very high	44 Å²	44	36.7 Å²	36.7	27%	0.267	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-25	178.5	178.1	0	0	0	0	112.1	Y338 L349 H606 Q610	Y338-V608 HydrophobicContact CD2-CG1 4.22Å; Y338-V608 HydrophobicContact CE2-CG1 3.52Å; L349-V608 HydrophobicContact CD1-CB 4.29Å; L349-V608 HydrophobicContact CD1-CG1 4.23Å; L349-V608 HydrophobicContact CD1-CG2 4.26Å; H606-V608 VanDerWaalsContact C-N 3.27Å; H606-V608 VanDerWaalsContact CE1-CG2 3.45Å; H606-V608 WeakPolarHBondContact CE1-CG2 3.36Å; H606-V608 WeakPolarHBondContact ND1-CB 3.37Å; H606-V608 PolarHBondContact ND1-N 2.96Å; H606-V608 VanDerWaalsContact ND1-N 3.14Å; H606-V608 PolarHBondContact O-N 2.86Å; H606-V608 VanDerWaalsContact O-N 3.16Å; V608-Q610 VanDerWaalsContact C-N 3.34Å
609	Y	93	Very high	90.4	Very high	30 Å²	30	38.5 Å²	38.5	12%	0.118	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-40.5	178.2	-175.7	-120.4	0	0	0	111.2	Y522 V563 F564 I604 H606 P607	Y522-Y609 HydrophobicContact CD2-CD2 4.24Å; Y522-Y609 AromaticContact CD2-CE2 3.91Å; Y522-Y609 HydrophobicContact CD2-CE2 3.91Å; Y522-Y609 HydrophobicContact CE2-CD2 4.36Å; Y522-Y609 HydrophobicContact CE2-CE1 4.39Å; Y522-Y609 AromaticContact CE2-CE2 3.74Å; Y522-Y609 HydrophobicContact CE2-CE2 3.74Å; Y522-Y609 AromaticContact CE2-CZ 3.76Å; V563-Y609 WeakPolarHBondContact O-CE2 3.32Å; F564-Y609 AromaticContact CD2-CD2 3.71Å; F564-Y609 HydrophobicContact CD2-CD2 3.71Å; F564-Y609 HydrophobicContact CD2-CG 4.16Å; F564-Y609 HydrophobicContact CE2-CD2 4.43Å; I604-Y609 HydrophobicContact CB-CD1 3.69Å; I604-Y609 HydrophobicContact CB-CE1 3.86Å; I604-Y609 HydrophobicContact CB-CG 4.04Å; I604-Y609 HydrophobicContact CG1-CE1 4.41Å; I604-Y609 HydrophobicContact CG2-CD1 3.88Å; I604-Y609 HydrophobicContact CG2-CD2 4.35Å; I604-Y609 HydrophobicContact CG2-CG 3.78Å; H606-Y609 WeakPolarHBondContact O-CB 3.49Å; H606-Y609 PolarHBondContact O-N 3.48Å; P607-Y609 VanDerWaalsContact C-N 3.35Å
610	Q	92.3	Very high	89.5	Confident	5 Å²	5	42.5 Å²	42.5	2%	0.023	24%	0.243	C	C	.	.	S	Bend	trans	-110.5	77.5	-179.3	-70.6	178.7	-14.3	0	0	111	H395 W435 V608 T612	H395-Q610 PolarHBondContact O-NE2 2.92Å; W435-Q610 HydrophobicContact CD2-CB 4.03Å; W435-Q610 HydrophobicContact CD2-CG 3.69Å; W435-Q610 HydrophobicContact CE3-CG 4.02Å; W435-Q610 HydrophobicContact CG-CB 3.87Å; W435-Q610 HydrophobicContact CG-CG 3.9Å; W435-Q610 HydrophobicContact CZ2-CG 4.44Å; V608-Q610 VanDerWaalsContact C-N 3.34Å; Q610-T612 WeakPolarHBondContact O-CG2 3.4Å; Q610-T612 PolarHBondContact O-N 3.3Å; Q610-T612 VanDerWaalsContact O-N 3.12Å
611	N	85.6	Confident	88.2	Confident	45 Å²	45	46.5 Å²	46.5	24%	0.241	26%	0.261	C	S	.	.			trans	-59.9	118.4	-178.8	-169.6	-22.1	0	0	0	111.6	S613 W614	N611-S613 VanDerWaalsContact CG-OG 3.29Å; N611-S613 PolarHBondContact ND2-OG 3.32Å; N611-S613 WeakPolarHBondContact OD1-CB 3.42Å; N611-S613 PolarHBondContact OD1-N 3.4Å; N611-S613 PolarHBondContact OD1-OG 2.8Å; N611-W614 HydrophobicContact CB-CH2 4.45Å; N611-W614 HydrophobicContact CB-CZ2 4.05Å
612	T	82.3	Confident	87.6	Confident	72 Å²	72	49.3 Å²	49.3	44%	0.442	29%	0.29	S	S	.	.			trans	-95.6	5.8	-179.1	62.2	0	0	0	0	114.2	R398 Q610 W614	R398-T612 HydrophobicContact CB-CG2 4.46Å; Q610-T612 WeakPolarHBondContact O-CG2 3.4Å; Q610-T612 PolarHBondContact O-N 3.3Å; Q610-T612 VanDerWaalsContact O-N 3.12Å; T612-W614 PolarHBondContact O-N 3.44Å
613	S	83.3	Confident	87.4	Confident	79 Å²	79	50.6 Å²	50.6	55%	0.552	30%	0.299	S	S	*	.			trans	-66.2	-15.6	175.3	64.5	0	0	0	0	112.9	N611	N611-S613 VanDerWaalsContact CG-OG 3.29Å; N611-S613 PolarHBondContact ND2-OG 3.32Å; N611-S613 WeakPolarHBondContact OD1-CB 3.42Å; N611-S613 PolarHBondContact OD1-N 3.4Å; N611-S613 PolarHBondContact OD1-OG 2.8Å
614	W	83.1	Confident	86.9	Confident	62 Å²	62	52.9 Å²	52.9	24%	0.235	32%	0.315	C	S	.	.	S	Bend	trans	-75.9	134.7	-179.6	-52.9	-25.2	0	0	0	111.9	W435 I436 Y477 P478 K479 N611 T612 N616	W435-W614 AromaticContact CZ2-CZ3 3.95Å; W435-W614 HydrophobicContact CZ2-CZ3 3.95Å; I436-W614 HydrophobicContact CD1-CB 4.29Å; I436-W614 HydrophobicContact CD1-CE3 4.16Å; I436-W614 HydrophobicContact CG1-CE3 4.14Å; Y477-W614 HydrophobicContact CE2-CH2 4.09Å; P478-W614 HydrophobicContact CB-CE3 4.38Å; P478-W614 HydrophobicContact CB-CZ3 4.42Å; K479-W614 HydrophobicContact CB-CD2 3.98Å; K479-W614 HydrophobicContact CB-CE3 3.97Å; K479-W614 HydrophobicContact CB-CH2 3.73Å; K479-W614 HydrophobicContact CB-CZ2 3.73Å; K479-W614 HydrophobicContact CB-CZ3 3.85Å; K479-W614 HydrophobicContact CD-CH2 4.39Å; K479-W614 HydrophobicContact CD-CZ2 3.78Å; K479-W614 HydrophobicContact CG-CD2 4.34Å; K479-W614 HydrophobicContact CG-CH2 4.43Å; K479-W614 HydrophobicContact CG-CZ2 3.92Å; N611-W614 HydrophobicContact CB-CH2 4.45Å; N611-W614 HydrophobicContact CB-CZ2 4.05Å; T612-W614 PolarHBondContact O-N 3.44Å; W614-N616 PolarHBondContact O-N 3.18Å
615	K	85.2	Confident	86.7	Confident	156 Å²	156	54.2 Å²	54.2	68%	0.678	32%	0.321	S	S	*	.			trans	-67.8	131	-178.4	-176.5	179.6	179.3	-179.2	0	111	L617	K615-L617 HydrophobicContact CB-CD1 4.29Å; K615-L617 HydrophobicContact CG-CD1 4.37Å; K615-L617 WeakPolarHBondContact O-CD1 3.46Å; K615-L617 PolarHBondContact O-N 2.9Å
616	N	90	Very high	86.7	Confident	43 Å²	43	53 Å²	53	23%	0.23	31%	0.314	C	S	.	.			trans	-74.4	105.9	166.2	-176.5	-29.2	0	0	0	109.8	I436 W614 C618 S619	I436-N616 HydrophobicContact CG2-CB 4.06Å; I436-N616 PolarHBondContact O-ND2 3.34Å; W614-N616 PolarHBondContact O-N 3.18Å; N616-C618 VanDerWaalsContact C-N 3.29Å; N616-C618 PolarHBondContact O-N 2.91Å; N616-C618 WeakPolarHBondContact OD1-CA 3.4Å; N616-C618 WeakPolarHBondContact OD1-CB 3.21Å; N616-C618 PolarHBondContact OD1-N 2.92Å; N616-S619 PolarHBondContact ND2-OG 2.81Å; N616-S619 PolarHBondContact OD1-N 2.83Å; N616-S619 PolarHBondContact OD1-OG 2.79Å
617	L	87.3	Confident	86.7	Confident	31 Å²	31	53.6 Å²	53.6	16%	0.162	32%	0.318	C	S	.	.	S	Bend	trans	-70.4	-23.7	-179.7	-86.6	65.3	0	0	0	112.9	K615 K621 V629 L639 H641	K615-L617 HydrophobicContact CB-CD1 4.29Å; K615-L617 HydrophobicContact CG-CD1 4.37Å; K615-L617 WeakPolarHBondContact O-CD1 3.46Å; K615-L617 PolarHBondContact O-N 2.9Å; L617-K621 WeakPolarHBondContact O-CG 3.38Å; L617-V629 HydrophobicContact CB-CG1 4.3Å; L617-L639 HydrophobicContact CD2-CB 3.88Å; L617-L639 VanDerWaalsContact CD2-O 3.24Å; L617-L639 WeakPolarHBondContact CD2-O 3.45Å; L617-H641 HydrophobicContact CB-CB 4.28Å
618	C	89.4	Confident	87.1	Confident	19 Å²	19	49.6 Å²	49.6	13%	0.128	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-80.7	-27	-174.8	-70.9	0	0	0	0	113.8	I437 N616 S620 K621 C627	I437-C618 HydrophobicContact CG2-CB 4.3Å; N616-C618 VanDerWaalsContact C-N 3.29Å; N616-C618 PolarHBondContact O-N 2.91Å; N616-C618 WeakPolarHBondContact OD1-CA 3.4Å; N616-C618 WeakPolarHBondContact OD1-CB 3.21Å; N616-C618 PolarHBondContact OD1-N 2.92Å; C618-S620 PolarHBondContact O-N 3.33Å; C618-S620 VanDerWaalsContact O-N 3.07Å; C618-K621 PolarHBondContact O-N 2.77Å; C618-C627 VanDerWaalsContact CA-SG 3.52Å; C618-C627 HydrophobicContact CB-CB 3.61Å; C618-C627 WeakPolarHBondContact CB-SG 3.48Å; C618-C627 WeakPolarHBondContact SG-CB 3.43Å; C618-C627 CovalentContact SG-SG 2.03Å; C618-C627 PolarHBondContact SG-SG 3.02Å
619	S	82	Confident	87.2	Confident	99 Å²	99	47.9 Å²	47.9	69%	0.692	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-60.1	-23.5	-177.1	-57	0	0	0	0	114.8	N616	N616-S619 PolarHBondContact ND2-OG 2.81Å; N616-S619 PolarHBondContact OD1-N 2.83Å; N616-S619 PolarHBondContact OD1-OG 2.79Å
620	S	72.8	Confident	87.2	Confident	83 Å²	83	46.4 Å²	46.4	58%	0.58	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-105.7	-6.7	-173.1	64.1	0	0	0	0	115.3	C618	C618-S620 PolarHBondContact O-N 3.33Å; C618-S620 VanDerWaalsContact O-N 3.07Å
621	K	67.9	Low	87.2	Confident	92 Å²	92	47 Å²	47	40%	0.4	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-5.4	-158.8	-62.4	-67.2	-178.3	179.2	0	116.1	L617 C618 H641 K656	L617-K621 WeakPolarHBondContact O-CG 3.38Å; C618-K621 PolarHBondContact O-N 2.77Å; K621-H641 WeakPolarHBondContact CG-NE2 3.25Å; K621-K656 PolarHBondContact O-NZ 2.74Å
622	G	84.3	Confident	87.4	Confident	60 Å²	60	50.7 Å²	50.7	62%	0.619	29%	0.294	S	S	*	.			trans	67.7	37.5	166	0	0	0	0	0	114.5
623	C	92.1	Very high	87.5	Confident	30 Å²	30	51.6 Å²	51.6	20%	0.203	30%	0.296	C	S	.	.			trans	-62.2	137.6	169.1	-61.6	0	0	0	0	109.8	H625 L626 C627 C643	C623-H625 PolarHBondContact O-N 2.83Å; C623-L626 WeakPolarHBondContact CB-O 3.32Å; C623-C627 HydrophobicContact CB-CB 4.02Å; C623-C627 VanDerWaalsContact SG-CB 3.55Å; C623-C627 VanDerWaalsContact SG-SG 3.68Å; C623-C643 WeakPolarHBondContact CA-SG 3.21Å; C623-C643 HydrophobicContact CB-CB 3.67Å; C623-C643 WeakPolarHBondContact CB-SG 3.46Å; C623-C643 WeakPolarHBondContact SG-CA 3.31Å; C623-C643 WeakPolarHBondContact SG-CB 3.46Å; C623-C643 CovalentContact SG-SG 2.03Å; C623-C643 PolarHBondContact SG-SG 2.84Å
624	S	89.1	Confident	87.3	Confident	50 Å²	50	56.6 Å²	56.6	35%	0.35	32%	0.316	S	S	.	.	S	Bend	trans	-68.7	-31.3	-177.5	57.6	0	0	0	0	114.1	K656 T657 C658	S624-K656 WeakPolarHBondContact CB-O 3.34Å; S624-K656 PolarHBondContact N-O 3.4Å; S624-K656 PolarHBondContact OG-O 2.85Å; S624-T657 WeakPolarHBondContact OG-CA 3.18Å; S624-C658 PolarHBondContact OG-N 2.77Å; S624-C658 VanDerWaalsContact OG-N 3.09Å
625	H	91.5	Very high	87	Confident	29 Å²	29	58.6 Å²	58.6	13%	0.134	34%	0.339	C	S	.	.	S	Bend	trans	-134.4	-78.7	-174.9	-62.5	75.2	0	0	0	111.6	Y459 C623 P646 E729	Y459-H625 AromaticContact CD1-CD2 3.75Å; Y459-H625 HydrophobicContact CD2-CB 4.44Å; Y459-H625 AromaticContact CE1-CD2 3.51Å; Y459-H625 HydrophobicContact CG-CB 4.43Å; Y459-H625 AromaticContact CZ-CD2 3.75Å; C623-H625 PolarHBondContact O-N 2.83Å; H625-P646 HydrophobicContact CB-CG 3.99Å; H625-E729 VanDerWaalsContact NE2-CG 3.3Å; H625-E729 WeakPolarHBondContact NE2-CG 3.41Å; H625-E729 IonicContact NE2-OE1 3.8Å
626	L	94.7	Very high	86.7	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	146.9	-176.2	-63	172.3	0	0	0	110.7	F452 T461 C623 C643 L644	F452-L626 HydrophobicContact CE2-CB 4.03Å; F452-L626 HydrophobicContact CE2-CD1 3.95Å; F452-L626 HydrophobicContact CE2-CD2 4.05Å; F452-L626 HydrophobicContact CE2-CG 4.23Å; F452-L626 HydrophobicContact CZ-CB 4.21Å; F452-L626 HydrophobicContact CZ-CD1 4.19Å; T461-L626 HydrophobicContact CG2-CD1 3.81Å; C623-L626 WeakPolarHBondContact CB-O 3.32Å; L626-C643 CarbonylContact O-C 3.55Å; L626-C643 WeakPolarHBondContact O-CA 3.45Å; L626-L644 HydrophobicContact CB-CB 4.05Å; L626-L644 WeakPolarHBondContact CB-O 3.38Å; L626-L644 PolarHBondContact N-O 3.43Å; L626-L644 PolarHBondContact O-N 3.08Å
627	C	95.5	Very high	86.2	Confident	12 Å²	12	55.7 Å²	55.7	8%	0.081	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	130.8	172.5	-178	0	0	0	0	108.3	N439 C618 C623 S642	N439-C627 PolarHBondContact ND2-O 2.87Å; C618-C627 VanDerWaalsContact CA-SG 3.52Å; C618-C627 HydrophobicContact CB-CB 3.61Å; C618-C627 WeakPolarHBondContact CB-SG 3.48Å; C618-C627 WeakPolarHBondContact SG-CB 3.43Å; C618-C627 CovalentContact SG-SG 2.03Å; C618-C627 PolarHBondContact SG-SG 3.02Å; C623-C627 HydrophobicContact CB-CB 4.02Å; C623-C627 VanDerWaalsContact SG-CB 3.55Å; C623-C627 VanDerWaalsContact SG-SG 3.68Å; C627-S642 WeakPolarHBondContact CA-O 3.47Å
628	A	95.8	Very high	86.1	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.8	173.7	0	0	0	0	0	109.7	F452 D500 H641 S642 L644	F452-A628 HydrophobicContact CE1-CB 4.44Å; F452-A628 HydrophobicContact CZ-CB 4.12Å; D500-A628 HydrophobicContact CB-CB 3.96Å; A628-H641 WeakPolarHBondContact O-CA 3.12Å; A628-S642 PolarHBondContact N-O 3.45Å; A628-S642 PolarHBondContact O-N 2.9Å; A628-L644 HydrophobicContact CB-CD1 3.69Å
629	V	93.6	Very high	86.1	Confident	7 Å²	7	61.6 Å²	61.6	4%	0.042	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	151	168.3	-75.5	0	0	0	0	109.9	I437 M499 D500 L617 R640	I437-V629 HydrophobicContact CD1-CB 4.11Å; I437-V629 HydrophobicContact CD1-CG1 3.63Å; I437-V629 HydrophobicContact CD1-CG2 3.8Å; M499-V629 CarbonylContact C-O 3.5Å; M499-V629 HydrophobicContact CB-CG2 4.29Å; M499-V629 WeakPolarHBondContact CB-O 3.03Å; M499-V629 HydrophobicContact CE-CG2 4.06Å; M499-V629 HydrophobicContact SD-CG2 3.84Å; D500-V629 PolarHBondContact N-O 2.96Å; D500-V629 VanDerWaalsContact N-O 3.16Å; L617-V629 HydrophobicContact CB-CG1 4.3Å; V629-R640 CarbonylContact C-O 3.6Å; V629-R640 WeakPolarHBondContact CA-O 3.47Å
630	G	92.7	Very high	86.5	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	168.3	170.8	0	0	0	0	0	109.6	R640	G630-R640 PolarHBondContact N-O 2.72Å; G630-R640 PolarHBondContact O-N 3.38Å; G630-R640 VanDerWaalsContact O-N 3.14Å
631	P	93.3	Very high	87.3	Confident	18 Å²	18	61.8 Å²	61.8	12%	0.117	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	165.3	-179.3	28.4	-36.2	0	0	0	112.3	L480 Y482 A498 R640	L480-P631 WeakPolarHBondContact O-CA 3.36Å; Y482-P631 HydrophobicContact CD1-CB 4.46Å; Y482-P631 HydrophobicContact CE1-CB 3.69Å; Y482-P631 HydrophobicContact CE1-CG 3.69Å; Y482-P631 HydrophobicContact CE2-CB 3.86Å; Y482-P631 VanDerWaalsContact OH-CB 3.25Å; Y482-P631 WeakPolarHBondContact OH-CB 3.47Å; A498-P631 HydrophobicContact CB-CG 4.12Å; P631-R640 WeakPolarHBondContact O-CB 3.36Å; P631-R640 PolarHBondContact O-N 2.04Å
632	K	90.2	Very high	88.6	Confident	121 Å²	121	58.1 Å²	58.1	53%	0.526	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	139.4	174.3	-57.4	-174.6	179.5	-164.3	0	109.8	A637 L639	K632-A637 VanDerWaalsContact CD-O 3.32Å; K632-A637 WeakPolarHBondContact CD-O 3.42Å; K632-A637 WeakPolarHBondContact CE-O 3.09Å; K632-A637 PolarHBondContact NZ-O 2.03Å; K632-L639 HydrophobicContact CG-CD2 3.91Å; K632-L639 HydrophobicContact CG-CG 4.48Å
633	D	83	Confident	89.1	Confident	91 Å²	91	55.8 Å²	55.8	49%	0.487	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-81.8	154.5	170.3	-172.8	25.9	0	0	0	110	S635 S636	D633-S635 PolarHBondContact O-N 3.21Å; D633-S635 PolarHBondContact OD2-OG 3.11Å; D633-S636 PolarHBondContact O-N 3.24Å
634	L	79	Confident	89.2	Confident	185 Å²	185	55.7 Å²	55.7	97%	0.969	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-26	178	-70.2	165.9	0	0	0	112.4
635	S	77.9	Confident	89.3	Confident	103 Å²	103	53.9 Å²	53.9	72%	0.72	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-12.5	-178.3	70.1	0	0	0	0	114.8	D633	D633-S635 PolarHBondContact O-N 3.21Å; D633-S635 PolarHBondContact OD2-OG 3.11Å
636	S	78.2	Confident	89.3	Confident	53 Å²	53	52.9 Å²	52.9	37%	0.371	29%	0.289	S	S	.	.			trans	-133.4	133.5	-169.8	177.3	0	0	0	0	112.2	D633 E638	D633-S636 PolarHBondContact O-N 3.24Å; S636-E638 PolarHBondContact O-N 3.36Å; S636-E638 PolarHBondContact OG-N 2.82Å; S636-E638 PolarHBondContact OG-O 2.86Å
637	A	79	Confident	88.7	Confident	85 Å²	85	54 Å²	54	70%	0.702	30%	0.295	S	S	*	.	S	Bend	trans	-72.3	-13.4	173.7	0	0	0	0	0	113.5	K632	K632-A637 VanDerWaalsContact CD-O 3.32Å; K632-A637 WeakPolarHBondContact CD-O 3.42Å; K632-A637 WeakPolarHBondContact CE-O 3.09Å; K632-A637 PolarHBondContact NZ-O 2.03Å
638	E	85.7	Confident	87.9	Confident	140 Å²	140	54.7 Å²	54.7	65%	0.654	30%	0.304	S	S	*	.	S	Bend	trans	-98.7	151.2	-178	-62.3	-171.4	172.7	0	0	112.4	S636	S636-E638 PolarHBondContact O-N 3.36Å; S636-E638 PolarHBondContact OG-N 2.82Å; S636-E638 PolarHBondContact OG-O 2.86Å
639	L	89.6	Confident	87.4	Confident	34 Å²	34	56 Å²	56	18%	0.178	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	149.1	171.8	-68.8	171.8	0	0	0	111.2	K479 L617 K632	K479-L639 WeakPolarHBondContact O-CD1 3.46Å; L617-L639 HydrophobicContact CD2-CB 3.88Å; L617-L639 VanDerWaalsContact CD2-O 3.24Å; L617-L639 WeakPolarHBondContact CD2-O 3.45Å; K632-L639 HydrophobicContact CG-CD2 3.91Å; K632-L639 HydrophobicContact CG-CG 4.48Å
640	R	90.2	Very high	86.9	Confident	129 Å²	129	59.3 Å²	59.3	49%	0.487	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	153.2	172.4	180	173.8	166.5	-169.8	-9.8	110.1	V629 G630 P631 S642	V629-R640 CarbonylContact C-O 3.6Å; V629-R640 WeakPolarHBondContact CA-O 3.47Å; G630-R640 PolarHBondContact N-O 2.72Å; G630-R640 PolarHBondContact O-N 3.38Å; G630-R640 VanDerWaalsContact O-N 3.14Å; P631-R640 WeakPolarHBondContact O-CB 3.36Å; P631-R640 PolarHBondContact O-N 2.04Å; R640-S642 PolarHBondContact NE-OG 3.04Å; R640-S642 VanDerWaalsContact NE-OG 3.15Å; R640-S642 PolarHBondContact NH2-OG 3.03Å; R640-S642 VanDerWaalsContact NH2-OG 3.11Å
641	H	91.1	Very high	86.8	Confident	58 Å²	58	62.7 Å²	62.7	27%	0.269	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	148.3	159.7	64.2	-77.1	0	0	0	108.9	L617 K621 A628	L617-H641 HydrophobicContact CB-CB 4.28Å; K621-H641 WeakPolarHBondContact CG-NE2 3.25Å; A628-H641 WeakPolarHBondContact O-CA 3.12Å
642	S	93.6	Very high	86.6	Confident	15 Å²	15	64.8 Å²	64.8	11%	0.105	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.1	177.4	-67.3	0	0	0	0	108.6	D500 C627 A628 R640 L644	D500-S642 VanDerWaalsContact OD2-CB 3.28Å; D500-S642 WeakPolarHBondContact OD2-CB 3.38Å; D500-S642 PolarHBondContact OD2-OG 3.33Å; C627-S642 WeakPolarHBondContact CA-O 3.47Å; A628-S642 PolarHBondContact N-O 3.45Å; A628-S642 PolarHBondContact O-N 2.9Å; R640-S642 PolarHBondContact NE-OG 3.04Å; R640-S642 VanDerWaalsContact NE-OG 3.15Å; R640-S642 PolarHBondContact NH2-OG 3.03Å; R640-S642 VanDerWaalsContact NH2-OG 3.11Å; S642-L644 VanDerWaalsContact O-CD1 3.29Å; S642-L644 WeakPolarHBondContact O-CD1 3.45Å
643	C	95	Very high	86.5	Confident	11 Å²	11	67.2 Å²	67.2	7%	0.074	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	133	168.1	-56.6	0	0	0	0	108.8	C623 L626 L651 K655	C623-C643 WeakPolarHBondContact CA-SG 3.21Å; C623-C643 HydrophobicContact CB-CB 3.67Å; C623-C643 WeakPolarHBondContact CB-SG 3.46Å; C623-C643 WeakPolarHBondContact SG-CA 3.31Å; C623-C643 WeakPolarHBondContact SG-CB 3.46Å; C623-C643 CovalentContact SG-SG 2.03Å; C623-C643 PolarHBondContact SG-SG 2.84Å; L626-C643 CarbonylContact O-C 3.55Å; L626-C643 WeakPolarHBondContact O-CA 3.45Å; C643-L651 HydrophobicContact CB-CD1 4.28Å; C643-L651 WeakPolarHBondContact O-CD2 3.47Å; C643-K655 WeakPolarHBondContact CB-O 3.3Å
644	L	94.3	Very high	86.8	Confident	27 Å²	27	66.7 Å²	66.7	14%	0.141	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	159.1	179	-65.3	99.8	0	0	0	110.5	F452 T461 D500 L626 A628 S642	F452-L644 HydrophobicContact CE1-CD1 4.44Å; F452-L644 HydrophobicContact CE1-CD2 4.13Å; F452-L644 HydrophobicContact CZ-CB 4.31Å; F452-L644 HydrophobicContact CZ-CD1 3.99Å; F452-L644 HydrophobicContact CZ-CD2 4.29Å; F452-L644 HydrophobicContact CZ-CG 4.43Å; T461-L644 HydrophobicContact CG2-CD2 4.35Å; D500-L644 HydrophobicContact CB-CD1 4.26Å; L626-L644 HydrophobicContact CB-CB 4.05Å; L626-L644 WeakPolarHBondContact CB-O 3.38Å; L626-L644 PolarHBondContact N-O 3.43Å; L626-L644 PolarHBondContact O-N 3.08Å; A628-L644 HydrophobicContact CB-CD1 3.69Å; S642-L644 VanDerWaalsContact O-CD1 3.29Å; S642-L644 WeakPolarHBondContact O-CD1 3.45Å
645	C	91.8	Very high	87.3	Confident	12 Å²	12	65.1 Å²	65.1	8%	0.081	35%	0.35	C	S	.	.			trans	-111.1	146.8	-179.1	-64	0	0	0	0	111.3	T461 L651 C658	T461-C645 WeakPolarHBondContact CB-O 3.29Å; T461-C645 PolarHBondContact OG1-O 2.77Å; C645-L651 WeakPolarHBondContact SG-CA 3.37Å; C645-L651 PolarHBondContact SG-N 2.65Å; C645-L651 VanDerWaalsContact SG-N 3.44Å; C645-C658 WeakPolarHBondContact CA-SG 3.42Å; C645-C658 HydrophobicContact CB-CB 3.8Å; C645-C658 WeakPolarHBondContact CB-SG 3.5Å; C645-C658 VanDerWaalsContact SG-CA 3.55Å; C645-C658 WeakPolarHBondContact SG-CB 3.39Å; C645-C658 CovalentContact SG-SG 2.03Å; C645-C658 PolarHBondContact SG-SG 3.02Å
646	P	90.5	Very high	87.9	Confident	9 Å²	9	64.8 Å²	64.8	6%	0.058	34%	0.336	C	S	.	.			trans	-63.2	161.4	174.6	-15.4	28.4	0	0	0	111.7	Y459 C460 H625 G648 Y649	Y459-P646 HydrophobicContact CD1-CG 3.75Å; Y459-P646 HydrophobicContact CG-CG 4.16Å; C460-P646 CarbonylContact O-C 3.4Å; C460-P646 WeakPolarHBondContact O-CA 3.45Å; H625-P646 HydrophobicContact CB-CG 3.99Å; P646-G648 PolarHBondContact O-N 2.8Å; P646-Y649 HydrophobicContact CB-CD2 3.83Å; P646-Y649 HydrophobicContact CB-CE2 4.1Å; P646-Y649 HydrophobicContact CG-CD2 4.15Å; P646-Y649 HydrophobicContact CG-CE2 4.38Å; P646-Y649 WeakPolarHBondContact O-CB 3.35Å; P646-Y649 WeakPolarHBondContact O-CD2 3.36Å; P646-Y649 PolarHBondContact O-N 3.34Å
647	N	83.2	Confident	88.5	Confident	23 Å²	23	64.4 Å²	64.4	12%	0.123	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	127.3	174.7	-72	-11.3	0	0	0	111.2	C460 T461 V462	C460-N647 PolarHBondContact O-N 2.03Å; T461-N647 WeakPolarHBondContact CA-OD1 3.41Å; V462-N647 PolarHBondContact N-OD1 2.71Å
648	G	78.2	Confident	88.9	Confident	27 Å²	27	60.5 Å²	60.5	28%	0.278	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	-1.7	-176.4	0	0	0	0	0	114.9	P646 R661	P646-G648 PolarHBondContact O-N 2.8Å; G648-R661 WeakPolarHBondContact O-CB 3.39Å; G648-R661 PolarHBondContact O-N 2.86Å
649	Y	84.7	Confident	88.9	Confident	27 Å²	27	57 Å²	57	11%	0.106	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	154.1	177.1	-59.9	-110.6	0	0	0	111.1	P646 C658 Q659 A660 G725 L726 E729 V730	P646-Y649 HydrophobicContact CB-CD2 3.83Å; P646-Y649 HydrophobicContact CB-CE2 4.1Å; P646-Y649 HydrophobicContact CG-CD2 4.15Å; P646-Y649 HydrophobicContact CG-CE2 4.38Å; P646-Y649 WeakPolarHBondContact O-CB 3.35Å; P646-Y649 WeakPolarHBondContact O-CD2 3.36Å; P646-Y649 PolarHBondContact O-N 3.34Å; Y649-C658 HydrophobicContact CD1-CB 4.45Å; Y649-Q659 CarbonylContact C-O 3.31Å; Y649-Q659 WeakPolarHBondContact CA-O 3.03Å; Y649-Q659 WeakPolarHBondContact CB-O 3.45Å; Y649-A660 HydrophobicContact CD1-CB 4.13Å; Y649-A660 HydrophobicContact CE1-CB 4.13Å; Y649-G725 WeakPolarHBondContact OH-CA 3.28Å; Y649-L726 PolarHBondContact OH-N 2.96Å; Y649-E729 PolarHBondContact OH-OE1 2.83Å; Y649-V730 HydrophobicContact CD1-CG2 4.03Å; Y649-V730 HydrophobicContact CE1-CG2 3.58Å
650	E	84.7	Confident	88.1	Confident	77 Å²	77	57.6 Å²	57.6	36%	0.36	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	142.2	176.8	-68.6	-177.7	170.3	0	0	110.9	C658 Q659 R661	E650-C658 CarbonylContact O-C 3.38Å; E650-C658 VanDerWaalsContact O-CA 3.31Å; E650-C658 WeakPolarHBondContact O-CA 3.35Å; E650-Q659 HydrophobicContact CB-CG 4.21Å; E650-Q659 PolarHBondContact N-O 3.31Å; E650-Q659 PolarHBondContact O-N 2.82Å; E650-R661 WeakPolarHBondContact OE1-CD 3.12Å; E650-R661 IonicContact OE1-CZ 2.59Å; E650-R661 IonicContact OE1-NE 3.19Å; E650-R661 IonicContact OE1-NH1 4Å; E650-R661 PolarHBondContact OE1-NH1 3.27Å
651	L	89.9	Confident	87.1	Confident	72 Å²	72	56.2 Å²	56.2	38%	0.377	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	128.4	176	-169.5	68.7	0	0	0	109.5	C643 C645 K655	C643-L651 HydrophobicContact CB-CD1 4.28Å; C643-L651 WeakPolarHBondContact O-CD2 3.47Å; C645-L651 WeakPolarHBondContact SG-CA 3.37Å; C645-L651 PolarHBondContact SG-N 2.65Å; C645-L651 VanDerWaalsContact SG-N 3.44Å; L651-K655 HydrophobicContact CD2-CB 4.34Å
652	K	89.2	Confident	85.4	Confident	62 Å²	62	61.3 Å²	61.3	27%	0.27	32%	0.316	S	S	.	.			trans	-72.1	168.3	175.7	-64	-165.4	-164.6	163.4	0	111.5	D654 K655 T657 Q659	K652-D654 PolarHBondContact O-N 2.93Å; K652-K655 PolarHBondContact O-N 2.7Å; K652-T657 WeakPolarHBondContact CB-O 3.39Å; K652-T657 VanDerWaalsContact CD-OG1 3.31Å; K652-T657 WeakPolarHBondContact CD-OG1 3.31Å; K652-T657 WeakPolarHBondContact CG-O 3.45Å; K652-T657 PolarHBondContact N-O 3Å; K652-Q659 HydrophobicContact CG-CB 4.33Å; K652-Q659 HydrophobicContact CG-CG 4.27Å
653	D	87.8	Confident	83.5	Confident	171 Å²	171	68.5 Å²	68.5	91%	0.914	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-22.4	177.9	-62.5	-33.9	0	0	0	113.9	K655	D653-K655 PolarHBondContact O-N 3.42Å
654	D	89.1	Confident	81.4	Confident	80 Å²	80	74.3 Å²	74.3	43%	0.428	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-8.2	174.8	71.3	1.3	0	0	0	113.8	K652 K656 T657	K652-D654 PolarHBondContact O-N 2.93Å; D654-K656 PolarHBondContact O-N 3Å; D654-K656 PolarHBondContact OD1-N 2.65Å; D654-T657 VanDerWaalsContact CG-OG1 3.24Å; D654-T657 PolarHBondContact OD1-N 3Å; D654-T657 PolarHBondContact OD1-OG1 3.38Å; D654-T657 WeakPolarHBondContact OD2-CB 3Å; D654-T657 VanDerWaalsContact OD2-CG2 3.24Å; D654-T657 WeakPolarHBondContact OD2-CG2 3.01Å; D654-T657 PolarHBondContact OD2-OG1 2.87Å
655	K	90.3	Very high	79.1	Confident	152 Å²	152	85.1 Å²	85.1	66%	0.661	41%	0.41	S	S	*	.	S	Bend	trans	56.6	24.8	-177.3	-58.8	-177.6	177.5	-179.5	0	114.1	C643 L651 K652 D653	C643-K655 WeakPolarHBondContact CB-O 3.3Å; L651-K655 HydrophobicContact CD2-CB 4.34Å; K652-K655 PolarHBondContact O-N 2.7Å; D653-K655 PolarHBondContact O-N 3.42Å
656	K	90.4	Very high	77.5	Confident	96 Å²	96	86.9 Å²	86.9	42%	0.417	42%	0.423	S	S	.	.	S	Bend	trans	-136.1	-38.9	-177.3	-69.4	-176.9	179.1	-170.3	0	113.7	K621 S624 D654	K621-K656 PolarHBondContact O-NZ 2.74Å; S624-K656 WeakPolarHBondContact CB-O 3.34Å; S624-K656 PolarHBondContact N-O 3.4Å; S624-K656 PolarHBondContact OG-O 2.85Å; D654-K656 PolarHBondContact O-N 3Å; D654-K656 PolarHBondContact OD1-N 2.65Å
657	T	89.6	Confident	76	Confident	45 Å²	45	91.7 Å²	91.7	28%	0.276	45%	0.446	S	S	.	.			trans	-99.2	140.6	-176.1	61.9	0	0	0	0	111.7	S624 K652 D654	S624-T657 WeakPolarHBondContact OG-CA 3.18Å; K652-T657 WeakPolarHBondContact CB-O 3.39Å; K652-T657 VanDerWaalsContact CD-OG1 3.31Å; K652-T657 WeakPolarHBondContact CD-OG1 3.31Å; K652-T657 WeakPolarHBondContact CG-O 3.45Å; K652-T657 PolarHBondContact N-O 3Å; D654-T657 VanDerWaalsContact CG-OG1 3.24Å; D654-T657 PolarHBondContact OD1-N 3Å; D654-T657 PolarHBondContact OD1-OG1 3.38Å; D654-T657 WeakPolarHBondContact OD2-CB 3Å; D654-T657 VanDerWaalsContact OD2-CG2 3.24Å; D654-T657 WeakPolarHBondContact OD2-CG2 3.01Å; D654-T657 PolarHBondContact OD2-OG1 2.87Å
658	C	88.8	Confident	75.3	Confident	3 Å²	3	92.5 Å²	92.5	2%	0.02	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	148.6	176.7	-59.2	0	0	0	0	111	S624 C645 Y649 E650 V730	S624-C658 PolarHBondContact OG-N 2.77Å; S624-C658 VanDerWaalsContact OG-N 3.09Å; C645-C658 WeakPolarHBondContact CA-SG 3.42Å; C645-C658 HydrophobicContact CB-CB 3.8Å; C645-C658 WeakPolarHBondContact CB-SG 3.5Å; C645-C658 VanDerWaalsContact SG-CA 3.55Å; C645-C658 WeakPolarHBondContact SG-CB 3.39Å; C645-C658 CovalentContact SG-SG 2.03Å; C645-C658 PolarHBondContact SG-SG 3.02Å; Y649-C658 HydrophobicContact CD1-CB 4.45Å; E650-C658 CarbonylContact O-C 3.38Å; E650-C658 VanDerWaalsContact O-CA 3.31Å; E650-C658 WeakPolarHBondContact O-CA 3.35Å; C658-V730 WeakPolarHBondContact O-CG1 3.43Å
659	Q	84	Confident	75.3	Confident	67 Å²	67	92 Å²	92	31%	0.313	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.1	172.8	65.7	-176.1	13.1	0	0	110.8	Y649 E650 K652	Y649-Q659 CarbonylContact C-O 3.31Å; Y649-Q659 WeakPolarHBondContact CA-O 3.03Å; Y649-Q659 WeakPolarHBondContact CB-O 3.45Å; E650-Q659 HydrophobicContact CB-CG 4.21Å; E650-Q659 PolarHBondContact N-O 3.31Å; E650-Q659 PolarHBondContact O-N 2.82Å; K652-Q659 HydrophobicContact CG-CB 4.33Å; K652-Q659 HydrophobicContact CG-CG 4.27Å
660	A	74.1	Confident	75.2	Confident	47 Å²	47	94.9 Å²	94.9	39%	0.388	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	139.6	179.4	0	0	0	0	0	111.7	Y649	Y649-A660 HydrophobicContact CD1-CB 4.13Å; Y649-A660 HydrophobicContact CE1-CB 4.13Å
661	R	68	Low	75.4	Confident	100 Å²	100	91.9 Å²	91.9	38%	0.377	44%	0.439	S	S	.	.			trans	-101.7	120.6	172.8	-169.7	-177.6	-177.9	149.5	-1.3	110	G648 E650 E663	G648-R661 WeakPolarHBondContact O-CB 3.39Å; G648-R661 PolarHBondContact O-N 2.86Å; E650-R661 WeakPolarHBondContact OE1-CD 3.12Å; E650-R661 IonicContact OE1-CZ 2.59Å; E650-R661 IonicContact OE1-NE 3.19Å; E650-R661 IonicContact OE1-NH1 4Å; E650-R661 PolarHBondContact OE1-NH1 3.27Å; R661-E663 VanDerWaalsContact C-N 3.3Å; R661-E663 PolarHBondContact O-N 3.35Å
662	L	56.5	Low	75.5	Confident	164 Å²	164	89.4 Å²	89.4	86%	0.859	43%	0.428	S	S	*	.	S	Bend	trans	-70.8	-19.7	-179.5	-74	164.2	0	0	0	114.3
663	E	52.7	Low	75.6	Confident	167 Å²	167	89.3 Å²	89.3	78%	0.78	43%	0.43	S	S	*	.	S	Bend	trans	-106.8	-8.8	-163.4	-68.2	-173.8	164.6	0	0	116.4	R661	R661-E663 VanDerWaalsContact C-N 3.3Å; R661-E663 PolarHBondContact O-N 3.35Å
664	K	50.7	Low	75.7	Confident	132 Å²	132	87.9 Å²	87.9	57%	0.574	42%	0.418	S	S	*	.			trans	-105.7	102.2	175.5	-82.6	-171.9	175.6	-175.1	0	110.7	S666	K664-S666 PolarHBondContact O-N 3.24Å
665	R	47.1	Very low	75.8	Confident	254 Å²	254	84.2 Å²	84.2	96%	0.958	40%	0.398	S	S	*	.			trans	-73.1	59.6	165.3	-66.1	-178.9	176.5	-179.8	-1	110.6
666	S	57.2	Low	75.9	Confident	50 Å²	50	77.6 Å²	77.6	35%	0.35	37%	0.37	S	S	.	.			trans	-71.7	130.4	155.2	51.4	0	0	0	0	106.4	K664 P668	K664-S666 PolarHBondContact O-N 3.24Å; S666-P668 WeakPolarHBondContact O-CD 3.03Å; S666-P668 VanDerWaalsContact O-N 3.13Å
667	M	60.5	Low	76.1	Confident	110 Å²	110	77.2 Å²	77.2	54%	0.542	37%	0.368	S	S	.	.			trans	-67.3	113.1	174.3	-166	179.5	-75.6	0	0	106.4	F425	F425-M667 HydrophobicContact CD2-SD 3.98Å; F425-M667 HydrophobicContact CE2-SD 4.17Å
668	P	67.2	Low	76.2	Confident	40 Å²	40	79.9 Å²	79.9	26%	0.26	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-65.6	145.4	-178.9	28.1	-33.5	0	0	0	108.8	S666 R670 L726	S666-P668 WeakPolarHBondContact O-CD 3.03Å; S666-P668 VanDerWaalsContact O-N 3.13Å; P668-R670 PolarHBondContact O-N 3.29Å; P668-L726 HydrophobicContact CB-CD1 4Å; P668-L726 HydrophobicContact CG-CD1 4.05Å
669	I	79.1	Confident	76.4	Confident	15 Å²	15	81.6 Å²	81.6	8%	0.077	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-59.8	129.5	169	-60.3	179.1	0	0	0	107	F422 I426 Y442 C460 V462	F422-I669 HydrophobicContact CB-CG2 4.23Å; F422-I669 HydrophobicContact CD2-CG2 3.95Å; I426-I669 HydrophobicContact CD1-CB 4.43Å; I426-I669 HydrophobicContact CD1-CD1 3.74Å; I426-I669 HydrophobicContact CD1-CG1 3.86Å; I426-I669 HydrophobicContact CD1-CG2 3.84Å; Y442-I669 HydrophobicContact CE1-CD1 4.3Å; Y442-I669 HydrophobicContact CE2-CD1 4.47Å; Y442-I669 WeakPolarHBondContact OH-CD1 3.49Å; C460-I669 HydrophobicContact CB-CB 3.89Å; C460-I669 HydrophobicContact CB-CD1 3.91Å; C460-I669 HydrophobicContact CB-CG1 4.35Å; C460-I669 HydrophobicContact CB-CG2 4.24Å; V462-I669 HydrophobicContact CG2-CD1 4.37Å
670	R	82.5	Confident	76.8	Confident	88 Å²	88	79 Å²	79	33%	0.332	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.3	-170.2	-70.1	-179.5	175.8	-171.6	6.4	110	F422 G423 D424 P668	F422-R670 WeakPolarHBondContact CA-O 3.36Å; G423-R670 PolarHBondContact N-O 2.8Å; G423-R670 VanDerWaalsContact N-O 3.08Å; G423-R670 PolarHBondContact O-N 2.94Å; D424-R670 HydrophobicContact CB-CB 4.39Å; D424-R670 WeakPolarHBondContact OD2-CD 3.27Å; P668-R670 PolarHBondContact O-N 3.29Å
671	W	88.7	Confident	77.7	Confident	14 Å²	14	83.1 Å²	83.1	5%	0.053	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	134.5	164.9	-165.8	32.1	0	0	0	108.7	D456 L673 F676 N679 A685 Y727	D456-W671 PolarHBondContact O-NE1 2.95Å; W671-L673 PolarHBondContact O-N 3.19Å; W671-F676 HydrophobicContact CD2-CB 4.15Å; W671-F676 HydrophobicContact CD2-CG 4.41Å; W671-F676 HydrophobicContact CE3-CB 3.73Å; W671-F676 HydrophobicContact CE3-CD1 4.1Å; W671-F676 AromaticContact CE3-CD2 3.67Å; W671-F676 HydrophobicContact CE3-CD2 3.67Å; W671-F676 HydrophobicContact CE3-CE2 4.31Å; W671-F676 AromaticContact CE3-CG 3.56Å; W671-F676 HydrophobicContact CE3-CG 3.56Å; W671-F676 HydrophobicContact CZ3-CB 4.28Å; W671-F676 AromaticContact CZ3-CD2 3.66Å; W671-F676 HydrophobicContact CZ3-CD2 3.66Å; W671-F676 HydrophobicContact CZ3-CE2 4.24Å; W671-F676 HydrophobicContact CZ3-CG 4.04Å; W671-N679 HydrophobicContact CH2-CB 3.44Å; W671-N679 VanDerWaalsContact CH2-CB 3.44Å; W671-N679 VanDerWaalsContact CH2-CG 3.45Å; W671-N679 WeakPolarHBondContact CH2-ND2 3.09Å; W671-N679 HydrophobicContact CZ2-CB 4.17Å; W671-N679 WeakPolarHBondContact CZ2-ND2 3.38Å; W671-N679 HydrophobicContact CZ3-CB 4.13Å; W671-A685 HydrophobicContact CH2-CB 4.49Å; W671-A685 HydrophobicContact CZ3-CB 4.03Å; W671-Y727 WeakPolarHBondContact CB-OH 3.43Å; W671-Y727 AromaticContact CE3-CE1 3.9Å; W671-Y727 HydrophobicContact CE3-CE1 3.9Å; W671-Y727 HydrophobicContact CZ3-CE1 4.45Å
672	C	92.2	Very high	78.9	Confident	20 Å²	20	84 Å²	84	14%	0.135	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-56.8	133.3	-176.6	173.1	0	0	0	0	110.8	C420 L421 Q674 S675 F676	C420-C672 HydrophobicContact CB-CB 3.67Å; C420-C672 WeakPolarHBondContact CB-SG 3.45Å; C420-C672 WeakPolarHBondContact SG-CB 3.15Å; C420-C672 CovalentContact SG-SG 2.01Å; C420-C672 PolarHBondContact SG-SG 3.41Å; L421-C672 VanDerWaalsContact O-CB 3.29Å; L421-C672 WeakPolarHBondContact O-CB 3.3Å; L421-C672 PolarHBondContact O-N 3.19Å; C672-Q674 VanDerWaalsContact C-N 3.28Å; C672-Q674 PolarHBondContact O-N 3.37Å; C672-S675 PolarHBondContact O-N 3.36Å; C672-S675 VanDerWaalsContact O-N 3.15Å; C672-F676 PolarHBondContact O-N 3.47Å
673	L	90.8	Very high	80.5	Confident	60 Å²	60	79.1 Å²	79.1	31%	0.314	38%	0.383	S	S	.	.	H	α-helix	trans	-58.4	-37.1	-174.1	-171.4	66	0	0	0	113.1	W671 K677 L702 I705	W671-L673 PolarHBondContact O-N 3.19Å; L673-K677 WeakPolarHBondContact O-CB 3.31Å; L673-K677 PolarHBondContact O-N 3.48Å; L673-L702 HydrophobicContact CD1-CD2 4.17Å; L673-L702 HydrophobicContact CD1-CG 4.32Å; L673-L702 HydrophobicContact CD2-CD2 4.2Å; L673-L702 HydrophobicContact CD2-CG 4.11Å; L673-L702 WeakPolarHBondContact CD2-O 3.45Å; L673-L702 HydrophobicContact CG-CD2 4.08Å; L673-L702 HydrophobicContact CG-CG 4.41Å; L673-I705 HydrophobicContact CD1-CB 4.39Å; L673-I705 HydrophobicContact CD1-CD1 3.96Å; L673-I705 HydrophobicContact CD1-CG1 3.8Å
674	Q	90.5	Very high	82.2	Confident	142 Å²	142	73.8 Å²	73.8	66%	0.664	36%	0.362	S	S	*	.	H	α-helix	trans	-69.1	-43.9	178.9	-54.9	175.6	-16.9	0	0	111.4	C672 K677 K678	C672-Q674 VanDerWaalsContact C-N 3.28Å; C672-Q674 PolarHBondContact O-N 3.37Å; Q674-K677 PolarHBondContact O-N 3.14Å; Q674-K678 WeakPolarHBondContact O-CB 3.22Å; Q674-K678 PolarHBondContact O-N 2.72Å
675	S	91.5	Very high	84.2	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.014	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-40.8	174.7	-86	0	0	0	0	112.2	N419 C420 C672 K677 K678 N679	N419-S675 PolarHBondContact OD1-OG 3.26Å; C420-S675 VanDerWaalsContact O-CB 3.26Å; C420-S675 WeakPolarHBondContact O-CB 3.42Å; C420-S675 PolarHBondContact O-OG 2.04Å; C672-S675 PolarHBondContact O-N 3.36Å; C672-S675 VanDerWaalsContact O-N 3.15Å; S675-K677 PolarHBondContact O-N 2.58Å; S675-K678 PolarHBondContact O-N 3.04Å; S675-N679 WeakPolarHBondContact O-CB 3.48Å; S675-N679 PolarHBondContact O-N 3.07Å; S675-N679 PolarHBondContact O-ND2 3.44Å
676	F	92.9	Very high	86.3	Confident	14 Å²	14	56.2 Å²	56.2	6%	0.061	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-46.1	175.5	-161.6	169.7	0	0	0	110.5	W671 C672 K678 N679 C680 A685 I705 Y727	W671-F676 HydrophobicContact CD2-CB 4.15Å; W671-F676 HydrophobicContact CD2-CG 4.41Å; W671-F676 HydrophobicContact CE3-CB 3.73Å; W671-F676 HydrophobicContact CE3-CD1 4.1Å; W671-F676 AromaticContact CE3-CD2 3.67Å; W671-F676 HydrophobicContact CE3-CD2 3.67Å; W671-F676 HydrophobicContact CE3-CE2 4.31Å; W671-F676 AromaticContact CE3-CG 3.56Å; W671-F676 HydrophobicContact CE3-CG 3.56Å; W671-F676 HydrophobicContact CZ3-CB 4.28Å; W671-F676 AromaticContact CZ3-CD2 3.66Å; W671-F676 HydrophobicContact CZ3-CD2 3.66Å; W671-F676 HydrophobicContact CZ3-CE2 4.24Å; W671-F676 HydrophobicContact CZ3-CG 4.04Å; C672-F676 PolarHBondContact O-N 3.47Å; F676-K678 PolarHBondContact O-N 2.81Å; F676-N679 PolarHBondContact O-N 3.19Å; F676-C680 VanDerWaalsContact CE2-SG 3.59Å; F676-C680 WeakPolarHBondContact O-CB 3.03Å; F676-C680 PolarHBondContact O-N 3.35Å; F676-A685 HydrophobicContact CD2-CB 3.87Å; F676-A685 HydrophobicContact CE2-CB 3.77Å; F676-I705 HydrophobicContact CB-CD1 4.21Å; F676-I705 HydrophobicContact CD1-CB 3.8Å; F676-I705 HydrophobicContact CD1-CG2 4.09Å; F676-I705 HydrophobicContact CD2-CB 4.34Å; F676-I705 HydrophobicContact CD2-CG2 3.83Å; F676-I705 HydrophobicContact CE1-CB 3.9Å; F676-I705 HydrophobicContact CE1-CG2 3.93Å; F676-I705 WeakPolarHBondContact CE1-O 3.23Å; F676-I705 HydrophobicContact CE2-CB 4.4Å; F676-I705 HydrophobicContact CE2-CG2 3.62Å; F676-I705 HydrophobicContact CG-CB 4.03Å; F676-I705 HydrophobicContact CG-CD1 4.31Å; F676-I705 HydrophobicContact CG-CG2 4.05Å; F676-I705 HydrophobicContact CZ-CB 4.2Å; F676-I705 HydrophobicContact CZ-CG2 3.69Å; F676-Y727 HydrophobicContact CE1-CD1 4.38Å; F676-Y727 AromaticContact CE1-CE1 3.9Å; F676-Y727 HydrophobicContact CE1-CE1 3.9Å; F676-Y727 HydrophobicContact CE2-CD1 4.27Å; F676-Y727 HydrophobicContact CE2-CE1 4.36Å; F676-Y727 AromaticContact CZ-CD1 3.84Å; F676-Y727 HydrophobicContact CZ-CD1 3.84Å; F676-Y727 AromaticContact CZ-CE1 3.81Å; F676-Y727 HydrophobicContact CZ-CE1 3.81Å
677	K	93.2	Very high	87.7	Confident	87 Å²	87	57.9 Å²	57.9	38%	0.378	30%	0.295	S	S	.	.	H	α-helix	trans	-56.4	-51.4	175.6	-173.6	-178.2	174	-174.9	0	111.9	L673 Q674 S675 N679 C680 E681 L702 I705	L673-K677 WeakPolarHBondContact O-CB 3.31Å; L673-K677 PolarHBondContact O-N 3.48Å; Q674-K677 PolarHBondContact O-N 3.14Å; S675-K677 PolarHBondContact O-N 2.58Å; K677-N679 VanDerWaalsContact C-N 3.33Å; K677-N679 PolarHBondContact O-N 2.75Å; K677-C680 WeakPolarHBondContact O-CB 3.42Å; K677-C680 PolarHBondContact O-N 2.77Å; K677-C680 VanDerWaalsContact O-N 3.09Å; K677-E681 WeakPolarHBondContact CE-OE1 3.39Å; K677-E681 WeakPolarHBondContact O-CG 3.06Å; K677-E681 PolarHBondContact O-N 2.6Å; K677-L702 HydrophobicContact CD-CD2 4.14Å; K677-I705 VanDerWaalsContact CA-CD1 3.47Å; K677-I705 HydrophobicContact CB-CD1 3.69Å; K677-I705 HydrophobicContact CG-CD1 4.4Å
678	K	92.3	Very high	89	Confident	102 Å²	102	55.7 Å²	55.7	44%	0.443	29%	0.286	S	S	.	.	H	α-helix	trans	-57.8	-43.5	179	-178	179.3	177.9	-179.4	0	112.1	Q674 S675 F676 C680 E681 Q682	Q674-K678 WeakPolarHBondContact O-CB 3.22Å; Q674-K678 PolarHBondContact O-N 2.72Å; S675-K678 PolarHBondContact O-N 3.04Å; F676-K678 PolarHBondContact O-N 2.81Å; K678-C680 VanDerWaalsContact C-N 3.35Å; K678-E681 PolarHBondContact O-N 3.04Å; K678-Q682 VanDerWaalsContact O-CG 3.31Å; K678-Q682 WeakPolarHBondContact O-CG 3.49Å; K678-Q682 PolarHBondContact O-N 2.92Å; K678-Q682 VanDerWaalsContact O-N 3.14Å
679	N	92.3	Very high	89.8	Confident	38 Å²	38	59.9 Å²	59.9	20%	0.203	31%	0.306	C	S	.	.	H	α-helix	trans	-72.9	-26.7	177.9	-76	-77	0	0	0	113	W671 S675 F676 K677 G683 T684 A685	W671-N679 HydrophobicContact CH2-CB 3.44Å; W671-N679 VanDerWaalsContact CH2-CB 3.44Å; W671-N679 VanDerWaalsContact CH2-CG 3.45Å; W671-N679 WeakPolarHBondContact CH2-ND2 3.09Å; W671-N679 HydrophobicContact CZ2-CB 4.17Å; W671-N679 WeakPolarHBondContact CZ2-ND2 3.38Å; W671-N679 HydrophobicContact CZ3-CB 4.13Å; S675-N679 WeakPolarHBondContact O-CB 3.48Å; S675-N679 PolarHBondContact O-N 3.07Å; S675-N679 PolarHBondContact O-ND2 3.44Å; F676-N679 PolarHBondContact O-N 3.19Å; K677-N679 VanDerWaalsContact C-N 3.33Å; K677-N679 PolarHBondContact O-N 2.75Å; N679-G683 PolarHBondContact O-N 3.47Å; N679-T684 WeakPolarHBondContact CB-OG1 3.44Å; N679-T684 PolarHBondContact O-N 2.03Å; N679-T684 PolarHBondContact O-OG1 2.8Å; N679-T684 VanDerWaalsContact O-OG1 3.12Å; N679-T684 PolarHBondContact OD1-OG1 2.91Å; N679-T684 VanDerWaalsContact OD1-OG1 3.04Å; N679-A685 HydrophobicContact CB-CB 3.85Å; N679-A685 PolarHBondContact O-N 2.89Å; N679-A685 VanDerWaalsContact O-N 3.09Å
680	C	93.1	Very high	90	Very high	14 Å²	14	59.9 Å²	59.9	10%	0.095	31%	0.31	C	S	.	.	H	α-helix	trans	-69	-43.1	171.3	-85.3	0	0	0	0	111.8	F676 K677 K678 Q682 G683 A685 C692 Y694	F676-C680 VanDerWaalsContact CE2-SG 3.59Å; F676-C680 WeakPolarHBondContact O-CB 3.03Å; F676-C680 PolarHBondContact O-N 3.35Å; K677-C680 WeakPolarHBondContact O-CB 3.42Å; K677-C680 PolarHBondContact O-N 2.77Å; K677-C680 VanDerWaalsContact O-N 3.09Å; K678-C680 VanDerWaalsContact C-N 3.35Å; C680-Q682 PolarHBondContact O-N 3.38Å; C680-G683 PolarHBondContact O-N 3.09Å; C680-A685 HydrophobicContact CB-CB 4.36Å; C680-C692 VanDerWaalsContact CA-SG 3.51Å; C680-C692 HydrophobicContact CB-CB 3.71Å; C680-C692 WeakPolarHBondContact CB-SG 3.07Å; C680-C692 WeakPolarHBondContact SG-CB 3.25Å; C680-C692 CovalentContact SG-SG 2.03Å; C680-C692 PolarHBondContact SG-SG 3.19Å; C680-Y694 VanDerWaalsContact CB-OH 3.32Å; C680-Y694 WeakPolarHBondContact CB-OH 3.12Å
681	E	93.1	Very high	90.3	Very high	133 Å²	133	59 Å²	59	62%	0.621	32%	0.317	S	S	*	.	H	α-helix	trans	-62.6	-32.7	175.1	-69.8	170.4	177.3	0	0	112	K677 K678 G683	K677-E681 WeakPolarHBondContact CE-OE1 3.39Å; K677-E681 WeakPolarHBondContact O-CG 3.06Å; K677-E681 PolarHBondContact O-N 2.6Å; K678-E681 PolarHBondContact O-N 3.04Å; E681-G683 VanDerWaalsContact C-N 3.32Å
682	Q	92.3	Very high	90.4	Very high	117 Å²	117	59.9 Å²	59.9	55%	0.547	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-6.7	174.3	-67.6	174.7	1.8	0	0	114	K678 C680 T684	K678-Q682 VanDerWaalsContact O-CG 3.31Å; K678-Q682 WeakPolarHBondContact O-CG 3.49Å; K678-Q682 PolarHBondContact O-N 2.92Å; K678-Q682 VanDerWaalsContact O-N 3.14Å; C680-Q682 PolarHBondContact O-N 3.38Å; Q682-T684 HydrophobicContact CB-CG2 4.18Å; Q682-T684 PolarHBondContact O-N 3.28Å
683	G	89.9	Confident	90.4	Very high	62 Å²	62	61.4 Å²	61.4	64%	0.639	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	17.7	-176.4	0	0	0	0	0	114.7	N679 C680 E681	N679-G683 PolarHBondContact O-N 3.47Å; C680-G683 PolarHBondContact O-N 3.09Å; E681-G683 VanDerWaalsContact C-N 3.32Å
684	T	90.4	Very high	90.4	Very high	55 Å²	55	62.7 Å²	62.7	34%	0.337	33%	0.331	S	S	.	.			trans	-100.3	-17.9	-176.9	57.4	0	0	0	0	113.4	N679 Q682 K687	N679-T684 WeakPolarHBondContact CB-OG1 3.44Å; N679-T684 PolarHBondContact O-N 2.03Å; N679-T684 PolarHBondContact O-OG1 2.8Å; N679-T684 VanDerWaalsContact O-OG1 3.12Å; N679-T684 PolarHBondContact OD1-OG1 2.91Å; N679-T684 VanDerWaalsContact OD1-OG1 3.04Å; Q682-T684 HydrophobicContact CB-CG2 4.18Å; Q682-T684 PolarHBondContact O-N 3.28Å; T684-K687 PolarHBondContact O-NZ 3.26Å
685	A	91.3	Very high	90.3	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	S	Bend	trans	-65.8	-63.3	-175.7	0	0	0	0	0	112.7	R458 W671 F676 N679 C680	R458-A685 PolarHBondContact NH1-O 2.82Å; R458-A685 PolarHBondContact NH2-O 2.6Å; W671-A685 HydrophobicContact CH2-CB 4.49Å; W671-A685 HydrophobicContact CZ3-CB 4.03Å; F676-A685 HydrophobicContact CD2-CB 3.87Å; F676-A685 HydrophobicContact CE2-CB 3.77Å; N679-A685 HydrophobicContact CB-CB 3.85Å; N679-A685 PolarHBondContact O-N 2.89Å; N679-A685 VanDerWaalsContact O-N 3.09Å; C680-A685 HydrophobicContact CB-CB 4.36Å
686	C	91.1	Very high	90.3	Very high	17 Å²	17	65 Å²	65	12%	0.115	34%	0.337	C	S	.	.	S	Bend	trans	-82.4	136.1	-179.7	-52.7	0	0	0	0	111.1	G690 C692 C707	C686-G690 VanDerWaalsContact CB-C 3.46Å; C686-G690 VanDerWaalsContact CB-O 3.26Å; C686-G690 WeakPolarHBondContact CB-O 3.26Å; C686-C692 PolarHBondContact SG-SG 2.9Å; C686-C707 WeakPolarHBondContact CA-SG 3.47Å; C686-C707 HydrophobicContact CB-CB 3.72Å; C686-C707 WeakPolarHBondContact CB-SG 3.44Å; C686-C707 WeakPolarHBondContact SG-CA 3Å; C686-C707 WeakPolarHBondContact SG-CB 3.28Å; C686-C707 CovalentContact SG-SG 2.03Å; C686-C707 PolarHBondContact SG-SG 3.32Å
687	K	88.1	Confident	90.1	Very high	86 Å²	86	66.4 Å²	66.4	37%	0.374	35%	0.346	S	S	.	.			trans	-101	166.4	179.3	-58.8	-57.4	-173.6	-161.9	0	110.9	T684 N689 G690 Y727 C728 E729	T684-K687 PolarHBondContact O-NZ 3.26Å; K687-N689 PolarHBondContact O-N 3.34Å; K687-G690 PolarHBondContact O-N 3.08Å; K687-Y727 PolarHBondContact N-O 2.76Å; K687-C728 WeakPolarHBondContact O-CB 3.24Å; K687-E729 HydrophobicContact CB-CB 4.24Å; K687-E729 HydrophobicContact CG-CB 4.2Å
688	N	87.8	Confident	90	Very high	64 Å²	64	74.6 Å²	74.6	34%	0.342	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	46.8	170.8	-53.1	-54.7	0	0	0	114.8	G690 Y723 C728 E729	N688-G690 PolarHBondContact O-N 2.94Å; N688-Y723 HydrophobicContact CB-CD1 3.54Å; N688-Y723 HydrophobicContact CB-CD2 4.02Å; N688-Y723 HydrophobicContact CB-CE1 3.45Å; N688-Y723 VanDerWaalsContact CB-CE1 3.45Å; N688-Y723 HydrophobicContact CB-CE2 3.93Å; N688-Y723 HydrophobicContact CB-CG 3.83Å; N688-Y723 WeakPolarHBondContact ND2-CD1 3.45Å; N688-Y723 WeakPolarHBondContact ND2-CE1 3.26Å; N688-C728 PolarHBondContact ND2-O 3.42Å; N688-E729 PolarHBondContact ND2-O 3.41Å
689	N	82.6	Confident	90	Very high	127 Å²	127	76.2 Å²	76.2	68%	0.679	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	13.4	-175.8	-58.8	-8.7	0	0	0	115.7	K687 T720	K687-N689 PolarHBondContact O-N 3.34Å; N689-T720 PolarHBondContact O-OG1 3.11Å
690	G	83.8	Confident	89.8	Confident	15 Å²	15	82.4 Å²	82.4	16%	0.155	41%	0.411	C	S	.	.			trans	-58.8	147.7	165.8	0	0	0	0	0	111.4	C686 K687 N688	C686-G690 VanDerWaalsContact CB-C 3.46Å; C686-G690 VanDerWaalsContact CB-O 3.26Å; C686-G690 WeakPolarHBondContact CB-O 3.26Å; K687-G690 PolarHBondContact O-N 3.08Å; N688-G690 PolarHBondContact O-N 2.94Å
691	S	88.2	Confident	89.6	Confident	69 Å²	69	89 Å²	89	48%	0.483	43%	0.434	S	S	.	.			trans	-118.6	141.8	-178.5	-66.3	0	0	0	0	110.2	H693 C707	S691-H693 PolarHBondContact O-CD2 2.75Å; S691-H693 PolarHBondContact O-N 3.28Å; S691-C707 CarbonylContact O-C 3.53Å; S691-C707 WeakPolarHBondContact O-CA 3.44Å
692	C	92	Very high	89.3	Confident	33 Å²	33	84.5 Å²	84.5	22%	0.223	41%	0.414	C	S	.	.			trans	-76.4	123.9	178.3	-66.5	0	0	0	0	111.2	C680 C686 Y694 I705	C680-C692 VanDerWaalsContact CA-SG 3.51Å; C680-C692 HydrophobicContact CB-CB 3.71Å; C680-C692 WeakPolarHBondContact CB-SG 3.07Å; C680-C692 WeakPolarHBondContact SG-CB 3.25Å; C680-C692 CovalentContact SG-SG 2.03Å; C680-C692 PolarHBondContact SG-SG 3.19Å; C686-C692 PolarHBondContact SG-SG 2.9Å; C692-Y694 HydrophobicContact CB-CE2 4.11Å; C692-I705 HydrophobicContact CB-CG2 4.42Å
693	H	90.8	Very high	89.1	Confident	53 Å²	53	86.7 Å²	86.7	25%	0.245	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.9	173.5	-64.6	-76.7	0	0	0	110.2	S691 I705 Y706 L709	S691-H693 PolarHBondContact O-CD2 2.75Å; S691-H693 PolarHBondContact O-N 3.28Å; H693-I705 WeakPolarHBondContact O-CA 3.33Å; H693-Y706 HydrophobicContact CB-CD2 3.88Å; H693-Y706 HydrophobicContact CB-CE1 4.17Å; H693-Y706 HydrophobicContact CB-CE2 3.46Å; H693-Y706 VanDerWaalsContact CB-CE2 3.46Å; H693-Y706 HydrophobicContact CB-CG 4.39Å; H693-Y706 PolarHBondContact N-O 3.21Å; H693-Y706 PolarHBondContact O-N 3.08Å; H693-L709 WeakPolarHBondContact CE1-CD2 3.23Å; H693-L709 WeakPolarHBondContact NE2-CD2 3.29Å
694	Y	91.2	Very high	88.9	Confident	87 Å²	87	88.4 Å²	88.4	34%	0.341	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.5	-176.4	-56.8	-93	0	0	0	109.5	C680 C692 L702 I705	C680-Y694 VanDerWaalsContact CB-OH 3.32Å; C680-Y694 WeakPolarHBondContact CB-OH 3.12Å; C692-Y694 HydrophobicContact CB-CE2 4.11Å; Y694-L702 HydrophobicContact CD1-CD1 3.83Å; Y694-L702 HydrophobicContact CG-CD1 4.39Å; Y694-I705 HydrophobicContact CD1-CD1 4.07Å; Y694-I705 HydrophobicContact CD1-CG1 3.74Å; Y694-I705 HydrophobicContact CE1-CD1 3.86Å; Y694-I705 HydrophobicContact CE1-CG1 3.99Å
695	E	89	Confident	88.9	Confident	64 Å²	64	86.2 Å²	86.2	30%	0.299	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.5	171.9	-170.6	-173	155.1	0	0	109	R703 R704 Y706	E695-R703 WeakPolarHBondContact O-CA 3.3Å; E695-R703 WeakPolarHBondContact O-CB 3.1Å; E695-R703 PolarHBondContact O-N 3.04Å; E695-R703 IonicContact OE1-CZ 3.8Å; E695-R703 IonicContact OE1-NH1 2.83Å; E695-R703 PolarHBondContact OE1-NH1 3.42Å; E695-R704 HydrophobicContact CB-CB 4.15Å; E695-R704 PolarHBondContact N-O 3.29Å; E695-R704 PolarHBondContact O-N 3.21Å; E695-R704 VanDerWaalsContact O-N 3.17Å; E695-Y706 HydrophobicContact CB-CE1 4.24Å
696	Y	90.7	Very high	88.8	Confident	127 Å²	127	88.5 Å²	88.5	50%	0.498	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	147.3	177.1	-64.4	-91.9	0	0	0	110.2	E700 R701 L702	Y696-E700 WeakPolarHBondContact CD1-O 3.05Å; Y696-R701 CarbonylContact C-O 3.58Å; Y696-R701 WeakPolarHBondContact CA-O 3.24Å; Y696-L702 HydrophobicContact CD1-CB 4.11Å; Y696-L702 HydrophobicContact CD1-CD1 4.29Å; Y696-L702 HydrophobicContact CE1-CB 3.83Å; Y696-L702 HydrophobicContact CE1-CD1 3.84Å; Y696-L702 HydrophobicContact CE1-CG 4.44Å; Y696-L702 HydrophobicContact CE2-CD1 4.33Å
697	D	89.3	Confident	88.6	Confident	45 Å²	45	87.8 Å²	87.8	24%	0.241	40%	0.395	C	S	.	.			trans	-75.4	178.2	171.9	77	5.1	0	0	0	111.8	Q699 E700 R701	D697-Q699 PolarHBondContact O-N 3.26Å; D697-Q699 VanDerWaalsContact O-N 3.14Å; D697-Q699 VanDerWaalsContact OD1-CA 3.25Å; D697-Q699 WeakPolarHBondContact OD1-CA 3Å; D697-Q699 WeakPolarHBondContact OD1-CB 3.27Å; D697-Q699 PolarHBondContact OD1-N 3.34Å; D697-E700 PolarHBondContact O-N 3.28Å; D697-E700 VanDerWaalsContact O-N 3.09Å; D697-E700 PolarHBondContact OD1-N 2.6Å; D697-E700 VanDerWaalsContact OD1-N 3.1Å; D697-R701 PolarHBondContact N-O 2.76Å; D697-R701 PolarHBondContact OD1-N 2.98Å; D697-R701 IonicContact OD2-CZ 3.38Å; D697-R701 IonicContact OD2-NE 2.93Å; D697-R701 PolarHBondContact OD2-NE 3.07Å; D697-R701 IonicContact OD2-NH2 2.93Å; D697-R701 PolarHBondContact OD2-NH2 2.62Å
698	R	90.5	Very high	88.4	Confident	258 Å²	258	85.1 Å²	85.1	97%	0.974	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.3	177.9	-67.2	-175.8	-177.3	170.7	1.3	113.8
699	Q	91.8	Very high	88	Confident	136 Å²	136	85.5 Å²	85.5	64%	0.636	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	17.4	178.2	-63.4	-178.4	-30.1	0	0	111.3	D697 R701	D697-Q699 PolarHBondContact O-N 3.26Å; D697-Q699 VanDerWaalsContact O-N 3.14Å; D697-Q699 VanDerWaalsContact OD1-CA 3.25Å; D697-Q699 WeakPolarHBondContact OD1-CA 3Å; D697-Q699 WeakPolarHBondContact OD1-CB 3.27Å; D697-Q699 PolarHBondContact OD1-N 3.34Å; Q699-R701 HydrophobicContact CB-CG 4.43Å; Q699-R701 PolarHBondContact O-N 3.05Å; Q699-R701 VanDerWaalsContact O-N 3.17Å
700	E	88.6	Confident	87.5	Confident	169 Å²	169	83.1 Å²	83.1	79%	0.79	38%	0.375	S	S	*	.	S	Bend	trans	59.7	20	-178.1	-56.7	-169.8	158.9	0	0	114.7	Y696 D697	Y696-E700 WeakPolarHBondContact CD1-O 3.05Å; D697-E700 PolarHBondContact O-N 3.28Å; D697-E700 VanDerWaalsContact O-N 3.09Å; D697-E700 PolarHBondContact OD1-N 2.6Å; D697-E700 VanDerWaalsContact OD1-N 3.1Å
701	R	88.1	Confident	87	Confident	151 Å²	151	84 Å²	84	57%	0.57	38%	0.376	S	S	*	.			trans	-86.2	134.3	173.9	-58.3	-179.2	-60.9	-177.1	0.3	109.4	Y696 D697 Q699 R703	Y696-R701 CarbonylContact C-O 3.58Å; Y696-R701 WeakPolarHBondContact CA-O 3.24Å; D697-R701 PolarHBondContact N-O 2.76Å; D697-R701 PolarHBondContact OD1-N 2.98Å; D697-R701 IonicContact OD2-CZ 3.38Å; D697-R701 IonicContact OD2-NE 2.93Å; D697-R701 PolarHBondContact OD2-NE 3.07Å; D697-R701 IonicContact OD2-NH2 2.93Å; D697-R701 PolarHBondContact OD2-NH2 2.62Å; Q699-R701 HydrophobicContact CB-CG 4.43Å; Q699-R701 PolarHBondContact O-N 3.05Å; Q699-R701 VanDerWaalsContact O-N 3.17Å; R701-R703 PolarHBondContact O-N 3.02Å; R701-R703 VanDerWaalsContact O-N 3.1Å
702	L	87.9	Confident	86.2	Confident	39 Å²	39	89.3 Å²	89.3	20%	0.204	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	117.1	177	-178.6	67	0	0	0	109	L673 K677 Y694 Y696 I705	L673-L702 HydrophobicContact CD1-CD2 4.17Å; L673-L702 HydrophobicContact CD1-CG 4.32Å; L673-L702 HydrophobicContact CD2-CD2 4.2Å; L673-L702 HydrophobicContact CD2-CG 4.11Å; L673-L702 WeakPolarHBondContact CD2-O 3.45Å; L673-L702 HydrophobicContact CG-CD2 4.08Å; L673-L702 HydrophobicContact CG-CG 4.41Å; K677-L702 HydrophobicContact CD-CD2 4.14Å; Y694-L702 HydrophobicContact CD1-CD1 3.83Å; Y694-L702 HydrophobicContact CG-CD1 4.39Å; Y696-L702 HydrophobicContact CD1-CB 4.11Å; Y696-L702 HydrophobicContact CD1-CD1 4.29Å; Y696-L702 HydrophobicContact CE1-CB 3.83Å; Y696-L702 HydrophobicContact CE1-CD1 3.84Å; Y696-L702 HydrophobicContact CE1-CG 4.44Å; Y696-L702 HydrophobicContact CE2-CD1 4.33Å; L702-I705 HydrophobicContact CD1-CG1 4.25Å; L702-I705 HydrophobicContact CD2-CD1 4Å; L702-I705 HydrophobicContact CD2-CG1 4.16Å
703	R	87.1	Confident	85.5	Confident	164 Å²	164	95 Å²	95	62%	0.619	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	-43.1	-175.3	-175.2	-172.5	-177.2	-161.8	6.5	111.7	E695 R701	E695-R703 WeakPolarHBondContact O-CA 3.3Å; E695-R703 WeakPolarHBondContact O-CB 3.1Å; E695-R703 PolarHBondContact O-N 3.04Å; E695-R703 IonicContact OE1-CZ 3.8Å; E695-R703 IonicContact OE1-NH1 2.83Å; E695-R703 PolarHBondContact OE1-NH1 3.42Å; R701-R703 PolarHBondContact O-N 3.02Å; R701-R703 VanDerWaalsContact O-N 3.1Å
704	R	87	Confident	84.7	Confident	98 Å²	98	97.2 Å²	97.2	37%	0.37	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	145.7	-174	-161.4	176.4	-169	-172.1	-0.2	111.2	E695 Y706	E695-R704 HydrophobicContact CB-CB 4.15Å; E695-R704 PolarHBondContact N-O 3.29Å; E695-R704 PolarHBondContact O-N 3.21Å; E695-R704 VanDerWaalsContact O-N 3.17Å; R704-Y706 HydrophobicContact CG-CD1 4.44Å
705	I	90.3	Very high	83.5	Confident	8 Å²	8	100.6 Å²	100.6	4%	0.041	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.4	165	-58.1	169.7	0	0	0	107.5	L673 F676 K677 C692 H693 Y694 L702	L673-I705 HydrophobicContact CD1-CB 4.39Å; L673-I705 HydrophobicContact CD1-CD1 3.96Å; L673-I705 HydrophobicContact CD1-CG1 3.8Å; F676-I705 HydrophobicContact CB-CD1 4.21Å; F676-I705 HydrophobicContact CD1-CB 3.8Å; F676-I705 HydrophobicContact CD1-CG2 4.09Å; F676-I705 HydrophobicContact CD2-CB 4.34Å; F676-I705 HydrophobicContact CD2-CG2 3.83Å; F676-I705 HydrophobicContact CE1-CB 3.9Å; F676-I705 HydrophobicContact CE1-CG2 3.93Å; F676-I705 WeakPolarHBondContact CE1-O 3.23Å; F676-I705 HydrophobicContact CE2-CB 4.4Å; F676-I705 HydrophobicContact CE2-CG2 3.62Å; F676-I705 HydrophobicContact CG-CB 4.03Å; F676-I705 HydrophobicContact CG-CD1 4.31Å; F676-I705 HydrophobicContact CG-CG2 4.05Å; F676-I705 HydrophobicContact CZ-CB 4.2Å; F676-I705 HydrophobicContact CZ-CG2 3.69Å; K677-I705 VanDerWaalsContact CA-CD1 3.47Å; K677-I705 HydrophobicContact CB-CD1 3.69Å; K677-I705 HydrophobicContact CG-CD1 4.4Å; C692-I705 HydrophobicContact CB-CG2 4.42Å; H693-I705 WeakPolarHBondContact O-CA 3.33Å; Y694-I705 HydrophobicContact CD1-CD1 4.07Å; Y694-I705 HydrophobicContact CD1-CG1 3.74Å; Y694-I705 HydrophobicContact CE1-CD1 3.86Å; Y694-I705 HydrophobicContact CE1-CG1 3.99Å; L702-I705 HydrophobicContact CD1-CG1 4.25Å; L702-I705 HydrophobicContact CD2-CD1 4Å; L702-I705 HydrophobicContact CD2-CG1 4.16Å
706	Y	88.2	Confident	82.5	Confident	49 Å²	49	102.4 Å²	102.4	19%	0.192	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	151.9	174	54.9	-87.4	0	0	0	110.2	H693 E695 R704 E708 V710 L717	H693-Y706 HydrophobicContact CB-CD2 3.88Å; H693-Y706 HydrophobicContact CB-CE1 4.17Å; H693-Y706 HydrophobicContact CB-CE2 3.46Å; H693-Y706 VanDerWaalsContact CB-CE2 3.46Å; H693-Y706 HydrophobicContact CB-CG 4.39Å; H693-Y706 PolarHBondContact N-O 3.21Å; H693-Y706 PolarHBondContact O-N 3.08Å; E695-Y706 HydrophobicContact CB-CE1 4.24Å; R704-Y706 HydrophobicContact CG-CD1 4.44Å; Y706-E708 WeakPolarHBondContact CD2-O 3.09Å; Y706-E708 WeakPolarHBondContact CE2-O 3.36Å; Y706-V710 HydrophobicContact CE2-CG2 4.38Å; Y706-L717 HydrophobicContact CD2-CD2 3.9Å; Y706-L717 HydrophobicContact CE2-CD2 4.08Å
707	C	88.5	Confident	81.6	Confident	2 Å²	2	99.8 Å²	99.8	1%	0.014	45%	0.453	C	S	.	.	S	Bend	trans	-94.9	-13.3	-177.8	-70.9	0	0	0	0	113.9	C686 S691 C728	C686-C707 WeakPolarHBondContact CA-SG 3.47Å; C686-C707 HydrophobicContact CB-CB 3.72Å; C686-C707 WeakPolarHBondContact CB-SG 3.44Å; C686-C707 WeakPolarHBondContact SG-CA 3Å; C686-C707 WeakPolarHBondContact SG-CB 3.28Å; C686-C707 CovalentContact SG-SG 2.03Å; C686-C707 PolarHBondContact SG-SG 3.32Å; S691-C707 CarbonylContact O-C 3.53Å; S691-C707 WeakPolarHBondContact O-CA 3.44Å; C707-C728 PolarHBondContact O-SG 3.42Å; C707-C728 VanDerWaalsContact O-SG 3.36Å
708	E	83.4	Confident	81.1	Confident	29 Å²	29	100.8 Å²	100.8	14%	0.136	46%	0.457	C	S	.	.	S	Bend	trans	-86.9	146.7	-177.3	-62.4	168.1	128.6	0	0	110.6	Y706 L717 I718	Y706-E708 WeakPolarHBondContact CD2-O 3.09Å; Y706-E708 WeakPolarHBondContact CE2-O 3.36Å; E708-L717 HydrophobicContact CB-CB 3.66Å; E708-L717 HydrophobicContact CB-CD2 3.85Å; E708-L717 HydrophobicContact CB-CG 4.31Å; E708-L717 HydrophobicContact CG-CB 4.23Å; E708-L717 WeakPolarHBondContact OE2-CB 3.49Å; E708-I718 CarbonylContact C-O 3.53Å
709	L	78.2	Confident	80.7	Confident	72 Å²	72	89 Å²	89	38%	0.377	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	139.1	170.8	-69.7	159.6	0	0	0	109.3	H693 D711 L717 I718 T720	H693-L709 WeakPolarHBondContact CE1-CD2 3.23Å; H693-L709 WeakPolarHBondContact NE2-CD2 3.29Å; L709-D711 PolarHBondContact O-N 3.21Å; L709-L717 CarbonylContact O-C 3.5Å; L709-L717 VanDerWaalsContact O-CA 3.31Å; L709-L717 WeakPolarHBondContact O-CA 3.31Å; L709-I718 HydrophobicContact CB-CG1 4.2Å; L709-I718 PolarHBondContact N-O 3.17Å; L709-I718 WeakPolarHBondContact O-CG1 3.32Å; L709-I718 PolarHBondContact O-N 3.23Å; L709-T720 HydrophobicContact CD1-CG2 4.11Å
710	V	72.9	Confident	80.1	Confident	78 Å²	78	84.6 Å²	84.6	47%	0.473	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	108	167.3	-178	0	0	0	0	108.2	Y706 K712 L717	Y706-V710 HydrophobicContact CE2-CG2 4.38Å; V710-K712 PolarHBondContact O-N 3.47Å; V710-L717 HydrophobicContact CG2-CD2 3.77Å
711	D	73.6	Confident	79.6	Confident	33 Å²	33	82.4 Å²	82.4	18%	0.176	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	117.4	167.1	-166.3	-48	0	0	0	108.5	L709 D713 I714 H715 Q716 I718	L709-D711 PolarHBondContact O-N 3.21Å; D711-D713 VanDerWaalsContact C-N 3.29Å; D711-D713 PolarHBondContact O-N 3.07Å; D711-D713 WeakPolarHBondContact OD1-CA 3.19Å; D711-D713 WeakPolarHBondContact OD1-CB 3.34Å; D711-D713 PolarHBondContact OD1-N 2.04Å; D711-I714 HydrophobicContact CB-CB 4.28Å; D711-I714 PolarHBondContact OD1-N 3.25Å; D711-I714 VanDerWaalsContact OD1-N 3.11Å; D711-H715 VanDerWaalsContact O-CA 3.23Å; D711-H715 WeakPolarHBondContact O-CA 3.49Å; D711-H715 PolarHBondContact O-N 2.83Å; D711-Q716 WeakPolarHBondContact CB-O 3.25Å; D711-Q716 PolarHBondContact N-O 3.25Å; D711-I718 HydrophobicContact CB-CD1 3.74Å; D711-I718 HydrophobicContact CB-CG1 3.97Å; D711-I718 HydrophobicContact CB-CG2 4.4Å; D711-I718 WeakPolarHBondContact OD2-CD1 3.41Å
712	K	71.7	Confident	79	Confident	180 Å²	180	77.5 Å²	77.5	78%	0.783	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-26.7	-179.4	-69.1	-174.5	-179	179.3	0	112.5	V710	V710-K712 PolarHBondContact O-N 3.47Å
713	D	76.8	Confident	78.8	Confident	154 Å²	154	78.7 Å²	78.7	82%	0.824	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-36.2	-176.8	-60.9	-38.6	0	0	0	111	D711	D711-D713 VanDerWaalsContact C-N 3.29Å; D711-D713 PolarHBondContact O-N 3.07Å; D711-D713 WeakPolarHBondContact OD1-CA 3.19Å; D711-D713 WeakPolarHBondContact OD1-CB 3.34Å; D711-D713 PolarHBondContact OD1-N 2.04Å
714	I	73.9	Confident	78.2	Confident	99 Å²	99	72.8 Å²	72.8	51%	0.508	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-11.9	-176.5	-46.7	177.6	0	0	0	112.1	D711 Q716	D711-I714 HydrophobicContact CB-CB 4.28Å; D711-I714 PolarHBondContact OD1-N 3.25Å; D711-I714 VanDerWaalsContact OD1-N 3.11Å; I714-Q716 HydrophobicContact CB-CB 4.38Å; I714-Q716 HydrophobicContact CG2-CB 4.08Å; I714-Q716 HydrophobicContact CG2-CG 3.89Å; I714-Q716 PolarHBondContact O-N 3.23Å
715	H	66.7	Low	77.8	Confident	158 Å²	158	68.4 Å²	68.4	73%	0.731	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	36.8	-170.5	-65.9	-47.1	0	0	0	112.6	D711	D711-H715 VanDerWaalsContact O-CA 3.23Å; D711-H715 WeakPolarHBondContact O-CA 3.49Å; D711-H715 PolarHBondContact O-N 2.83Å
716	Q	68	Low	77.4	Confident	101 Å²	101	70.9 Å²	70.9	47%	0.472	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	150	-179.9	-77.3	-175.1	-8.8	0	0	111.1	D711 I714	D711-Q716 WeakPolarHBondContact CB-O 3.25Å; D711-Q716 PolarHBondContact N-O 3.25Å; I714-Q716 HydrophobicContact CB-CB 4.38Å; I714-Q716 HydrophobicContact CG2-CB 4.08Å; I714-Q716 HydrophobicContact CG2-CG 3.89Å; I714-Q716 PolarHBondContact O-N 3.23Å
717	L	72.1	Confident	77.3	Confident	73 Å²	73	69 Å²	69	38%	0.382	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.3	171.6	-73.4	158.8	0	0	0	108.5	Y706 E708 L709 V710	Y706-L717 HydrophobicContact CD2-CD2 3.9Å; Y706-L717 HydrophobicContact CE2-CD2 4.08Å; E708-L717 HydrophobicContact CB-CB 3.66Å; E708-L717 HydrophobicContact CB-CD2 3.85Å; E708-L717 HydrophobicContact CB-CG 4.31Å; E708-L717 HydrophobicContact CG-CB 4.23Å; E708-L717 WeakPolarHBondContact OE2-CB 3.49Å; L709-L717 CarbonylContact O-C 3.5Å; L709-L717 VanDerWaalsContact O-CA 3.31Å; L709-L717 WeakPolarHBondContact O-CA 3.31Å; V710-L717 HydrophobicContact CG2-CD2 3.77Å
718	I	77.2	Confident	77.2	Confident	65 Å²	65	68.9 Å²	68.9	33%	0.333	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140	-177	57.2	165.2	0	0	0	111.4	E708 L709 D711	E708-I718 CarbonylContact C-O 3.53Å; L709-I718 HydrophobicContact CB-CG1 4.2Å; L709-I718 PolarHBondContact N-O 3.17Å; L709-I718 WeakPolarHBondContact O-CG1 3.32Å; L709-I718 PolarHBondContact O-N 3.23Å; D711-I718 HydrophobicContact CB-CD1 3.74Å; D711-I718 HydrophobicContact CB-CG1 3.97Å; D711-I718 HydrophobicContact CB-CG2 4.4Å; D711-I718 WeakPolarHBondContact OD2-CD1 3.41Å
719	C	81.9	Confident	77.3	Confident	10 Å²	10	68.8 Å²	68.8	7%	0.068	36%	0.363	C	S	.	.			trans	-90.6	156.7	169.2	-62.6	0	0	0	0	111.6	Y723 C728	C719-Y723 VanDerWaalsContact CB-O 3.31Å; C719-Y723 WeakPolarHBondContact CB-O 3.23Å; C719-C728 HydrophobicContact CB-CB 3.53Å; C719-C728 WeakPolarHBondContact CB-SG 3.47Å; C719-C728 WeakPolarHBondContact SG-CA 3.07Å; C719-C728 WeakPolarHBondContact SG-CB 3.47Å; C719-C728 CovalentContact SG-SG 2.02Å; C719-C728 PolarHBondContact SG-SG 3.11Å
720	T	79.9	Confident	77.5	Confident	45 Å²	45	65.8 Å²	65.8	28%	0.276	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-58.6	144.8	172.3	50.6	0	0	0	0	111	N689 L709 G722 Y723	N689-T720 PolarHBondContact O-OG1 3.11Å; L709-T720 HydrophobicContact CD1-CG2 4.11Å; T720-G722 VanDerWaalsContact C-N 3.28Å; T720-G722 PolarHBondContact O-N 2.86Å; T720-Y723 WeakPolarHBondContact O-CD2 2.88Å
721	N	78.8	Confident	77.6	Confident	122 Å²	122	64.5 Å²	64.5	65%	0.652	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	62.1	23.8	176.8	-55.9	-35.5	0	0	0	115.9	Y723	N721-Y723 HydrophobicContact CB-CD2 3.93Å; N721-Y723 HydrophobicContact CB-CE2 4Å; N721-Y723 PolarHBondContact O-N 3.37Å
722	G	75.4	Confident	77.4	Confident	48 Å²	48	65.4 Å²	65.4	50%	0.495	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	75.6	9	175.8	0	0	0	0	0	114.6	T720 P732	T720-G722 VanDerWaalsContact C-N 3.28Å; T720-G722 PolarHBondContact O-N 2.86Å; G722-P732 WeakPolarHBondContact O-CA 3.35Å; G722-P732 WeakPolarHBondContact O-CB 3.11Å
723	Y	82.2	Confident	77	Confident	65 Å²	65	61.4 Å²	61.4	26%	0.255	34%	0.343	S	S	.	.			trans	-61.4	162.1	168.2	-73.7	-98.1	0	0	0	110.3	N688 C719 T720 N721 V730 A731	N688-Y723 HydrophobicContact CB-CD1 3.54Å; N688-Y723 HydrophobicContact CB-CD2 4.02Å; N688-Y723 HydrophobicContact CB-CE1 3.45Å; N688-Y723 VanDerWaalsContact CB-CE1 3.45Å; N688-Y723 HydrophobicContact CB-CE2 3.93Å; N688-Y723 HydrophobicContact CB-CG 3.83Å; N688-Y723 WeakPolarHBondContact ND2-CD1 3.45Å; N688-Y723 WeakPolarHBondContact ND2-CE1 3.26Å; C719-Y723 VanDerWaalsContact CB-O 3.31Å; C719-Y723 WeakPolarHBondContact CB-O 3.23Å; T720-Y723 WeakPolarHBondContact O-CD2 2.88Å; N721-Y723 HydrophobicContact CB-CD2 3.93Å; N721-Y723 HydrophobicContact CB-CE2 4Å; N721-Y723 PolarHBondContact O-N 3.37Å; Y723-V730 CarbonylContact C-O 3.45Å; Y723-V730 VanDerWaalsContact CA-O 3.26Å; Y723-V730 WeakPolarHBondContact CA-O 3.44Å; Y723-V730 WeakPolarHBondContact CD1-O 3.22Å; Y723-A731 HydrophobicContact CD1-CB 4.44Å; Y723-A731 HydrophobicContact CE1-CB 4.07Å
724	S	76.5	Confident	76	Confident	39 Å²	39	60.4 Å²	60.4	27%	0.273	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-141.8	172.5	179.8	57.4	0	0	0	0	110.6	E729 V730	S724-E729 PolarHBondContact O-N 3.39Å; S724-V730 PolarHBondContact N-O 3.23Å; S724-V730 WeakPolarHBondContact O-CA 2.92Å; S724-V730 VanDerWaalsContact O-CB 3.28Å; S724-V730 WeakPolarHBondContact O-CB 3.17Å; S724-V730 PolarHBondContact O-N 2.75Å; S724-V730 WeakPolarHBondContact OG-CB 3.06Å
725	G	78.5	Confident	74.7	Confident	6 Å²	6	57.6 Å²	57.6	6%	0.062	34%	0.338	C	S	.	.	S	Bend	trans	96.5	159.3	-177.4	0	0	0	0	0	113.1	Y649 Y727 C728	Y649-G725 WeakPolarHBondContact OH-CA 3.28Å; G725-Y727 PolarHBondContact O-N 3.37Å; G725-C728 PolarHBondContact O-N 3.47Å
726	L	80.7	Confident	73.1	Confident	60 Å²	60	61.7 Å²	61.7	31%	0.314	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-25.4	-172.2	-67	171.8	0	0	0	113.6	Y649 P668	Y649-L726 PolarHBondContact OH-N 2.96Å; P668-L726 HydrophobicContact CB-CD1 4Å; P668-L726 HydrophobicContact CG-CD1 4.05Å
727	Y	87	Confident	71.4	Confident	10 Å²	10	61.6 Å²	61.6	4%	0.039	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	19.7	-179.4	-41.7	-75.4	0	0	0	113.3	R458 Y459 W671 F676 K687 G725 E729	R458-Y727 HydrophobicContact CG-CD2 4.04Å; R458-Y727 HydrophobicContact CG-CE2 3.6Å; R458-Y727 WeakPolarHBondContact O-CE2 3.31Å; R458-Y727 PolarHBondContact O-OH 3.34Å; Y459-Y727 HydrophobicContact CD1-CE2 4.38Å; Y459-Y727 AromaticContact CE1-CD2 3.87Å; Y459-Y727 HydrophobicContact CE1-CD2 3.87Å; Y459-Y727 HydrophobicContact CE1-CE2 4.02Å; W671-Y727 WeakPolarHBondContact CB-OH 3.43Å; W671-Y727 AromaticContact CE3-CE1 3.9Å; W671-Y727 HydrophobicContact CE3-CE1 3.9Å; W671-Y727 HydrophobicContact CZ3-CE1 4.45Å; F676-Y727 HydrophobicContact CE1-CD1 4.38Å; F676-Y727 AromaticContact CE1-CE1 3.9Å; F676-Y727 HydrophobicContact CE1-CE1 3.9Å; F676-Y727 HydrophobicContact CE2-CD1 4.27Å; F676-Y727 HydrophobicContact CE2-CE1 4.36Å; F676-Y727 AromaticContact CZ-CD1 3.84Å; F676-Y727 HydrophobicContact CZ-CD1 3.84Å; F676-Y727 AromaticContact CZ-CE1 3.81Å; F676-Y727 HydrophobicContact CZ-CE1 3.81Å; K687-Y727 PolarHBondContact N-O 2.76Å; G725-Y727 PolarHBondContact O-N 3.37Å; Y727-E729 WeakPolarHBondContact CA-OE2 3.38Å; Y727-E729 WeakPolarHBondContact CB-OE2 3.46Å; Y727-E729 PolarHBondContact N-OE2 2.86Å; Y727-E729 PolarHBondContact O-N 3.3Å
728	C	86.2	Confident	69.6	Low	0 Å²	0	62.2 Å²	62.2	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	60.3	27.4	-178.4	-55.6	0	0	0	0	115	K687 N688 C707 C719 G725	K687-C728 WeakPolarHBondContact O-CB 3.24Å; N688-C728 PolarHBondContact ND2-O 3.42Å; C707-C728 PolarHBondContact O-SG 3.42Å; C707-C728 VanDerWaalsContact O-SG 3.36Å; C719-C728 HydrophobicContact CB-CB 3.53Å; C719-C728 WeakPolarHBondContact CB-SG 3.47Å; C719-C728 WeakPolarHBondContact SG-CA 3.07Å; C719-C728 WeakPolarHBondContact SG-CB 3.47Å; C719-C728 CovalentContact SG-SG 2.02Å; C719-C728 PolarHBondContact SG-SG 3.11Å; G725-C728 PolarHBondContact O-N 3.47Å
729	E	85.4	Confident	67.9	Low	27 Å²	27	63.1 Å²	63.1	13%	0.126	39%	0.393	C	S	.	.			trans	-83.6	-24	-175.9	70.7	-74.8	170.1	0	0	114.6	Y459 H625 Y649 K687 N688 S724 Y727	Y459-E729 HydrophobicContact CE1-CG 4.26Å; Y459-E729 WeakPolarHBondContact OH-CG 3.33Å; H625-E729 VanDerWaalsContact NE2-CG 3.3Å; H625-E729 WeakPolarHBondContact NE2-CG 3.41Å; H625-E729 IonicContact NE2-OE1 3.8Å; Y649-E729 PolarHBondContact OH-OE1 2.83Å; K687-E729 HydrophobicContact CB-CB 4.24Å; K687-E729 HydrophobicContact CG-CB 4.2Å; N688-E729 PolarHBondContact ND2-O 3.41Å; S724-E729 PolarHBondContact O-N 3.39Å; Y727-E729 WeakPolarHBondContact CA-OE2 3.38Å; Y727-E729 WeakPolarHBondContact CB-OE2 3.46Å; Y727-E729 PolarHBondContact N-OE2 2.86Å; Y727-E729 PolarHBondContact O-N 3.3Å
730	V	81.1	Confident	65.5	Low	9 Å²	9	70.2 Å²	70.2	6%	0.055	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-88.6	119.8	-175.6	-178.8	0	0	0	0	110.4	Y649 C658 Y723 S724	Y649-V730 HydrophobicContact CD1-CG2 4.03Å; Y649-V730 HydrophobicContact CE1-CG2 3.58Å; C658-V730 WeakPolarHBondContact O-CG1 3.43Å; Y723-V730 CarbonylContact C-O 3.45Å; Y723-V730 VanDerWaalsContact CA-O 3.26Å; Y723-V730 WeakPolarHBondContact CA-O 3.44Å; Y723-V730 WeakPolarHBondContact CD1-O 3.22Å; S724-V730 PolarHBondContact N-O 3.23Å; S724-V730 WeakPolarHBondContact O-CA 2.92Å; S724-V730 VanDerWaalsContact O-CB 3.28Å; S724-V730 WeakPolarHBondContact O-CB 3.17Å; S724-V730 PolarHBondContact O-N 2.75Å; S724-V730 WeakPolarHBondContact OG-CB 3.06Å
731	A	75.1	Confident	63.2	Low	51 Å²	51	77.5 Å²	77.5	42%	0.421	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-59.8	145.6	176.4	0	0	0	0	0	111.7	Y723 V733	Y723-A731 HydrophobicContact CD1-CB 4.44Å; Y723-A731 HydrophobicContact CE1-CB 4.07Å; A731-V733 PolarHBondContact O-N 3.03Å
732	P	70.4	Confident	61.3	Low	51 Å²	51	76.1 Å²	76.1	33%	0.331	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-51.1	137.9	171.2	16.8	-27.6	0	0	0	109.6	G722 V734	G722-P732 WeakPolarHBondContact O-CA 3.35Å; G722-P732 WeakPolarHBondContact O-CB 3.11Å; P732-V734 VanDerWaalsContact C-N 3.28Å; P732-V734 PolarHBondContact O-N 2.02Å
733	V	63.8	Low	59.8	Low	97 Å²	97	76 Å²	76	59%	0.588	44%	0.437	S	S	*	.			trans	-64.2	104.9	158.1	-171.8	0	0	0	0	103.9	A731 G735	A731-V733 PolarHBondContact O-N 3.03Å; V733-G735 PolarHBondContact O-N 3.49Å
734	V	55.7	Low	58.3	Low	133 Å²	133	76.7 Å²	76.7	81%	0.806	45%	0.45	S	S	*	.			trans	-62.4	85.3	152.5	-176.1	0	0	0	0	102.8	P732 R736	P732-V734 VanDerWaalsContact C-N 3.28Å; P732-V734 PolarHBondContact O-N 2.02Å; V734-R736 PolarHBondContact O-N 2.69Å
735	G	45.9	Very low	57.4	Low	40 Å²	40	80 Å²	80	41%	0.412	46%	0.463	S	S	.	.			trans	-48.7	126.4	160.7	0	0	0	0	0	102.1	V733 S737	V733-G735 PolarHBondContact O-N 3.49Å; G735-S737 PolarHBondContact O-N 3.16Å
736	R	33.8	Very low	56.6	Low	244 Å²	244	84.1 Å²	84.1	92%	0.921	48%	0.483	S	S	*	.			trans	-44.5	101.2	145.6	-102.5	177.8	169.8	156.5	-2.3	102.5	V734 S738	V734-R736 PolarHBondContact O-N 2.69Å; R736-S738 PolarHBondContact O-N 3.01Å
737	S	32.4	Very low	55.9	Low	98 Å²	98	83 Å²	83	69%	0.685	49%	0.487	S	S	*	.			trans	-55.7	113.7	168.5	85.6	0	0	0	0	100	G735 G739	G735-S737 PolarHBondContact O-N 3.16Å; S737-G739 PolarHBondContact O-N 3.06Å; S737-G739 VanDerWaalsContact O-N 3.14Å
738	S	33.2	Very low	55.3	Low	86 Å²	86	87.3 Å²	87.3	60%	0.601	51%	0.51	S	S	*	.			trans	-25.6	123.7	159.2	48.9	0	0	0	0	107.3	R736 K740	R736-S738 PolarHBondContact O-N 3.01Å; S738-K740 VanDerWaalsContact C-N 3.3Å; S738-K740 PolarHBondContact O-N 2.9Å
739	G	41.3	Very low	55	Low	85 Å²	85	93.9 Å²	93.9	88%	0.876	54%	0.538	S	S	*	.	S	Bend	trans	-45.2	102.8	172.7	0	0	0	0	0	108.4	S737	S737-G739 PolarHBondContact O-N 3.06Å; S737-G739 VanDerWaalsContact O-N 3.14Å
740	K	32.6	Very low	54.7	Low	158 Å²	158	97.9 Å²	97.9	69%	0.687	56%	0.56	S	S	*	*			trans	-152.6	102.2	176	-105.5	-175	-175.7	-179.8	0	104.5	S738	S738-K740 VanDerWaalsContact C-N 3.3Å; S738-K740 PolarHBondContact O-N 2.9Å
741	W	31.8	Very low	54.6	Low	198 Å²	198	100.5 Å²	100.5	75%	0.75	58%	0.579	S	S	*	*			trans	75.2	53.3	169.2	-39.7	85.8	0	0	0	114.8	S743 P744	W741-S743 PolarHBondContact O-N 3.39Å; W741-P744 HydrophobicContact CE3-CG 4.24Å; W741-P744 HydrophobicContact CZ3-CG 4.27Å
742	S	38.2	Very low	55	Low	94 Å²	94	102.1 Å²	102.1	66%	0.657	58%	0.579	S	S	*	*	S	Bend		-50.8	107.5	125.4	47.2	0	0	0	0	104.7
743	S	44.2	Very low	55.4	Low	46 Å²	46	102.8 Å²	102.8	32%	0.322	58%	0.583	S	S	.	*			trans	-31.3	135.4	-168.2	-169.9	0	0	0	0	111.2	W741 L745 I746 G747	W741-S743 PolarHBondContact O-N 3.39Å; S743-L745 CarbonylContact O-C 3.58Å; S743-L745 PolarHBondContact O-N 3.39Å; S743-I746 PolarHBondContact O-N 3.18Å; S743-G747 PolarHBondContact O-N 3.18Å
744	P	51.2	Low	56.5	Low	79 Å²	79	105.1 Å²	105.1	51%	0.513	59%	0.585	S	S	.	*	H	α-helix	trans	-50.2	-26	177.4	18.8	-29.8	0	0	0	110.2	W741 G747 L748	W741-P744 HydrophobicContact CE3-CG 4.24Å; W741-P744 HydrophobicContact CZ3-CG 4.27Å; P744-G747 PolarHBondContact O-N 3.24Å; P744-L748 WeakPolarHBondContact O-CB 3.39Å; P744-L748 PolarHBondContact O-N 3.44Å
745	L	56.3	Low	57.8	Low	107 Å²	107	101.2 Å²	101.2	56%	0.56	57%	0.567	S	S	*	*	H	α-helix	trans	-54.9	-49.4	167.9	-61.7	171.9	0	0	0	114.4	S743 L748 F749	S743-L745 CarbonylContact O-C 3.58Å; S743-L745 PolarHBondContact O-N 3.39Å; L745-L748 PolarHBondContact O-N 3.46Å; L745-F749 VanDerWaalsContact O-CB 3.25Å; L745-F749 WeakPolarHBondContact O-CB 3.44Å; L745-F749 WeakPolarHBondContact O-CD2 3.38Å; L745-F749 PolarHBondContact O-N 2.84Å
746	I	63.2	Low	59.7	Low	93 Å²	93	102.9 Å²	102.9	48%	0.477	57%	0.569	S	S	.	*	H	α-helix	trans	-69.1	-40.6	-178.9	-57.5	171.2	0	0	0	110.8	S743 F749 L750	S743-I746 PolarHBondContact O-N 3.18Å; I746-F749 PolarHBondContact O-N 3.19Å; I746-L750 HydrophobicContact CG2-CD1 4.05Å; I746-L750 HydrophobicContact CG2-CG 4.42Å; I746-L750 WeakPolarHBondContact O-CB 3.04Å; I746-L750 VanDerWaalsContact O-CG 3.32Å; I746-L750 WeakPolarHBondContact O-CG 3.05Å; I746-L750 PolarHBondContact O-N 3.03Å
747	G	64.5	Low	62.1	Low	38 Å²	38	96 Å²	96	39%	0.392	55%	0.55	S	S	.	.	H	α-helix	trans	-66.4	-37.5	175	0	0	0	0	0	112.7	S743 P744 S751	S743-G747 PolarHBondContact O-N 3.18Å; P744-G747 PolarHBondContact O-N 3.24Å; G747-S751 VanDerWaalsContact O-CB 3.25Å; G747-S751 WeakPolarHBondContact O-CB 2.94Å; G747-S751 PolarHBondContact O-N 3.48Å; G747-S751 PolarHBondContact O-OG 2.59Å
748	L	75.6	Confident	64.4	Low	99 Å²	99	94.3 Å²	94.3	52%	0.518	54%	0.535	S	S	.	.	H	α-helix	trans	-70.7	-38.8	174	-158.2	102.7	0	0	0	111.1	P744 L745 S751 I752	P744-L748 WeakPolarHBondContact O-CB 3.39Å; P744-L748 PolarHBondContact O-N 3.44Å; L745-L748 PolarHBondContact O-N 3.46Å; L748-S751 WeakPolarHBondContact CA-OG 3.46Å; L748-S751 PolarHBondContact O-N 2.79Å; L748-S751 PolarHBondContact O-OG 3.07Å; L748-S751 VanDerWaalsContact O-OG 3.06Å; L748-I752 HydrophobicContact CD2-CD1 3.61Å; L748-I752 HydrophobicContact CG-CD1 3.81Å; L748-I752 HydrophobicContact CG-CG1 4.44Å; L748-I752 WeakPolarHBondContact O-CB 3.01Å; L748-I752 WeakPolarHBondContact O-CD1 3.18Å; L748-I752 WeakPolarHBondContact O-CG1 3.31Å; L748-I752 PolarHBondContact O-N 3.46Å
749	F	78.4	Confident	66.6	Low	138 Å²	138	93.9 Å²	93.9	61%	0.605	53%	0.532	S	S	*	.	H	α-helix	trans	-65.5	-46.4	174.6	-96.9	-77.8	0	0	0	110.5	L745 I746 S751 I752 T753	L745-F749 VanDerWaalsContact O-CB 3.25Å; L745-F749 WeakPolarHBondContact O-CB 3.44Å; L745-F749 WeakPolarHBondContact O-CD2 3.38Å; L745-F749 PolarHBondContact O-N 2.84Å; I746-F749 PolarHBondContact O-N 3.19Å; F749-S751 PolarHBondContact O-N 3.49Å; F749-I752 PolarHBondContact O-N 2.62Å; F749-T753 WeakPolarHBondContact O-CB 3.22Å; F749-T753 WeakPolarHBondContact O-CG2 3.46Å; F749-T753 PolarHBondContact O-N 3.26Å; F749-T753 PolarHBondContact O-OG1 2.85Å
750	L	80.4	Confident	68.4	Low	111 Å²	111	94.3 Å²	94.3	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-64.8	-40	177.2	-72.7	172.2	0	0	0	111.7	I746 T753 F754	I746-L750 HydrophobicContact CG2-CD1 4.05Å; I746-L750 HydrophobicContact CG2-CG 4.42Å; I746-L750 WeakPolarHBondContact O-CB 3.04Å; I746-L750 VanDerWaalsContact O-CG 3.32Å; I746-L750 WeakPolarHBondContact O-CG 3.05Å; I746-L750 PolarHBondContact O-N 3.03Å; L750-T753 VanDerWaalsContact CA-OG1 3.29Å; L750-T753 WeakPolarHBondContact CA-OG1 3.16Å; L750-T753 PolarHBondContact O-N 2.86Å; L750-T753 PolarHBondContact O-OG1 3.05Å; L750-F754 WeakPolarHBondContact O-CB 3.27Å; L750-F754 PolarHBondContact O-N 3.4Å
751	S	78	Confident	70.3	Confident	64 Å²	64	91.5 Å²	91.5	45%	0.448	51%	0.505	S	S	.	.	H	α-helix	trans	-70.6	-38.1	176.8	72.6	0	0	0	0	112.7	G747 L748 F749 F754 A755	G747-S751 VanDerWaalsContact O-CB 3.25Å; G747-S751 WeakPolarHBondContact O-CB 2.94Å; G747-S751 PolarHBondContact O-N 3.48Å; G747-S751 PolarHBondContact O-OG 2.59Å; L748-S751 WeakPolarHBondContact CA-OG 3.46Å; L748-S751 PolarHBondContact O-N 2.79Å; L748-S751 PolarHBondContact O-OG 3.07Å; L748-S751 VanDerWaalsContact O-OG 3.06Å; F749-S751 PolarHBondContact O-N 3.49Å; S751-F754 PolarHBondContact O-N 3.33Å; S751-A755 WeakPolarHBondContact O-CB 3.1Å; S751-A755 PolarHBondContact O-N 2.85Å
752	I	83.9	Confident	72.2	Confident	85 Å²	85	89.9 Å²	89.9	44%	0.436	50%	0.498	S	S	.	.	H	α-helix	trans	-66.9	-45	172.9	-70	165.5	0	0	0	109.7	L748 F749 F754 A755 V756	L748-I752 HydrophobicContact CD2-CD1 3.61Å; L748-I752 HydrophobicContact CG-CD1 3.81Å; L748-I752 HydrophobicContact CG-CG1 4.44Å; L748-I752 WeakPolarHBondContact O-CB 3.01Å; L748-I752 WeakPolarHBondContact O-CD1 3.18Å; L748-I752 WeakPolarHBondContact O-CG1 3.31Å; L748-I752 PolarHBondContact O-N 3.46Å; F749-I752 PolarHBondContact O-N 2.62Å; I752-F754 VanDerWaalsContact C-N 3.31Å; I752-F754 PolarHBondContact O-N 3.31Å; I752-A755 PolarHBondContact O-N 3.34Å; I752-V756 HydrophobicContact CG2-CG2 4.17Å; I752-V756 VanDerWaalsContact O-CB 3.32Å; I752-V756 WeakPolarHBondContact O-CB 3.14Å; I752-V756 WeakPolarHBondContact O-CG2 3.49Å; I752-V756 PolarHBondContact O-N 3.2Å
753	T	80	Confident	73.5	Confident	66 Å²	66	89.2 Å²	89.2	41%	0.405	49%	0.494	S	S	.	.	H	α-helix	trans	-64.4	-38	177.3	55.8	0	0	0	0	111.6	F749 L750 L757	F749-T753 WeakPolarHBondContact O-CB 3.22Å; F749-T753 WeakPolarHBondContact O-CG2 3.46Å; F749-T753 PolarHBondContact O-N 3.26Å; F749-T753 PolarHBondContact O-OG1 2.85Å; L750-T753 VanDerWaalsContact CA-OG1 3.29Å; L750-T753 WeakPolarHBondContact CA-OG1 3.16Å; L750-T753 PolarHBondContact O-N 2.86Å; L750-T753 PolarHBondContact O-OG1 3.05Å; T753-L757 VanDerWaalsContact O-CB 3.28Å; T753-L757 WeakPolarHBondContact O-CB 3.43Å; T753-L757 WeakPolarHBondContact O-CG 3.16Å; T753-L757 PolarHBondContact O-N 3.39Å
754	F	85.4	Confident	74.2	Confident	146 Å²	146	90.2 Å²	90.2	64%	0.64	50%	0.501	S	S	*	.	H	α-helix	trans	-69.6	-41.7	175.7	-172.2	-98.2	0	0	0	111.1	L750 S751 I752 L757 V758	L750-F754 WeakPolarHBondContact O-CB 3.27Å; L750-F754 PolarHBondContact O-N 3.4Å; S751-F754 PolarHBondContact O-N 3.33Å; I752-F754 VanDerWaalsContact C-N 3.31Å; I752-F754 PolarHBondContact O-N 3.31Å; F754-L757 PolarHBondContact O-N 2.97Å; F754-V758 HydrophobicContact CD1-CG2 3.97Å; F754-V758 HydrophobicContact CE1-CG2 3.65Å; F754-V758 HydrophobicContact CE2-CG2 4.49Å; F754-V758 HydrophobicContact CZ-CG2 3.94Å; F754-V758 WeakPolarHBondContact O-CB 3.39Å; F754-V758 VanDerWaalsContact O-CG2 3.22Å; F754-V758 WeakPolarHBondContact O-CG2 3.15Å; F754-V758 PolarHBondContact O-N 2.74Å
755	A	82.8	Confident	74.3	Confident	51 Å²	51	91.3 Å²	91.3	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-41.3	174.9	0	0	0	0	0	111.7	S751 I752 V758 C759	S751-A755 WeakPolarHBondContact O-CB 3.1Å; S751-A755 PolarHBondContact O-N 2.85Å; I752-A755 PolarHBondContact O-N 3.34Å; A755-V758 PolarHBondContact O-N 3.38Å; A755-C759 VanDerWaalsContact O-CB 3.31Å; A755-C759 WeakPolarHBondContact O-CB 3.31Å; A755-C759 PolarHBondContact O-N 3.11Å; A755-C759 PolarHBondContact O-SG 2.6Å
756	V	86.2	Confident	73.8	Confident	75 Å²	75	95.9 Å²	95.9	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-43.8	175.1	170.5	0	0	0	0	110.5	I752 C759 I760	I752-V756 HydrophobicContact CG2-CG2 4.17Å; I752-V756 VanDerWaalsContact O-CB 3.32Å; I752-V756 WeakPolarHBondContact O-CB 3.14Å; I752-V756 WeakPolarHBondContact O-CG2 3.49Å; I752-V756 PolarHBondContact O-N 3.2Å; V756-C759 PolarHBondContact O-N 3.49Å; V756-I760 HydrophobicContact CG1-CD1 3.66Å; V756-I760 HydrophobicContact CG1-CG1 4.31Å; V756-I760 WeakPolarHBondContact O-CB 3.31Å; V756-I760 WeakPolarHBondContact O-CG1 3.26Å; V756-I760 PolarHBondContact O-N 3.29Å
757	L	83.9	Confident	72.8	Confident	99 Å²	99	100.5 Å²	100.5	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-63.4	-42.5	175	-83.3	164.1	0	0	0	111.9	T753 F754 C759 I760 L761	T753-L757 VanDerWaalsContact O-CB 3.28Å; T753-L757 WeakPolarHBondContact O-CB 3.43Å; T753-L757 WeakPolarHBondContact O-CG 3.16Å; T753-L757 PolarHBondContact O-N 3.39Å; F754-L757 PolarHBondContact O-N 2.97Å; L757-C759 VanDerWaalsContact C-N 3.35Å; L757-I760 PolarHBondContact O-N 3.38Å; L757-L761 WeakPolarHBondContact O-CB 3Å; L757-L761 WeakPolarHBondContact O-CD1 3.1Å; L757-L761 VanDerWaalsContact O-CG 3.24Å; L757-L761 WeakPolarHBondContact O-CG 3.07Å; L757-L761 PolarHBondContact O-N 2.7Å
758	V	82.5	Confident	71.6	Confident	62 Å²	62	104.1 Å²	104.1	38%	0.376	54%	0.538	S	S	.	.	H	α-helix	trans	-64.1	-40.4	173.6	171.1	0	0	0	0	110.2	F754 A755 L761 W762	F754-V758 HydrophobicContact CD1-CG2 3.97Å; F754-V758 HydrophobicContact CE1-CG2 3.65Å; F754-V758 HydrophobicContact CE2-CG2 4.49Å; F754-V758 HydrophobicContact CZ-CG2 3.94Å; F754-V758 WeakPolarHBondContact O-CB 3.39Å; F754-V758 VanDerWaalsContact O-CG2 3.22Å; F754-V758 WeakPolarHBondContact O-CG2 3.15Å; F754-V758 PolarHBondContact O-N 2.74Å; A755-V758 PolarHBondContact O-N 3.38Å; V758-L761 PolarHBondContact O-N 3.05Å; V758-W762 WeakPolarHBondContact O-CA 3.48Å; V758-W762 WeakPolarHBondContact O-CB 3.29Å; V758-W762 PolarHBondContact O-N 3.07Å
759	C	78.7	Confident	69.6	Low	78 Å²	78	109.6 Å²	109.6	53%	0.527	56%	0.558	S	S	.	*	H	α-helix	trans	-67.3	-38.3	175.5	-75	0	0	0	0	112.6	A755 V756 L757 W762 S763	A755-C759 VanDerWaalsContact O-CB 3.31Å; A755-C759 WeakPolarHBondContact O-CB 3.31Å; A755-C759 PolarHBondContact O-N 3.11Å; A755-C759 PolarHBondContact O-SG 2.6Å; V756-C759 PolarHBondContact O-N 3.49Å; L757-C759 VanDerWaalsContact C-N 3.35Å; C759-W762 PolarHBondContact O-N 3.4Å; C759-S763 WeakPolarHBondContact O-CB 3.19Å; C759-S763 PolarHBondContact O-N 2.04Å
760	I	79.7	Confident	67.5	Low	93 Å²	93	111.7 Å²	111.7	48%	0.477	57%	0.567	S	S	.	*	H	α-helix	trans	-67.5	-44.7	174.8	-69.1	165.8	0	0	0	109.8	V756 L757 W762 S763 S764	V756-I760 HydrophobicContact CG1-CD1 3.66Å; V756-I760 HydrophobicContact CG1-CG1 4.31Å; V756-I760 WeakPolarHBondContact O-CB 3.31Å; V756-I760 WeakPolarHBondContact O-CG1 3.26Å; V756-I760 PolarHBondContact O-N 3.29Å; L757-I760 PolarHBondContact O-N 3.38Å; I760-W762 VanDerWaalsContact C-N 3.35Å; I760-S763 PolarHBondContact O-N 3.48Å; I760-S764 VanDerWaalsContact O-CB 3.25Å; I760-S764 WeakPolarHBondContact O-CB 3.25Å; I760-S764 PolarHBondContact O-N 3.5Å; I760-S764 PolarHBondContact O-OG 2.84Å
761	L	72.5	Confident	65.4	Low	99 Å²	99	111.1 Å²	111.1	52%	0.518	57%	0.572	S	S	.	*	H	α-helix	trans	-63.3	-41.4	174.7	-77.9	163.5	0	0	0	110.6	L757 V758 S764 L765	L757-L761 WeakPolarHBondContact O-CB 3Å; L757-L761 WeakPolarHBondContact O-CD1 3.1Å; L757-L761 VanDerWaalsContact O-CG 3.24Å; L757-L761 WeakPolarHBondContact O-CG 3.07Å; L757-L761 PolarHBondContact O-N 2.7Å; V758-L761 PolarHBondContact O-N 3.05Å; L761-S764 CarbonylContact O-C 3.41Å; L761-S764 PolarHBondContact O-N 3.15Å; L761-L765 HydrophobicContact CB-CD1 4.38Å; L761-L765 WeakPolarHBondContact O-CB 3.43Å; L761-L765 VanDerWaalsContact O-CD1 3.26Å; L761-L765 WeakPolarHBondContact O-CD1 3.37Å; L761-L765 WeakPolarHBondContact O-CG 3.46Å; L761-L765 PolarHBondContact O-N 2.01Å
762	W	71.1	Confident	63.1	Low	164 Å²	164	117 Å²	117	62%	0.621	59%	0.593	S	S	*	*	H	α-helix	trans	-73.5	-34.5	-179.4	-156.5	35.3	0	0	0	112.1	V758 C759 I760 L765 R766	V758-W762 WeakPolarHBondContact O-CA 3.48Å; V758-W762 WeakPolarHBondContact O-CB 3.29Å; V758-W762 PolarHBondContact O-N 3.07Å; C759-W762 PolarHBondContact O-N 3.4Å; I760-W762 VanDerWaalsContact C-N 3.35Å; W762-L765 PolarHBondContact O-N 3.49Å; W762-R766 WeakPolarHBondContact O-CB 3.29Å; W762-R766 WeakPolarHBondContact O-CG 3.27Å; W762-R766 PolarHBondContact O-N 3.5Å
763	S	64.6	Low	60.9	Low	80 Å²	80	118.1 Å²	118.1	56%	0.559	61%	0.606	S	S	*	*	H	α-helix	trans	-68.1	-36.6	170.3	-170.1	0	0	0	0	111.6	C759 I760	C759-S763 WeakPolarHBondContact O-CB 3.19Å; C759-S763 PolarHBondContact O-N 2.04Å; I760-S763 PolarHBondContact O-N 3.48Å
764	S	58.9	Low	58.7	Low	68 Å²	68	122.5 Å²	122.5	48%	0.476	63%	0.626	S	S	.	*	H	α-helix	trans	-73.3	-36.2	174.4	-57.7	0	0	0	0	112.1	I760 L761 K767	I760-S764 VanDerWaalsContact O-CB 3.25Å; I760-S764 WeakPolarHBondContact O-CB 3.25Å; I760-S764 PolarHBondContact O-N 3.5Å; I760-S764 PolarHBondContact O-OG 2.84Å; L761-S764 CarbonylContact O-C 3.41Å; L761-S764 PolarHBondContact O-N 3.15Å; S764-K767 PolarHBondContact O-N 3.19Å
765	L	53.2	Low	56.3	Low	102 Å²	102	122.9 Å²	122.9	53%	0.534	63%	0.634	S	S	.	*	H	α-helix	trans	-75.2	-25.5	177.1	-76.3	158	0	0	0	112	L761 W762 K767 L768	L761-L765 HydrophobicContact CB-CD1 4.38Å; L761-L765 WeakPolarHBondContact O-CB 3.43Å; L761-L765 VanDerWaalsContact O-CD1 3.26Å; L761-L765 WeakPolarHBondContact O-CD1 3.37Å; L761-L765 WeakPolarHBondContact O-CG 3.46Å; L761-L765 PolarHBondContact O-N 2.01Å; W762-L765 PolarHBondContact O-N 3.49Å; L765-K767 PolarHBondContact O-N 3.2Å; L765-K767 VanDerWaalsContact O-N 3.13Å; L765-L768 PolarHBondContact O-N 2.82Å
766	R	46.3	Very low	54.2	Low	202 Å²	202	123.2 Å²	123.2	76%	0.762	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-17.7	168.4	-90.1	-173.1	-177.4	-164.9	1	113.2	W762	W762-R766 WeakPolarHBondContact O-CB 3.29Å; W762-R766 WeakPolarHBondContact O-CG 3.27Å; W762-R766 PolarHBondContact O-N 3.5Å
767	K	42	Very low	52.2	Low	190 Å²	190	126.4 Å²	126.4	83%	0.826	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-1.7	173.5	-71.1	-169.9	176.9	-177.5	0	114.2	S764 L765	S764-K767 PolarHBondContact O-N 3.19Å; L765-K767 PolarHBondContact O-N 3.2Å; L765-K767 VanDerWaalsContact O-N 3.13Å
768	L	39.3	Very low	49.8	Very low	115 Å²	115	128 Å²	128	60%	0.602	66%	0.663	S	S	*	*			trans	-118.4	96.3	179.3	-78.1	153.7	0	0	0	109.5	L765 F770	L765-L768 PolarHBondContact O-N 2.82Å; L768-F770 VanDerWaalsContact C-N 3.34Å; L768-F770 PolarHBondContact O-N 3.18Å
769	K	33.2	Very low	47.7	Very low	213 Å²	213	128.7 Å²	128.7	93%	0.926	68%	0.675	S	S	*	*			trans	-57.6	98.3	160.2	-76.5	179.9	175.2	180	0	107.6
770	F	35.7	Very low	45.8	Very low	182 Å²	182	129.2 Å²	129.2	80%	0.798	68%	0.676	S	S	*	*			trans	-132.5	121.6	164	-112.7	-89.2	0	0	0	109.8	L768	L768-F770 VanDerWaalsContact C-N 3.34Å; L768-F770 PolarHBondContact O-N 3.18Å
771	S	35.2	Very low	43.5	Very low	99 Å²	99	132.9 Å²	132.9	69%	0.692	69%	0.689	S	S	*	*			trans	-56.3	141.7	175.4	49.8	0	0	0	0	112.4
772	E	29.2	Very low	41.6	Very low	187 Å²	187	134.5 Å²	134.5	87%	0.874	70%	0.697	S	S	*	*			trans	-46.2	142	148.2	-68.7	175.6	145.9	0	0	109.4
773	P	39.1	Very low	39.7	Very low	109 Å²	109	137 Å²	137	71%	0.708	71%	0.706	S	S	*	*			cis	-144.1	-175.2	48.7	34.5	-11.9	0	0	0	115.1
774	L	32.3	Very low	38.1	Very low	159 Å²	159	143.6 Å²	143.6	83%	0.832	72%	0.719	S	S	*	*			trans	89.6	76.9	165.4	-58.7	164.9	0	0	0	117.7
775	L	35.7	Very low	36.7	Very low	153 Å²	153	147.8 Å²	147.8	80%	0.801	74%	0.735	S	S	*	*			trans	-143.7	33.1	149	-110.7	153.5	0	0	0	112.9	N777 M778	L775-N777 VanDerWaalsContact C-N 3.3Å; L775-N777 PolarHBondContact O-N 2.02Å; L775-M778 HydrophobicContact CD2-CB 4.46Å
776	G	38.2	Very low	35.8	Very low	59 Å²	59	147.6 Å²	147.6	61%	0.608	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-0.5	174.2	0	0	0	0	0	115.9
777	N	44.5	Very low	34.8	Very low	141 Å²	141	148.5 Å²	148.5	75%	0.754	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.4	9.2	-168.6	-86.1	-9.6	0	0	0	117.4	L775	L775-N777 VanDerWaalsContact C-N 3.3Å; L775-N777 PolarHBondContact O-N 2.02Å
778	M	34.9	Very low	34.2	Very low	134 Å²	134	143 Å²	143	66%	0.66	74%	0.743	S	S	*	*	S	Bend	trans	-105.1	-27.9	174.7	-120.2	176.3	180	0	0	114.6	L775 T780	L775-M778 HydrophobicContact CD2-CB 4.46Å; M778-T780 PolarHBondContact O-N 3.21Å
779	A	38.4	Very low	33.6	Very low	76 Å²	76	144.5 Å²	144.5	63%	0.628	75%	0.752	S	S	*	*	H	α-helix	trans	-73.5	-26.4	179.2	0	0	0	0	0	113.5
780	T	36.9	Very low	33.4	Very low	89 Å²	89	141 Å²	141	55%	0.546	75%	0.748	S	S	.	*	H	α-helix	trans	-83	-20.4	180	-30.6	0	0	0	0	112.7	M778	M778-T780 PolarHBondContact O-N 3.21Å
781	K	33.2	Very low	33.1	Very low	169 Å²	169	136.1 Å²	136.1	74%	0.735	74%	0.736	S	S	*	*	H	α-helix	trans	-84.3	-32.9	178.5	-120	175.3	-179.3	-179.3	0	112.9
782	L	32	Very low	33	Very low	133 Å²	133	139.9 Å²	139.9	70%	0.696	74%	0.743	S	S	*	*	H	α-helix	trans	-79.8	-18	176.8	-83.6	153.4	0	0	0	114.1
783	R	31.6	Very low	33.1	Very low	216 Å²	216	137.1 Å²	137.1	82%	0.815	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-6.4	174.7	-85.4	-174.4	178.5	180	1.2	115.2
784	R	30.2	Very low	32.6	Very low	220 Å²	220	137.4 Å²	137.4	83%	0.83	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-3.7	176.6	-75.7	-168.7	-174.5	-175.5	2.4	114.8
785	L	30.2	Very low	32.6	Very low	155 Å²	155	135.4 Å²	135.4	81%	0.812	73%	0.732	S	S	*	*	S	Bend	trans	-98.9	0.6	-177.5	-84.8	155.6	0	0	0	115.2
786	S	32.9	Very low	32.1	Very low	99 Å²	99	139.1 Å²	139.1	69%	0.692	74%	0.735	S	S	*	*	S	Bend	trans	-120.9	19.9	-176.5	67.6	0	0	0	0	116.3
787	R	26.9	Very low	31.6	Very low	221 Å²	221	143.3 Å²	143.3	83%	0.834	74%	0.743	S	S	*	*			trans	-135.4	62.6	170.4	-76.1	-173.3	174.1	170.9	-2.7	112.2	N789	R787-N789 VanDerWaalsContact C-N 3.34Å; R787-N789 PolarHBondContact O-N 3.37Å
788	G	27.9	Very low	30.8	Very low	74 Å²	74	142.7 Å²	142.7	76%	0.763	74%	0.744	S	S	*	*			trans	-85.1	82.9	152.4	0	0	0	0	0	107.9	V790	G788-V790 PolarHBondContact O-N 3.3Å
789	N	27.5	Very low	30.6	Very low	146 Å²	146	142.8 Å²	142.8	78%	0.781	75%	0.752	S	S	*	*			trans	-66.2	112.3	170.7	-85.6	-2.4	0	0	0	107.9	R787 S791	R787-N789 VanDerWaalsContact C-N 3.34Å; R787-N789 PolarHBondContact O-N 3.37Å; N789-S791 VanDerWaalsContact C-N 3.33Å; N789-S791 PolarHBondContact O-N 2.94Å
790	V	28.9	Very low	30.1	Very low	140 Å²	140	142.1 Å²	142.1	85%	0.848	75%	0.753	S	S	*	*			trans	-70.5	94	163.8	179.7	0	0	0	0	106.4	G788 Q792	G788-V790 PolarHBondContact O-N 3.3Å; V790-Q792 PolarHBondContact O-N 3.23Å
791	S	29.9	Very low	29.7	Very low	79 Å²	79	145.4 Å²	145.4	55%	0.552	77%	0.767	S	S	*	*			trans	-78.8	111.2	168.6	-170.3	0	0	0	0	108	N789 D793	N789-S791 VanDerWaalsContact C-N 3.33Å; N789-S791 PolarHBondContact O-N 2.94Å; S791-D793 PolarHBondContact O-N 3.15Å; S791-D793 PolarHBondContact OG-OD2 3.03Å
792	Q	32.2	Very low	29.7	Very low	179 Å²	179	149 Å²	149	84%	0.836	78%	0.776	S	S	*	*			trans	-74.8	71.7	164.5	-76.2	179.5	-35.3	0	0	108.8	V790 C794	V790-Q792 PolarHBondContact O-N 3.23Å; Q792-C794 PolarHBondContact O-N 2.79Å
793	D	31	Very low	29.9	Very low	129 Å²	129	146.8 Å²	146.8	69%	0.69	77%	0.772	S	S	*	*			trans	-85.1	96.8	167.5	-79.5	-48.8	0	0	0	108.7	S791 V795	S791-D793 PolarHBondContact O-N 3.15Å; S791-D793 PolarHBondContact OG-OD2 3.03Å; D793-V795 PolarHBondContact O-N 3.45Å
794	C	30.5	Very low	29.7	Very low	114 Å²	114	144.2 Å²	144.2	77%	0.77	77%	0.774	S	S	*	*			trans	-66.5	97.3	168.6	-62.5	0	0	0	0	108.9	Q792 R796	Q792-C794 PolarHBondContact O-N 2.79Å; C794-R796 PolarHBondContact O-N 3.48Å
795	V	30.3	Very low	29.7	Very low	117 Å²	117	138.1 Å²	138.1	71%	0.709	78%	0.779	S	S	*	*			trans	-78.7	120.7	176.3	-177.3	0	0	0	0	109.6	D793 L797	D793-V795 PolarHBondContact O-N 3.45Å; V795-L797 PolarHBondContact O-N 3.29Å
796	R	26.7	Very low	29.7	Very low	231 Å²	231	133.7 Å²	133.7	87%	0.872	77%	0.771	S	S	*	*			trans	-65.9	106	167.8	-107.9	-179.2	176.3	134.8	-0.1	108.8	C794 T798	C794-R796 PolarHBondContact O-N 3.48Å; R796-T798 PolarHBondContact O-N 3.45Å
797	L	26.4	Very low	29.7	Very low	147 Å²	147	136 Å²	136	77%	0.77	78%	0.781	S	S	*	*			trans	-85.4	103.1	164.7	-72	168.4	0	0	0	108.2	V795 T799	V795-L797 PolarHBondContact O-N 3.29Å; L797-T799 PolarHBondContact O-N 2.03Å
798	T	27.8	Very low	30	Very low	129 Å²	129	131.8 Å²	131.8	79%	0.791	78%	0.78	S	S	*	*			trans	-84.7	86.7	161.4	52.2	0	0	0	0	107.4	R796 G800	R796-T798 PolarHBondContact O-N 3.45Å; T798-G800 PolarHBondContact O-N 2.75Å
799	T	30.6	Very low	30	Very low	135 Å²	135	134.6 Å²	134.6	83%	0.828	78%	0.777	S	S	*	*			trans	-78.1	96.9	166.9	51.2	0	0	0	0	107.7	L797	L797-T799 PolarHBondContact O-N 2.03Å
800	G	29.4	Very low	30.3	Very low	62 Å²	62	133 Å²	133	64%	0.639	78%	0.775	S	S	*	*			trans	-158.6	77.1	177.5	0	0	0	0	0	108.6	T798 R802	T798-G800 PolarHBondContact O-N 2.75Å; G800-R802 PolarHBondContact O-N 2.88Å
801	D	28.8	Very low	30.4	Very low	159 Å²	159	133.2 Å²	133.2	85%	0.85	77%	0.771	S	S	*	*			trans	-62.7	131.7	169.1	-146	-6	0	0	0	108.8	S803	D801-S803 PolarHBondContact O-N 2.84Å; D801-S803 VanDerWaalsContact O-N 3.16Å
802	R	31.4	Very low	30.5	Very low	245 Å²	245	140 Å²	140	93%	0.925	79%	0.785	S	S	*	*	S	Bend	trans	-84.3	82.6	-175.6	-88.4	178.5	164.7	172.3	-4	109.4	G800	G800-R802 PolarHBondContact O-N 2.88Å
803	S	36.4	Very low	30.3	Very low	86 Å²	86	140.2 Å²	140.2	60%	0.601	79%	0.787	S	S	*	*			trans	-167.3	74.4	167	43.2	0	0	0	0	112.3	D801	D801-S803 PolarHBondContact O-N 2.84Å; D801-S803 VanDerWaalsContact O-N 3.16Å
804	N	28.9	Very low	30.5	Very low	162 Å²	162	141.1 Å²	141.1	87%	0.866	79%	0.787	S	S	*	*	S	Bend	trans	145	89.6	147.8	-76.9	-18	0	0	0	111.4	G806	N804-G806 PolarHBondContact O-N 3.13Å
805	G	28.9	Very low	30.4	Very low	91 Å²	91	144.7 Å²	144.7	94%	0.938	79%	0.789	S	S	*	*			trans	44.9	3	141.7	0	0	0	0	0	123.9
806	G	30.6	Very low	30.6	Very low	62 Å²	62	145.4 Å²	145.4	64%	0.639	78%	0.784	S	S	*	*			trans	-84.1	120.7	-175.2	0	0	0	0	0	113.1	N804 V808	N804-G806 PolarHBondContact O-N 3.13Å; G806-V808 PolarHBondContact O-N 3.08Å
807	V	32.7	Very low	30.6	Very low	147 Å²	147	139.7 Å²	139.7	89%	0.891	78%	0.778	S	S	*	*			trans	-71.3	105.7	171.3	178.5	0	0	0	0	108.8
808	V	33.6	Very low	30.9	Very low	134 Å²	134	141.3 Å²	141.3	81%	0.812	78%	0.78	S	S	*	*			trans	-82	117.3	174.6	-177.7	0	0	0	0	109.2	G806	G806-V808 PolarHBondContact O-N 3.08Å
809	N	27.8	Very low	31.1	Very low	132 Å²	132	142.7 Å²	142.7	71%	0.706	78%	0.781	S	S	*	*			trans	-79.9	118.2	179.9	-158.6	-3.6	0	0	0	110	L811	N809-L811 PolarHBondContact O-N 3.23Å
810	P	34.6	Very low	31	Very low	114 Å²	114	148 Å²	148	74%	0.74	79%	0.785	S	S	*	*			trans	-91.8	82.4	-171.2	34.9	-31.6	0	0	0	111
811	L	29.3	Very low	31.1	Very low	144 Å²	144	150.8 Å²	150.8	75%	0.754	79%	0.79	S	S	*	*			trans	-129.6	3.1	171.4	-89.4	166.4	0	0	0	115.4	N809	N809-L811 PolarHBondContact O-N 3.23Å
812	Y	33.1	Very low	31.3	Very low	221 Å²	221	149.1 Å²	149.1	87%	0.867	79%	0.786	S	S	*	*			trans	-129.8	102.5	174.5	-82.4	-90.3	0	0	0	110.7
813	E	28.6	Very low	31.4	Very low	184 Å²	184	143.3 Å²	143.3	86%	0.86	78%	0.78	S	S	*	*			trans	-103.8	92	167	-80.9	-170	162.6	0	0	108.6
814	E	33.4	Very low	31.4	Very low	148 Å²	148	145.8 Å²	145.8	69%	0.692	79%	0.791	S	S	*	*			trans	-90.9	119.5	167.2	-76.1	-171.5	156.5	0	0	110.3	H816	E814-H816 PolarHBondContact O-N 2.9Å; E814-H816 IonicContact OE2-NE2 3.45Å
815	K	29.3	Very low	31.5	Very low	188 Å²	188	146.3 Å²	146.3	82%	0.817	79%	0.788	S	S	*	*			trans	-88.8	96.7	178.1	-71	179.3	-178.7	172.6	0	109.6
816	H	33.3	Very low	31.7	Very low	132 Å²	132	147 Å²	147	61%	0.611	78%	0.779	S	S	*	*			trans	-87.7	119.1	167.9	-65.8	-78	0	0	0	110.7	E814 F818	E814-H816 PolarHBondContact O-N 2.9Å; E814-H816 IonicContact OE2-NE2 3.45Å; H816-F818 HydrophobicContact CB-CD2 4.16Å; H816-F818 HydrophobicContact CB-CE2 3.45Å; H816-F818 VanDerWaalsContact CB-CE2 3.45Å; H816-F818 HydrophobicContact CB-CZ 3.93Å
817	C	28.6	Very low	31.8	Very low	111 Å²	111	154.2 Å²	154.2	75%	0.75	79%	0.788	S	S	*	*			trans	-95	113.9	171.2	-70.1	0	0	0	0	109.2
818	F	32.4	Very low	31.9	Very low	182 Å²	182	154 Å²	154	80%	0.798	78%	0.782	S	S	*	*			trans	-103.3	135.8	174	-65.6	-81.2	0	0	0	111.1	H816	H816-F818 HydrophobicContact CB-CD2 4.16Å; H816-F818 HydrophobicContact CB-CE2 3.45Å; H816-F818 VanDerWaalsContact CB-CE2 3.45Å; H816-F818 HydrophobicContact CB-CZ 3.93Å
819	I	31.3	Very low	31.9	Very low	158 Å²	158	153.1 Å²	153.1	81%	0.81	78%	0.782	S	S	*	*			trans	-87.1	108.4	175.7	-62	165.1	0	0	0	107.5	T821	I819-T821 HydrophobicContact CG2-CG2 4.32Å; I819-T821 PolarHBondContact O-N 2.67Å
820	R	27.9	Very low	32.2	Very low	246 Å²	246	151.1 Å²	151.1	93%	0.928	79%	0.793	S	S	*	*			trans	-76	108.6	168.5	-102	-176	177.7	178.9	-0.7	109.4
821	T	31.6	Very low	32.1	Very low	121 Å²	121	150.3 Å²	150.3	74%	0.742	80%	0.795	S	S	*	*			trans	-85.4	115.9	164.3	52.5	0	0	0	0	108.7	I819	I819-T821 HydrophobicContact CG2-CG2 4.32Å; I819-T821 PolarHBondContact O-N 2.67Å
822	T	34	Very low	32.4	Very low	123 Å²	123	150 Å²	150	76%	0.755	80%	0.8	S	S	*	*			trans	-69.5	129.5	169.3	47.5	0	0	0	0	109.2	V824	T822-V824 PolarHBondContact O-N 3.09Å
823	P	32.3	Very low	32.3	Very low	123 Å²	123	144.3 Å²	144.3	80%	0.799	79%	0.793	S	S	*	*			trans	-62.3	131.8	174.4	-13.6	26.4	0	0	0	109.6	E825	P823-E825 PolarHBondContact O-N 2.81Å
824	V	37.4	Very low	32.5	Very low	139 Å²	139	141.7 Å²	141.7	84%	0.842	79%	0.789	S	S	*	*			trans	-71.4	113.3	168.9	177.6	0	0	0	0	106.5	T822 S826	T822-V824 PolarHBondContact O-N 3.09Å; V824-S826 PolarHBondContact O-N 2.89Å
825	E	30.8	Very low	32.3	Very low	172 Å²	172	143.8 Å²	143.8	80%	0.804	80%	0.796	S	S	*	*			trans	-57.9	103.9	170.1	-76.2	-178.8	159	0	0	109	P823 Y827	P823-E825 PolarHBondContact O-N 2.81Å; E825-Y827 PolarHBondContact O-N 2.88Å
826	S	33.3	Very low	32.2	Very low	106 Å²	106	144 Å²	144	74%	0.741	80%	0.8	S	S	*	*			trans	-73.3	111.2	163.9	54.3	0	0	0	0	108.3	V824 D828	V824-S826 PolarHBondContact O-N 2.89Å; S826-D828 VanDerWaalsContact C-N 3.25Å; S826-D828 PolarHBondContact O-N 2.83Å
827	Y	33.4	Very low	32.2	Very low	213 Å²	213	146 Å²	146	84%	0.835	84%	0.84	S	S	*	*	S	Bend	trans	-66.1	88.5	158.2	-92.2	-93.1	0	0	0	108.5	E825	E825-Y827 PolarHBondContact O-N 2.88Å
828	D	33.5	Very low	32.4	Very low	142 Å²	142	147.8 Å²	147.8	76%	0.759	84%	0.844	S	S	*	*	S	Bend		163.8	128.6	127.8	-93.4	-25.8	0	0	0	111.9	S826	S826-D828 VanDerWaalsContact C-N 3.25Å; S826-D828 PolarHBondContact O-N 2.83Å
829	S	34.8	Very low	32.4	Very low	117 Å²	117	146 Å²	146	82%	0.818	85%	0.847	S	S	*	*	S	Bend	trans	67.1	84.3	169.1	61.7	0	0	0	0	120	A831	S829-A831 PolarHBondContact O-N 3.03Å
830	G	32.9	Very low	32.4	Very low	90 Å²	90	145.3 Å²	145.3	93%	0.928	85%	0.849	S	S	*	*				47	69.6	129.1	0	0	0	0	0	120.7
831	A	33.6	Very low	32.7	Very low	96 Å²	96	139.4 Å²	139.4	79%	0.793	84%	0.844	S	S	*	*			trans	-157.8	96.2	151.2	0	0	0	0	0	109.8	S829 S833	S829-A831 PolarHBondContact O-N 3.03Å; A831-S833 PolarHBondContact O-N 2.93Å
832	T	34	Very low	32.8	Very low	139 Å²	139	140.6 Å²	140.6	85%	0.853	85%	0.85	S	S	*	*			trans	-83.7	96.5	169.7	43.1	0	0	0	0	108.9	T834	T832-T834 PolarHBondContact O-N 3.12Å
833	S	32.3	Very low	32.7	Very low	101 Å²	101	141.7 Å²	141.7	71%	0.706	86%	0.857	S	S	*	*			trans	-84.7	102.7	162.4	65.3	0	0	0	0	108.6	A831 F835	A831-S833 PolarHBondContact O-N 2.93Å; S833-F835 PolarHBondContact O-N 2.75Å
834	T	32	Very low	32.7	Very low	129 Å²	129	143.1 Å²	143.1	79%	0.791	86%	0.861	S	S	*	*			trans	-67.2	112	165.5	40.6	0	0	0	0	109	T832	T832-T834 PolarHBondContact O-N 3.12Å
835	F	29	Very low	32.4	Very low	192 Å²	192	143.4 Å²	143.4	84%	0.842	86%	0.862	S	S	*	*			trans	-93	108.6	158.8	-96.1	-87.9	0	0	0	107.3	S833	S833-F835 PolarHBondContact O-N 2.75Å
836	E	28.2	Very low	32.5	Very low	193 Å²	193	141 Å²	141	90%	0.902	87%	0.867	S	S	*	*			trans	-73.3	133.9	160.8	-75.1	-177.8	151.7	0	0	108
837	A	32.7	Very low	32.4	Very low	174 Å²	174	144.2 Å²	144.2	100%	1.438	88%	0.879	S	S	*	*			trans	-122.8	0	-177.9	0	0	0	0	0	110.3

Retrieved 837 of 837 residues in 1643.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).