A0A3Q0KRU4_SCHMA Loading...

Groucho-related

AlphaFold DB , UniProt , Accession A0A3Q0KRU4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 985 aa.

						>A0A3Q0KRU4_SCHMA|A0A3Q0KRU4
MFPSRPPGPSGPGGSCKFTVLETCDRIKEEFTCIQQQNHSLQLEREKLLSERSDMQRICVMYYEMANGLNLEMHRQMEIAKRLSAILTQVLPFLSQEHQSQVLSAIERAKQVTMQELNSVLAAQIEDVKSSKFFNGNNMGLPLEQFEAYKQLSVIGGANPGVSGLHASNLTSNHSGGSTSSSTPGSLQSGSANAQTSSLLPSLSPSGNPSVSAALLNGLMSAAGAASVGPGALMLQSSGSRISPLGREAEKLMSNEDKQRAAAAAAAAAGSFLLSNRSSGNGPCLVPPPPNPITGLLGGCGEFPGFPGTFPISAGLGGGDIGRSPSSLPSISQQPCRGSSTDDAGGPGGRSSNSGGIQLGSNFSGLPHSSLSALANPLLLPPPMTPTPGGNLGLSSSTPTSGSVMDEKRRKLNEPKEGGHENGNWRMNDDMRSVPERGSSLGGTGRRSGSNRQPLNLSPQLSSGHNTTYPTTSSAPAVGTANSNSGRPSQASEVPASTRWKQSSKNVQSGPGAYSFIVLPNGQTRPCALASAPGATTAQGLPRRLQHLASLPHGDVVCAVTLGPCPVGRASSLASADTCLGSRNAGSDTDSVTVGSPGSNHTTSIPAHFAYTGARGSVKLWDLASISANSGNTPLANRDITPLATFDCLCYDSYVRSIKLFPDVSGLIVGGESNALTVWDLNGPGRRKAELTFEAPACYALALSLDGKLAYSCCSDGQVAVWDIHNQSIVHQFHGHVDGTSCVEITGDGNRLWTGGLDHKVRCWDIRGNPSRDVYHIEFKSQVFSLGLSSHMVPTRRQAESVSPVSVDGESTSSGGAGAGGGTRDTASPQSFVSGSNKSLSIESWLAVGLESSEVEVLAIGPDGPPASAFPVNYNVPREESGSGSGNPSPISHHTGSNQPQHFRLTHHESCVLALRFAHHADWFLTTGKDHQVNAWRTPYGACLLETKEAASVLTCDISLDDKFVVTGSGDKRANLYEVIFTPQR
					

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(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	37.4	Very low	41.3	Very low	238 Å²	238	131.4 Å²	131.4	100%	1.172	78%	0.775	S	S	*	*				0	91.1	0	-171.1	168	-178.5	0	0	107.5
2	F	34.4	Very low	41.5	Very low	202 Å²	202	131.8 Å²	131.8	89%	0.886	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-82.7	129.2	-178.5	-78.6	-81.4	0	0	0	110.1
3	P	47.7	Very low	41.1	Very low	108 Å²	108	128.2 Å²	128.2	70%	0.701	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.2	145.8	172	28.4	-33.2	0	0	0	110.4	R5	P3-R5 PolarHBondContact O-N 3.27Å
4	S	41.3	Very low	40.6	Very low	118 Å²	118	123.8 Å²	123.8	83%	0.825	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66	130.3	-170.2	45.2	0	0	0	0	113.4
5	R	37.7	Very low	40.7	Very low	234 Å²	234	123.3 Å²	123.3	88%	0.883	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-51.1	133.4	173.7	-170.6	-175.4	-167.1	-153.7	6.2	111.2	P3	P3-R5 PolarHBondContact O-N 3.27Å
6	P	42.4	Very low	40.5	Very low	109 Å²	109	123.3 Å²	123.3	71%	0.708	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-65.9	143.5	-176.4	25.6	-34.4	0	0	0	112.5	G8	P6-G8 PolarHBondContact O-N 2.75Å
7	P	42.5	Very low	40.7	Very low	111 Å²	111	126.7 Å²	126.7	72%	0.721	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.4	121.6	-173.1	29.5	-34.7	0	0	0	112.6
8	G	42.4	Very low	41.4	Very low	58 Å²	58	127.7 Å²	127.7	60%	0.598	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-56.2	147.2	179.3	0	0	0	0	0	113.9	P6 S10 R409	P6-G8 PolarHBondContact O-N 2.75Å; G8-S10 PolarHBondContact O-N 3.1Å; G8-S10 VanDerWaalsContact O-N 3.11Å; G8-R409 PolarHBondContact O-NH2 2.62Å
9	P	45.2	Very low	42.7	Very low	127 Å²	127	124.1 Å²	124.1	83%	0.825	76%	0.758	S	S	*	*			trans	-76.4	97.6	-170.4	30.1	-35.4	0	0	0	113.5	G11	P9-G11 PolarHBondContact O-N 3.05Å
10	S	36.3	Very low	44.2	Very low	73 Å²	73	123.6 Å²	123.6	51%	0.51	76%	0.755	S	S	.	*			trans	-76.8	117.8	166.7	69.8	0	0	0	0	111.6	G8 R409	G8-S10 PolarHBondContact O-N 3.1Å; G8-S10 VanDerWaalsContact O-N 3.11Å; S10-R409 PolarHBondContact O-NH1 3.18Å; S10-R409 PolarHBondContact OG-NE 3.06Å; S10-R409 PolarHBondContact OG-NH1 2.7Å; S10-R409 VanDerWaalsContact OG-NH1 3.09Å
11	G	47.1	Very low	45.9	Very low	67 Å²	67	123.8 Å²	123.8	69%	0.691	75%	0.751	S	S	*	*			trans	175.8	122.7	170.6	0	0	0	0	0	111.9	P9	P9-G11 PolarHBondContact O-N 3.05Å
12	P	43.2	Very low	47.9	Very low	136 Å²	136	118.1 Å²	118.1	88%	0.883	72%	0.721	S	S	*	*			trans	-84.9	150.5	177.2	34.4	-33.9	0	0	0	111.7
13	G	36.3	Very low	50.1	Low	86 Å²	86	110.2 Å²	110.2	89%	0.887	69%	0.69	S	S	*	*			trans	91.4	97.2	173.2	0	0	0	0	0	113.9
14	G	34.8	Very low	51.8	Low	66 Å²	66	107.9 Å²	107.9	68%	0.68	68%	0.675	S	S	*	*	S	Bend	trans	156.3	120.4	178.6	0	0	0	0	0	109	C16	G14-C16 PolarHBondContact O-N 3.31Å; G14-C16 VanDerWaalsContact O-N 3.15Å
15	S	41.8	Very low	53.9	Low	117 Å²	117	105.2 Å²	105.2	82%	0.818	65%	0.652	S	S	*	*			trans	-69.2	113.2	-173.9	41.1	0	0	0	0	110.8	K17	S15-K17 PolarHBondContact O-N 2.83Å
16	C	37.8	Very low	56.3	Low	123 Å²	123	99.9 Å²	99.9	83%	0.831	63%	0.632	S	S	*	*			trans	-69.6	73.8	179.4	-63.2	0	0	0	0	112.3	G14 F18	G14-C16 PolarHBondContact O-N 3.31Å; G14-C16 VanDerWaalsContact O-N 3.15Å; C16-F18 PolarHBondContact O-N 3.06Å
17	K	43.7	Very low	58.5	Low	181 Å²	181	99.2 Å²	99.2	79%	0.787	62%	0.621	S	S	*	*			trans	-73.6	65.2	151.5	-71.8	-172.3	175.7	-177.4	0	108.4	S15 T19	S15-K17 PolarHBondContact O-N 2.83Å; K17-T19 WeakPolarHBondContact O-CG2 3.44Å; K17-T19 PolarHBondContact O-N 2.8Å
18	F	53.9	Low	60.7	Low	144 Å²	144	99.8 Å²	99.8	63%	0.632	61%	0.612	S	S	*	*			trans	-65.9	98	172.8	-166	-103.1	0	0	0	106.6	C16 T23	C16-F18 PolarHBondContact O-N 3.06Å; F18-T23 WeakPolarHBondContact CD1-OG1 3.34Å; F18-T23 HydrophobicContact CE1-CG2 4.11Å; F18-T23 WeakPolarHBondContact CE1-OG1 3.47Å
19	T	64.9	Low	63	Low	60 Å²	60	103.4 Å²	103.4	37%	0.368	61%	0.614	S	S	.	*			trans	-75.2	140.2	-171	68.2	0	0	0	0	109.7	K17 L21 E22 T23	K17-T19 WeakPolarHBondContact O-CG2 3.44Å; K17-T19 PolarHBondContact O-N 2.8Å; T19-L21 PolarHBondContact O-N 3.49Å; T19-E22 WeakPolarHBondContact CB-OE2 3.4Å; T19-E22 PolarHBondContact N-OE2 3.38Å; T19-E22 VanDerWaalsContact N-OE2 3.14Å; T19-E22 PolarHBondContact O-N 2.76Å; T19-E22 VanDerWaalsContact OG1-CD 3.26Å; T19-E22 VanDerWaalsContact OG1-CG 3.23Å; T19-E22 WeakPolarHBondContact OG1-CG 3.42Å; T19-E22 PolarHBondContact OG1-N 3.49Å; T19-E22 PolarHBondContact OG1-OE2 3.29Å; T19-T23 PolarHBondContact O-N 3.2Å; T19-T23 PolarHBondContact O-OG1 3Å; T19-T23 VanDerWaalsContact O-OG1 3.06Å
20	V	72.7	Confident	65.1	Low	113 Å²	113	101.8 Å²	101.8	69%	0.685	60%	0.595	S	S	*	*	H	α-helix	trans	-59.8	-29.5	176.1	-178.6	0	0	0	0	110.2	T23 C24	V20-T23 PolarHBondContact O-N 3.18Å; V20-C24 WeakPolarHBondContact O-CB 3.44Å; V20-C24 PolarHBondContact O-N 3.26Å; V20-C24 PolarHBondContact O-SG 2.83Å
21	L	80.5	Confident	67.8	Low	128 Å²	128	104.6 Å²	104.6	67%	0.67	60%	0.598	S	S	*	*	H	α-helix	trans	-58.1	-58.9	173	-125.2	73.2	0	0	0	112.5	T19 T23 C24 D25	T19-L21 PolarHBondContact O-N 3.49Å; L21-T23 PolarHBondContact O-N 2.55Å; L21-T23 VanDerWaalsContact O-N 3.12Å; L21-C24 PolarHBondContact O-N 3.01Å; L21-D25 PolarHBondContact O-N 3.32Å
22	E	79	Confident	69.9	Low	120 Å²	120	104.7 Å²	104.7	56%	0.561	59%	0.585	S	S	*	*	H	α-helix	trans	-56.7	-32.1	178.5	-70.3	162.4	125.8	0	0	112.4	T19 R26	T19-E22 WeakPolarHBondContact CB-OE2 3.4Å; T19-E22 PolarHBondContact N-OE2 3.38Å; T19-E22 VanDerWaalsContact N-OE2 3.14Å; T19-E22 PolarHBondContact O-N 2.76Å; T19-E22 VanDerWaalsContact OG1-CD 3.26Å; T19-E22 VanDerWaalsContact OG1-CG 3.23Å; T19-E22 WeakPolarHBondContact OG1-CG 3.42Å; T19-E22 PolarHBondContact OG1-N 3.49Å; T19-E22 PolarHBondContact OG1-OE2 3.29Å; E22-R26 PolarHBondContact O-N 2.88Å; E22-R26 VanDerWaalsContact O-N 3.16Å
23	T	81.4	Confident	72.3	Confident	36 Å²	36	101.9 Å²	101.9	22%	0.221	57%	0.568	C	S	.	*	H	α-helix	trans	-71	-48.2	176.2	-46.6	0	0	0	0	111.3	F18 T19 V20 L21 D25 R26 I27	F18-T23 WeakPolarHBondContact CD1-OG1 3.34Å; F18-T23 HydrophobicContact CE1-CG2 4.11Å; F18-T23 WeakPolarHBondContact CE1-OG1 3.47Å; T19-T23 PolarHBondContact O-N 3.2Å; T19-T23 PolarHBondContact O-OG1 3Å; T19-T23 VanDerWaalsContact O-OG1 3.06Å; V20-T23 PolarHBondContact O-N 3.18Å; L21-T23 PolarHBondContact O-N 2.55Å; L21-T23 VanDerWaalsContact O-N 3.12Å; T23-D25 VanDerWaalsContact C-N 3.34Å; T23-D25 PolarHBondContact O-N 3.31Å; T23-R26 PolarHBondContact O-N 3.06Å; T23-I27 HydrophobicContact CG2-CD1 4.13Å; T23-I27 WeakPolarHBondContact O-CD1 3.45Å; T23-I27 VanDerWaalsContact O-CG1 3.26Å; T23-I27 WeakPolarHBondContact O-CG1 3.36Å; T23-I27 PolarHBondContact O-N 3.47Å
24	C	82	Confident	74.9	Confident	58 Å²	58	102.7 Å²	102.7	39%	0.392	55%	0.551	S	S	.	*	H	α-helix	trans	-62.5	-39.5	176.9	-74.7	0	0	0	0	112.3	V20 L21 I27 K28	V20-C24 WeakPolarHBondContact O-CB 3.44Å; V20-C24 PolarHBondContact O-N 3.26Å; V20-C24 PolarHBondContact O-SG 2.83Å; L21-C24 PolarHBondContact O-N 3.01Å; C24-I27 PolarHBondContact O-N 3.18Å; C24-K28 WeakPolarHBondContact O-CG 3.48Å; C24-K28 PolarHBondContact O-N 2.87Å
25	D	86.6	Confident	77.5	Confident	63 Å²	63	105.3 Å²	105.3	34%	0.337	55%	0.546	S	S	.	.	H	α-helix	trans	-70.8	-41	-179.3	-67.2	-34.7	0	0	0	111.4	L21 T23 I27 K28 E29	L21-D25 PolarHBondContact O-N 3.32Å; T23-D25 VanDerWaalsContact C-N 3.34Å; T23-D25 PolarHBondContact O-N 3.31Å; D25-I27 VanDerWaalsContact C-N 3.3Å; D25-I27 PolarHBondContact O-N 2.77Å; D25-K28 WeakPolarHBondContact O-CB 3.29Å; D25-K28 PolarHBondContact O-N 2.94Å; D25-K28 VanDerWaalsContact O-N 3.11Å; D25-K28 WeakPolarHBondContact OD1-CE 3.3Å; D25-K28 IonicContact OD1-NZ 3.49Å; D25-K28 PolarHBondContact OD1-NZ 2.75Å; D25-E29 PolarHBondContact O-N 3.29Å
26	R	86.8	Confident	79.9	Confident	122 Å²	122	106.4 Å²	106.4	46%	0.46	54%	0.538	S	S	.	.	H	α-helix	trans	-65	-32.7	171.7	-149.5	-172.7	79.2	-122.7	-6.5	112.8	E22 T23 E29 E30	E22-R26 PolarHBondContact O-N 2.88Å; E22-R26 VanDerWaalsContact O-N 3.16Å; T23-R26 PolarHBondContact O-N 3.06Å; R26-E29 PolarHBondContact O-N 3.03Å; R26-E30 IonicContact CZ-OE1 3.92Å; R26-E30 VanDerWaalsContact CZ-OE1 3.3Å; R26-E30 IonicContact NE-OE1 2.71Å; R26-E30 PolarHBondContact NE-OE1 3.29Å; R26-E30 IonicContact NH2-OE1 2.88Å; R26-E30 PolarHBondContact NH2-OE1 2.86Å; R26-E30 WeakPolarHBondContact O-CB 3.34Å; R26-E30 WeakPolarHBondContact O-CG 3.49Å; R26-E30 PolarHBondContact O-N 3.12Å
27	I	89	Confident	82.4	Confident	94 Å²	94	105.6 Å²	105.6	48%	0.482	52%	0.522	S	S	.	.	H	α-helix	trans	-66	-37.6	172.2	-71.6	166	0	0	0	111.3	T23 C24 D25 F31	T23-I27 HydrophobicContact CG2-CD1 4.13Å; T23-I27 WeakPolarHBondContact O-CD1 3.45Å; T23-I27 VanDerWaalsContact O-CG1 3.26Å; T23-I27 WeakPolarHBondContact O-CG1 3.36Å; T23-I27 PolarHBondContact O-N 3.47Å; C24-I27 PolarHBondContact O-N 3.18Å; D25-I27 VanDerWaalsContact C-N 3.3Å; D25-I27 PolarHBondContact O-N 2.77Å; I27-F31 WeakPolarHBondContact O-CB 3.23Å; I27-F31 PolarHBondContact O-N 3.21Å
28	K	89.4	Confident	84.4	Confident	124 Å²	124	101.3 Å²	101.3	54%	0.539	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-41.4	172.6	-67.1	167.4	-165.4	163.6	0	111.7	C24 D25 F31 T32	C24-K28 WeakPolarHBondContact O-CG 3.48Å; C24-K28 PolarHBondContact O-N 2.87Å; D25-K28 WeakPolarHBondContact O-CB 3.29Å; D25-K28 PolarHBondContact O-N 2.94Å; D25-K28 VanDerWaalsContact O-N 3.11Å; D25-K28 WeakPolarHBondContact OD1-CE 3.3Å; D25-K28 IonicContact OD1-NZ 3.49Å; D25-K28 PolarHBondContact OD1-NZ 2.75Å; K28-F31 PolarHBondContact O-N 3.3Å; K28-T32 VanDerWaalsContact O-CB 3.32Å; K28-T32 WeakPolarHBondContact O-CB 3.39Å; K28-T32 PolarHBondContact O-N 3.49Å; K28-T32 PolarHBondContact O-OG1 3.38Å
29	E	90.9	Very high	86.3	Confident	134 Å²	134	99.6 Å²	99.6	63%	0.626	50%	0.501	S	S	*	.	H	α-helix	trans	-64	-49.8	176.5	-70.1	177.7	164	0	0	111.5	D25 R26 F31 T32 C33	D25-E29 PolarHBondContact O-N 3.29Å; R26-E29 PolarHBondContact O-N 3.03Å; E29-F31 VanDerWaalsContact C-N 3.33Å; E29-F31 PolarHBondContact O-N 3.19Å; E29-T32 PolarHBondContact O-N 3.43Å; E29-C33 WeakPolarHBondContact O-CB 3.43Å; E29-C33 PolarHBondContact O-N 3.23Å
30	E	89.8	Confident	87.6	Confident	92 Å²	92	100.3 Å²	100.3	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-58	-43.9	175.4	-72.3	175.9	-148	0	0	110.9	R26 I34	R26-E30 IonicContact CZ-OE1 3.92Å; R26-E30 VanDerWaalsContact CZ-OE1 3.3Å; R26-E30 IonicContact NE-OE1 2.71Å; R26-E30 PolarHBondContact NE-OE1 3.29Å; R26-E30 IonicContact NH2-OE1 2.88Å; R26-E30 PolarHBondContact NH2-OE1 2.86Å; R26-E30 WeakPolarHBondContact O-CB 3.34Å; R26-E30 WeakPolarHBondContact O-CG 3.49Å; R26-E30 PolarHBondContact O-N 3.12Å; E30-I34 WeakPolarHBondContact O-CB 3.42Å; E30-I34 WeakPolarHBondContact O-CD1 3.42Å; E30-I34 VanDerWaalsContact O-CG1 3.26Å; E30-I34 WeakPolarHBondContact O-CG1 3.45Å; E30-I34 PolarHBondContact O-N 2.98Å
31	F	91.7	Very high	88.4	Confident	132 Å²	132	99.3 Å²	99.3	58%	0.579	50%	0.499	S	S	*	.	H	α-helix	trans	-64	-44.2	175.8	-176.3	-90.5	0	0	0	112.9	I27 K28 E29 I34 Q35	I27-F31 WeakPolarHBondContact O-CB 3.23Å; I27-F31 PolarHBondContact O-N 3.21Å; K28-F31 PolarHBondContact O-N 3.3Å; E29-F31 VanDerWaalsContact C-N 3.33Å; E29-F31 PolarHBondContact O-N 3.19Å; F31-I34 PolarHBondContact O-N 3.13Å; F31-Q35 WeakPolarHBondContact O-CB 3.44Å; F31-Q35 PolarHBondContact O-N 2.86Å
32	T	92	Very high	88.7	Confident	69 Å²	69	98 Å²	98	42%	0.423	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-39.2	180	-55.1	0	0	0	0	111.2	K28 E29 Q35 Q36	K28-T32 VanDerWaalsContact O-CB 3.32Å; K28-T32 WeakPolarHBondContact O-CB 3.39Å; K28-T32 PolarHBondContact O-N 3.49Å; K28-T32 PolarHBondContact O-OG1 3.38Å; E29-T32 PolarHBondContact O-N 3.43Å; T32-Q35 PolarHBondContact O-N 2.78Å; T32-Q36 PolarHBondContact O-N 3.43Å
33	C	92.7	Very high	89.2	Confident	78 Å²	78	96.8 Å²	96.8	53%	0.527	49%	0.486	S	S	.	.	H	α-helix	trans	-63.1	-46.8	174.4	-176	0	0	0	0	111.5	E29 Q35 Q36 Q37	E29-C33 WeakPolarHBondContact O-CB 3.43Å; E29-C33 PolarHBondContact O-N 3.23Å; C33-Q35 VanDerWaalsContact C-N 3.31Å; C33-Q35 PolarHBondContact O-N 3.2Å; C33-Q36 PolarHBondContact O-N 3Å; C33-Q37 PolarHBondContact O-N 2.55Å
34	I	90.6	Very high	89.6	Confident	103 Å²	103	100.3 Å²	100.3	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-40.4	174.8	-69.9	165.9	0	0	0	110.9	E30 F31 Q37 N38	E30-I34 WeakPolarHBondContact O-CB 3.42Å; E30-I34 WeakPolarHBondContact O-CD1 3.42Å; E30-I34 VanDerWaalsContact O-CG1 3.26Å; E30-I34 WeakPolarHBondContact O-CG1 3.45Å; E30-I34 PolarHBondContact O-N 2.98Å; F31-I34 PolarHBondContact O-N 3.13Å; I34-Q37 PolarHBondContact O-N 3.22Å; I34-N38 VanDerWaalsContact O-CB 3.31Å; I34-N38 WeakPolarHBondContact O-CB 3.41Å; I34-N38 PolarHBondContact O-N 3.04Å
35	Q	90.6	Very high	89.7	Confident	120 Å²	120	105.9 Å²	105.9	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-63.6	-43	178	-169.9	175.8	10.1	0	0	112	F31 T32 C33 N38 H39	F31-Q35 WeakPolarHBondContact O-CB 3.44Å; F31-Q35 PolarHBondContact O-N 2.86Å; T32-Q35 PolarHBondContact O-N 2.78Å; C33-Q35 VanDerWaalsContact C-N 3.31Å; C33-Q35 PolarHBondContact O-N 3.2Å; Q35-N38 PolarHBondContact O-N 2.81Å; Q35-H39 PolarHBondContact O-N 3.08Å
36	Q	91.4	Very high	89.6	Confident	140 Å²	140	108.8 Å²	108.8	65%	0.654	52%	0.524	S	S	*	.	H	α-helix	trans	-64.3	-43.5	172.9	-76.1	-174.6	-22	0	0	112.3	T32 C33 N38 H39 S40	T32-Q36 PolarHBondContact O-N 3.43Å; C33-Q36 PolarHBondContact O-N 3Å; Q36-N38 VanDerWaalsContact C-N 3.33Å; Q36-N38 PolarHBondContact O-N 3.07Å; Q36-H39 PolarHBondContact O-N 2.86Å; Q36-S40 PolarHBondContact O-N 2.95Å
37	Q	90.8	Very high	89.8	Confident	106 Å²	106	108.4 Å²	108.4	50%	0.495	53%	0.526	S	S	.	.	H	α-helix	trans	-62.7	-40.8	178.1	-171	176.8	14.1	0	0	111.6	C33 I34 S40 L41	C33-Q37 PolarHBondContact O-N 2.55Å; I34-Q37 PolarHBondContact O-N 3.22Å; Q37-S40 PolarHBondContact O-N 2.97Å; Q37-L41 HydrophobicContact CG-CD1 4.2Å; Q37-L41 WeakPolarHBondContact O-CG 3.4Å; Q37-L41 PolarHBondContact O-N 3.25Å
38	N	86.8	Confident	89.5	Confident	91 Å²	91	108.6 Å²	108.6	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-41.6	177.8	-154.6	-26.8	0	0	0	111.3	I34 Q35 Q36 L41 Q42	I34-N38 VanDerWaalsContact O-CB 3.31Å; I34-N38 WeakPolarHBondContact O-CB 3.41Å; I34-N38 PolarHBondContact O-N 3.04Å; Q35-N38 PolarHBondContact O-N 2.81Å; Q36-N38 VanDerWaalsContact C-N 3.33Å; Q36-N38 PolarHBondContact O-N 3.07Å; N38-L41 PolarHBondContact O-N 2.92Å; N38-Q42 WeakPolarHBondContact O-CG 3.31Å; N38-Q42 PolarHBondContact O-N 2.92Å
39	H	93.1	Very high	88.8	Confident	109 Å²	109	106.6 Å²	106.6	51%	0.505	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-39.3	174.4	-171.6	48.8	0	0	0	112.9	Q35 Q36 Q42 L43	Q35-H39 PolarHBondContact O-N 3.08Å; Q36-H39 PolarHBondContact O-N 2.86Å; H39-Q42 WeakPolarHBondContact O-CB 3.29Å; H39-Q42 PolarHBondContact O-N 3.31Å; H39-L43 PolarHBondContact O-N 2.93Å; H39-L43 VanDerWaalsContact O-N 3.14Å
40	S	92.3	Very high	88.2	Confident	74 Å²	74	102.9 Å²	102.9	52%	0.517	51%	0.511	S	S	.	.	H	α-helix	trans	-61.6	-44.7	173.8	-165.1	0	0	0	0	111.8	Q36 Q37 Q42 L43 E44	Q36-S40 PolarHBondContact O-N 2.95Å; Q37-S40 PolarHBondContact O-N 2.97Å; S40-Q42 VanDerWaalsContact C-N 3.31Å; S40-Q42 PolarHBondContact O-N 2.76Å; S40-L43 PolarHBondContact O-N 3.1Å; S40-E44 PolarHBondContact O-N 3.09Å
41	L	88.7	Confident	87.8	Confident	92 Å²	92	102.6 Å²	102.6	48%	0.482	51%	0.51	S	S	.	.	H	α-helix	trans	-66.6	-28.7	176.1	-71.6	168.3	0	0	0	113.1	Q37 N38 R45	Q37-L41 HydrophobicContact CG-CD1 4.2Å; Q37-L41 WeakPolarHBondContact O-CG 3.4Å; Q37-L41 PolarHBondContact O-N 3.25Å; N38-L41 PolarHBondContact O-N 2.92Å; L41-R45 VanDerWaalsContact O-CB 3.24Å; L41-R45 WeakPolarHBondContact O-CB 3.23Å; L41-R45 PolarHBondContact O-N 2.92Å
42	Q	87.7	Confident	87.1	Confident	102 Å²	102	103.7 Å²	103.7	48%	0.477	51%	0.51	S	S	.	.	H	α-helix	trans	-65.7	-46.5	171	-76.1	173.9	-27.9	0	0	111.5	N38 H39 S40 R45 E46	N38-Q42 WeakPolarHBondContact O-CG 3.31Å; N38-Q42 PolarHBondContact O-N 2.92Å; H39-Q42 WeakPolarHBondContact O-CB 3.29Å; H39-Q42 PolarHBondContact O-N 3.31Å; S40-Q42 VanDerWaalsContact C-N 3.31Å; S40-Q42 PolarHBondContact O-N 2.76Å; Q42-R45 WeakPolarHBondContact O-CB 3.24Å; Q42-R45 PolarHBondContact O-N 3.27Å; Q42-E46 WeakPolarHBondContact O-CG 3.48Å; Q42-E46 PolarHBondContact O-N 3.07Å
43	L	90.1	Very high	86.1	Confident	94 Å²	94	102.6 Å²	102.6	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-39.4	177.3	-66.8	169.1	0	0	0	112.1	H39 S40 E46 K47	H39-L43 PolarHBondContact O-N 2.93Å; H39-L43 VanDerWaalsContact O-N 3.14Å; S40-L43 PolarHBondContact O-N 3.1Å; L43-E46 PolarHBondContact O-N 2.89Å; L43-K47 PolarHBondContact O-N 2.92Å
44	E	89.8	Confident	85.2	Confident	110 Å²	110	102.2 Å²	102.2	51%	0.514	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-42.7	173.4	-173.3	173.5	-158.9	0	0	111.7	S40 E46 K47 L48	S40-E44 PolarHBondContact O-N 3.09Å; E44-E46 PolarHBondContact O-N 3.43Å; E44-K47 PolarHBondContact O-N 3.07Å; E44-L48 HydrophobicContact CG-CD1 4.18Å; E44-L48 WeakPolarHBondContact O-CB 3.4Å; E44-L48 WeakPolarHBondContact O-CG 3.42Å; E44-L48 PolarHBondContact O-N 2.82Å
45	R	82.6	Confident	84.4	Confident	175 Å²	175	102.8 Å²	102.8	66%	0.66	50%	0.5	S	S	*	.	H	α-helix	trans	-61	-42.2	174.2	-178.9	-175	-177.9	-121.7	4.1	112.1	L41 Q42 L48 L49	L41-R45 VanDerWaalsContact O-CB 3.24Å; L41-R45 WeakPolarHBondContact O-CB 3.23Å; L41-R45 PolarHBondContact O-N 2.92Å; Q42-R45 WeakPolarHBondContact O-CB 3.24Å; Q42-R45 PolarHBondContact O-N 3.27Å; R45-L48 PolarHBondContact O-N 2.9Å; R45-L49 HydrophobicContact CG-CD1 4.11Å; R45-L49 WeakPolarHBondContact O-CB 3.42Å; R45-L49 VanDerWaalsContact O-CG 3.26Å; R45-L49 WeakPolarHBondContact O-CG 3.15Å; R45-L49 PolarHBondContact O-N 3.34Å
46	E	85.6	Confident	83.8	Confident	123 Å²	123	100.8 Å²	100.8	58%	0.575	49%	0.491	S	S	*	.	H	α-helix	trans	-65.4	-43.8	177.6	-75	178.3	171.1	0	0	111.6	Q42 L43 E44 L48 L49 S50	Q42-E46 WeakPolarHBondContact O-CG 3.48Å; Q42-E46 PolarHBondContact O-N 3.07Å; L43-E46 PolarHBondContact O-N 2.89Å; E44-E46 PolarHBondContact O-N 3.43Å; E46-L48 PolarHBondContact O-N 2.87Å; E46-L49 PolarHBondContact O-N 3.34Å; E46-S50 PolarHBondContact O-N 3.44Å; E46-S50 PolarHBondContact O-OG 3.1Å
47	K	90.9	Very high	83	Confident	115 Å²	115	98.8 Å²	98.8	50%	0.5	48%	0.477	S	S	.	.	H	α-helix	trans	-58.7	-46.3	173.4	179.8	178.2	175.8	-66.2	0	112.2	L43 E44 L49 S50 E51	L43-K47 PolarHBondContact O-N 2.92Å; E44-K47 PolarHBondContact O-N 3.07Å; K47-L49 VanDerWaalsContact C-N 3.31Å; K47-L49 PolarHBondContact O-N 2.92Å; K47-S50 WeakPolarHBondContact CA-OG 2.97Å; K47-S50 PolarHBondContact O-N 3.03Å; K47-S50 PolarHBondContact O-OG 2.86Å; K47-E51 WeakPolarHBondContact CE-OE1 3.25Å; K47-E51 VanDerWaalsContact NZ-CD 3.26Å; K47-E51 IonicContact NZ-OE1 2.66Å; K47-E51 PolarHBondContact NZ-OE1 3.28Å; K47-E51 IonicContact NZ-OE2 2.75Å; K47-E51 PolarHBondContact NZ-OE2 2.72Å; K47-E51 WeakPolarHBondContact O-CG 3.39Å; K47-E51 PolarHBondContact O-N 3.46Å
48	L	81.3	Confident	82.4	Confident	97 Å²	97	98.3 Å²	98.3	51%	0.508	48%	0.477	S	S	.	.	H	α-helix	trans	-65.9	-32.1	177.1	-71.5	171.8	0	0	0	112.3	E44 R45 E46 R52	E44-L48 HydrophobicContact CG-CD1 4.18Å; E44-L48 WeakPolarHBondContact O-CB 3.4Å; E44-L48 WeakPolarHBondContact O-CG 3.42Å; E44-L48 PolarHBondContact O-N 2.82Å; R45-L48 PolarHBondContact O-N 2.9Å; E46-L48 PolarHBondContact O-N 2.87Å; L48-R52 WeakPolarHBondContact O-CB 3.29Å; L48-R52 PolarHBondContact O-N 3.11Å
49	L	75.9	Confident	81.6	Confident	82 Å²	82	97.4 Å²	97.4	43%	0.429	48%	0.477	S	S	.	.	H	α-helix	trans	-68.9	-39.3	172.9	-76.4	168.2	0	0	0	112.1	R45 E46 K47 S53	R45-L49 HydrophobicContact CG-CD1 4.11Å; R45-L49 WeakPolarHBondContact O-CB 3.42Å; R45-L49 VanDerWaalsContact O-CG 3.26Å; R45-L49 WeakPolarHBondContact O-CG 3.15Å; R45-L49 PolarHBondContact O-N 3.34Å; E46-L49 PolarHBondContact O-N 3.34Å; K47-L49 VanDerWaalsContact C-N 3.31Å; K47-L49 PolarHBondContact O-N 2.92Å; L49-S53 PolarHBondContact O-N 2.91Å; L49-S53 VanDerWaalsContact O-N 3.08Å
50	S	77.5	Confident	80.6	Confident	56 Å²	56	93.9 Å²	93.9	39%	0.392	46%	0.463	S	S	.	.	H	α-helix	trans	-64.6	-48.9	172.3	47.2	0	0	0	0	111.9	E46 K47 R52 S53 D54	E46-S50 PolarHBondContact O-N 3.44Å; E46-S50 PolarHBondContact O-OG 3.1Å; K47-S50 WeakPolarHBondContact CA-OG 2.97Å; K47-S50 PolarHBondContact O-N 3.03Å; K47-S50 PolarHBondContact O-OG 2.86Å; S50-R52 VanDerWaalsContact C-N 3.33Å; S50-R52 PolarHBondContact O-N 2.79Å; S50-S53 CarbonylContact O-C 3.59Å; S50-S53 WeakPolarHBondContact O-CA 3.46Å; S50-S53 WeakPolarHBondContact O-CB 3.49Å; S50-S53 PolarHBondContact O-N 3.12Å; S50-S53 PolarHBondContact O-OG 2.82Å; S50-D54 PolarHBondContact O-N 2.88Å
51	E	82	Confident	79.9	Confident	87 Å²	87	94.5 Å²	94.5	41%	0.407	46%	0.459	S	S	.	.	H	α-helix	trans	-61.5	-39.4	180	-73.3	173.4	167.7	0	0	111.9	K47 S53 D54 M55	K47-E51 WeakPolarHBondContact CE-OE1 3.25Å; K47-E51 VanDerWaalsContact NZ-CD 3.26Å; K47-E51 IonicContact NZ-OE1 2.66Å; K47-E51 PolarHBondContact NZ-OE1 3.28Å; K47-E51 IonicContact NZ-OE2 2.75Å; K47-E51 PolarHBondContact NZ-OE2 2.72Å; K47-E51 WeakPolarHBondContact O-CG 3.39Å; K47-E51 PolarHBondContact O-N 3.46Å; E51-S53 VanDerWaalsContact C-N 3.32Å; E51-S53 PolarHBondContact O-N 3.23Å; E51-D54 PolarHBondContact O-N 2.86Å; E51-M55 WeakPolarHBondContact O-CB 3.4Å; E51-M55 PolarHBondContact O-N 3.4Å
52	R	77.5	Confident	79.3	Confident	154 Å²	154	96.8 Å²	96.8	58%	0.581	46%	0.462	S	S	*	.	H	α-helix	trans	-59.4	-41.8	170.1	-173.4	-147.9	128.8	162.8	2.3	111.5	L48 S50 Q56	L48-R52 WeakPolarHBondContact O-CB 3.29Å; L48-R52 PolarHBondContact O-N 3.11Å; S50-R52 VanDerWaalsContact C-N 3.33Å; S50-R52 PolarHBondContact O-N 2.79Å; R52-Q56 VanDerWaalsContact O-CB 3.24Å; R52-Q56 WeakPolarHBondContact O-CB 3.44Å; R52-Q56 PolarHBondContact O-N 2.9Å
53	S	71.2	Confident	78.6	Confident	46 Å²	46	99.6 Å²	99.6	32%	0.322	47%	0.469	S	S	.	.	H	α-helix	trans	-69.1	-35.1	-179.9	86.1	0	0	0	0	112.8	L49 S50 E51 R57	L49-S53 PolarHBondContact O-N 2.91Å; L49-S53 VanDerWaalsContact O-N 3.08Å; S50-S53 CarbonylContact O-C 3.59Å; S50-S53 WeakPolarHBondContact O-CA 3.46Å; S50-S53 WeakPolarHBondContact O-CB 3.49Å; S50-S53 PolarHBondContact O-N 3.12Å; S50-S53 PolarHBondContact O-OG 2.82Å; E51-S53 VanDerWaalsContact C-N 3.32Å; E51-S53 PolarHBondContact O-N 3.23Å; S53-R57 PolarHBondContact O-N 2.92Å; S53-R57 PolarHBondContact OG-NH2 3.18Å
54	D	71.9	Confident	77.7	Confident	70 Å²	70	99 Å²	99	37%	0.374	46%	0.464	S	S	.	.	H	α-helix	trans	-68.1	-49	174.5	-67.9	-47.5	0	0	0	110.7	S50 E51 Q56 R57 I58	S50-D54 PolarHBondContact O-N 2.88Å; E51-D54 PolarHBondContact O-N 2.86Å; D54-Q56 VanDerWaalsContact C-N 3.32Å; D54-Q56 PolarHBondContact O-N 3.06Å; D54-R57 WeakPolarHBondContact O-CB 3.29Å; D54-R57 PolarHBondContact O-N 3.07Å; D54-R57 VanDerWaalsContact O-N 3.16Å; D54-R57 IonicContact OD1-CZ 3.72Å; D54-R57 IonicContact OD1-NH1 2.8Å; D54-R57 PolarHBondContact OD1-NH1 2.98Å; D54-R57 IonicContact OD1-NH2 2.56Å; D54-R57 PolarHBondContact OD1-NH2 3.05Å; D54-I58 WeakPolarHBondContact O-CG1 3.38Å; D54-I58 PolarHBondContact O-N 2.9Å
55	M	75.4	Confident	76.9	Confident	115 Å²	115	98.4 Å²	98.4	57%	0.567	46%	0.463	S	S	*	.	H	α-helix	trans	-57.8	-44.6	175	-171.7	62	67.8	0	0	111.4	E51 R57 I58 C59	E51-M55 WeakPolarHBondContact O-CB 3.4Å; E51-M55 PolarHBondContact O-N 3.4Å; M55-R57 VanDerWaalsContact C-N 3.33Å; M55-R57 PolarHBondContact O-N 3.23Å; M55-I58 PolarHBondContact O-N 3.46Å; M55-I58 VanDerWaalsContact O-N 3.14Å; M55-C59 PolarHBondContact O-N 2.96Å; M55-C59 PolarHBondContact O-SG 2.89Å
56	Q	77.7	Confident	76.1	Confident	79 Å²	79	91.9 Å²	91.9	37%	0.369	45%	0.446	S	S	.	.	H	α-helix	trans	-63.3	-37	178.1	-172	169.6	-7	0	0	112.2	R52 D54 V60	R52-Q56 VanDerWaalsContact O-CB 3.24Å; R52-Q56 WeakPolarHBondContact O-CB 3.44Å; R52-Q56 PolarHBondContact O-N 2.9Å; D54-Q56 VanDerWaalsContact C-N 3.32Å; D54-Q56 PolarHBondContact O-N 3.06Å; Q56-V60 WeakPolarHBondContact O-CB 2.94Å; Q56-V60 VanDerWaalsContact O-CG2 3.28Å; Q56-V60 WeakPolarHBondContact O-CG2 3.31Å; Q56-V60 PolarHBondContact O-N 2.91Å; Q56-V60 VanDerWaalsContact O-N 3.07Å
57	R	74.4	Confident	75.3	Confident	97 Å²	97	89 Å²	89	37%	0.366	44%	0.435	S	S	.	.	H	α-helix	trans	-63.5	-41.3	171.7	-95.5	176.3	-80.1	109.6	1	112.3	S53 D54 M55 M61 D257	S53-R57 PolarHBondContact O-N 2.92Å; S53-R57 PolarHBondContact OG-NH2 3.18Å; D54-R57 WeakPolarHBondContact O-CB 3.29Å; D54-R57 PolarHBondContact O-N 3.07Å; D54-R57 VanDerWaalsContact O-N 3.16Å; D54-R57 IonicContact OD1-CZ 3.72Å; D54-R57 IonicContact OD1-NH1 2.8Å; D54-R57 PolarHBondContact OD1-NH1 2.98Å; D54-R57 IonicContact OD1-NH2 2.56Å; D54-R57 PolarHBondContact OD1-NH2 3.05Å; M55-R57 VanDerWaalsContact C-N 3.33Å; M55-R57 PolarHBondContact O-N 3.23Å; R57-M61 WeakPolarHBondContact O-CB 3.41Å; R57-M61 PolarHBondContact O-N 3.06Å; R57-D257 WeakPolarHBondContact CD-OD1 3.42Å
58	I	78.5	Confident	74.4	Confident	97 Å²	97	85.6 Å²	85.6	50%	0.497	43%	0.432	S	S	.	.	H	α-helix	trans	-66.3	-47.1	177.5	-65	166.1	0	0	0	111.1	D54 M55 V60 M61 Y62	D54-I58 WeakPolarHBondContact O-CG1 3.38Å; D54-I58 PolarHBondContact O-N 2.9Å; M55-I58 PolarHBondContact O-N 3.46Å; M55-I58 VanDerWaalsContact O-N 3.14Å; I58-V60 PolarHBondContact O-N 2.86Å; I58-M61 PolarHBondContact O-N 2.91Å; I58-Y62 PolarHBondContact O-N 2.85Å
59	C	69.7	Low	74	Confident	72 Å²	72	86.2 Å²	86.2	49%	0.486	44%	0.435	S	S	.	.	H	α-helix	trans	-61.2	-44.1	179	-66.8	0	0	0	0	112.3	M55 Y62 Y63	M55-C59 PolarHBondContact O-N 2.96Å; M55-C59 PolarHBondContact O-SG 2.89Å; C59-Y62 PolarHBondContact O-N 2.86Å; C59-Y63 WeakPolarHBondContact O-CB 3.44Å; C59-Y63 PolarHBondContact O-N 2.89Å
60	V	71.4	Confident	74	Confident	35 Å²	35	85.5 Å²	85.5	21%	0.212	43%	0.432	C	S	.	.	H	α-helix	trans	-66.2	-42.2	177.7	175.4	0	0	0	0	111	Q56 I58 Y62 Y63 E64 R260	Q56-V60 WeakPolarHBondContact O-CB 2.94Å; Q56-V60 VanDerWaalsContact O-CG2 3.28Å; Q56-V60 WeakPolarHBondContact O-CG2 3.31Å; Q56-V60 PolarHBondContact O-N 2.91Å; Q56-V60 VanDerWaalsContact O-N 3.07Å; I58-V60 PolarHBondContact O-N 2.86Å; V60-Y62 VanDerWaalsContact C-N 3.32Å; V60-Y62 PolarHBondContact O-N 3.14Å; V60-Y63 PolarHBondContact O-N 2.9Å; V60-E64 HydrophobicContact CG1-CG 4.21Å; V60-E64 WeakPolarHBondContact CG1-OE1 3.38Å; V60-E64 WeakPolarHBondContact O-CB 3.07Å; V60-E64 VanDerWaalsContact O-CG 3.27Å; V60-E64 WeakPolarHBondContact O-CG 3.28Å; V60-E64 PolarHBondContact O-N 2.99Å; V60-R260 HydrophobicContact CG1-CB 4.34Å; V60-R260 HydrophobicContact CG1-CG 3.73Å
61	M	77.5	Confident	74	Confident	86 Å²	86	88.8 Å²	88.8	42%	0.424	44%	0.444	S	S	.	.	H	α-helix	trans	-58.3	-42.8	174.1	-172.7	-177	77.3	0	0	112.5	R57 I58 M65	R57-M61 WeakPolarHBondContact O-CB 3.41Å; R57-M61 PolarHBondContact O-N 3.06Å; I58-M61 PolarHBondContact O-N 2.91Å; M61-M65 WeakPolarHBondContact O-CB 3.45Å; M61-M65 PolarHBondContact O-N 2.88Å
62	Y	77	Confident	73.7	Confident	140 Å²	140	88.1 Å²	88.1	55%	0.549	44%	0.441	S	S	.	.	H	α-helix	trans	-64.9	-41.5	177.9	-165.2	-83.2	0	0	0	111.5	I58 C59 V60 M65 A66 Y149	I58-Y62 PolarHBondContact O-N 2.85Å; C59-Y62 PolarHBondContact O-N 2.86Å; V60-Y62 VanDerWaalsContact C-N 3.32Å; V60-Y62 PolarHBondContact O-N 3.14Å; Y62-M65 PolarHBondContact O-N 3.04Å; Y62-A66 VanDerWaalsContact O-CB 3.23Å; Y62-A66 WeakPolarHBondContact O-CB 3.37Å; Y62-A66 PolarHBondContact O-N 2.99Å; Y62-Y149 VanDerWaalsContact CE2-OH 3.32Å; Y62-Y149 WeakPolarHBondContact CE2-OH 3.38Å
63	Y	73.7	Confident	73.8	Confident	161 Å²	161	85 Å²	85	63%	0.631	43%	0.434	S	S	*	.	H	α-helix	trans	-68.5	-40.2	178.4	-161.5	-104.4	0	0	0	112.7	C59 V60 N67	C59-Y63 WeakPolarHBondContact O-CB 3.44Å; C59-Y63 PolarHBondContact O-N 2.89Å; V60-Y63 PolarHBondContact O-N 2.9Å; Y63-N67 WeakPolarHBondContact CD1-ND2 3.47Å; Y63-N67 WeakPolarHBondContact CE1-ND2 3.36Å; Y63-N67 WeakPolarHBondContact O-CB 3.24Å; Y63-N67 PolarHBondContact O-N 2.81Å; Y63-N67 PolarHBondContact O-ND2 2.83Å
64	E	70.6	Confident	74.2	Confident	83 Å²	83	87.9 Å²	87.9	39%	0.388	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-48	172.9	-73.1	165.8	163	0	0	111.2	V60 G68 R260	V60-E64 HydrophobicContact CG1-CG 4.21Å; V60-E64 WeakPolarHBondContact CG1-OE1 3.38Å; V60-E64 WeakPolarHBondContact O-CB 3.07Å; V60-E64 VanDerWaalsContact O-CG 3.27Å; V60-E64 WeakPolarHBondContact O-CG 3.28Å; V60-E64 PolarHBondContact O-N 2.99Å; E64-G68 PolarHBondContact O-N 3.36Å; E64-R260 WeakPolarHBondContact OE1-CG 3.3Å; E64-R260 IonicContact OE1-NE 3.15Å; E64-R260 PolarHBondContact OE1-NE 2.66Å; E64-R260 IonicContact OE2-CZ 3.42Å; E64-R260 VanDerWaalsContact OE2-CZ 3.22Å; E64-R260 IonicContact OE2-NE 3.92Å; E64-R260 PolarHBondContact OE2-NE 3.37Å; E64-R260 IonicContact OE2-NH2 3.97Å; E64-R260 PolarHBondContact OE2-NH2 3.24Å
65	M	72.3	Confident	74.7	Confident	97 Å²	97	91.4 Å²	91.4	48%	0.478	45%	0.451	S	S	.	.	H	α-helix	trans	-64.3	-44.3	177.6	-180	177.2	170	0	0	112.3	M61 Y62 G68 L69	M61-M65 WeakPolarHBondContact O-CB 3.45Å; M61-M65 PolarHBondContact O-N 2.88Å; Y62-M65 PolarHBondContact O-N 3.04Å; M65-G68 PolarHBondContact O-N 3.15Å; M65-L69 HydrophobicContact CE-CD1 4.02Å; M65-L69 HydrophobicContact CG-CD1 4.06Å; M65-L69 WeakPolarHBondContact O-CB 3.41Å; M65-L69 WeakPolarHBondContact O-CG 3.27Å; M65-L69 PolarHBondContact O-N 3.41Å
66	A	66.1	Low	75	Confident	38 Å²	38	90.4 Å²	90.4	31%	0.314	45%	0.445	S	S	.	.	H	α-helix	trans	-63.8	-42.8	179.2	0	0	0	0	0	112.1	Y62 L69 N70	Y62-A66 VanDerWaalsContact O-CB 3.23Å; Y62-A66 WeakPolarHBondContact O-CB 3.37Å; Y62-A66 PolarHBondContact O-N 2.99Å; A66-L69 PolarHBondContact O-N 3.39Å; A66-N70 WeakPolarHBondContact O-CB 3.41Å; A66-N70 PolarHBondContact O-N 2.96Å
67	N	69	Low	75.2	Confident	62 Å²	62	91 Å²	91	33%	0.332	45%	0.449	S	S	.	.	H	α-helix	trans	-68.7	-40.3	176.8	-76.2	-23.2	0	0	0	112.4	Y63 L69 N70 L71	Y63-N67 WeakPolarHBondContact CD1-ND2 3.47Å; Y63-N67 WeakPolarHBondContact CE1-ND2 3.36Å; Y63-N67 WeakPolarHBondContact O-CB 3.24Å; Y63-N67 PolarHBondContact O-N 2.81Å; Y63-N67 PolarHBondContact O-ND2 2.83Å; N67-L69 PolarHBondContact O-N 3.26Å; N67-N70 PolarHBondContact O-N 2.89Å; N67-L71 VanDerWaalsContact O-CD1 3.25Å; N67-L71 WeakPolarHBondContact O-CD1 3.32Å; N67-L71 PolarHBondContact O-N 3Å
68	G	72.4	Confident	75.6	Confident	44 Å²	44	89.9 Å²	89.9	45%	0.454	45%	0.448	S	S	.	.	H	α-helix	trans	-59.1	-45.3	173.5	0	0	0	0	0	112.4	E64 M65 E72	E64-G68 PolarHBondContact O-N 3.36Å; M65-G68 PolarHBondContact O-N 3.15Å; G68-E72 PolarHBondContact O-N 3.14Å; G68-E72 VanDerWaalsContact O-N 3.08Å
69	L	71.3	Confident	75.9	Confident	109 Å²	109	88.6 Å²	88.6	57%	0.571	44%	0.441	S	S	*	.	H	α-helix	trans	-63.1	-41.3	174.1	-76.4	167.3	0	0	0	112.4	M65 A66 N67 E72 M73	M65-L69 HydrophobicContact CE-CD1 4.02Å; M65-L69 HydrophobicContact CG-CD1 4.06Å; M65-L69 WeakPolarHBondContact O-CB 3.41Å; M65-L69 WeakPolarHBondContact O-CG 3.27Å; M65-L69 PolarHBondContact O-N 3.41Å; A66-L69 PolarHBondContact O-N 3.39Å; N67-L69 PolarHBondContact O-N 3.26Å; L69-E72 PolarHBondContact O-N 3.19Å; L69-M73 VanDerWaalsContact O-CB 3.24Å; L69-M73 WeakPolarHBondContact O-CB 3.28Å; L69-M73 PolarHBondContact O-N 2.87Å
70	N	77.3	Confident	76.3	Confident	68 Å²	68	87.8 Å²	87.8	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-68.3	-40.7	-179.5	-171.4	28.9	0	0	0	112.6	A66 N67 M73 H74	A66-N70 WeakPolarHBondContact O-CB 3.41Å; A66-N70 PolarHBondContact O-N 2.96Å; N67-N70 PolarHBondContact O-N 2.89Å; N70-M73 WeakPolarHBondContact OD1-CE 3.15Å; N70-H74 PolarHBondContact O-N 2.92Å; N70-H74 PolarHBondContact O-ND1 3.14Å; N70-H74 PolarHBondContact OD1-CE1 3.05Å; N70-H74 PolarHBondContact OD1-ND1 3.2Å
71	L	76.4	Confident	77	Confident	124 Å²	124	92.4 Å²	92.4	65%	0.649	46%	0.457	S	S	*	.	H	α-helix	trans	-62.9	-48	173.3	-95	88.3	0	0	0	111.3	N67 M73 H74 R75	N67-L71 VanDerWaalsContact O-CD1 3.25Å; N67-L71 WeakPolarHBondContact O-CD1 3.32Å; N67-L71 PolarHBondContact O-N 3Å; L71-M73 VanDerWaalsContact C-N 3.34Å; L71-M73 PolarHBondContact O-N 3.05Å; L71-H74 PolarHBondContact O-N 3.47Å; L71-R75 WeakPolarHBondContact O-CB 3.39Å; L71-R75 PolarHBondContact O-N 3.28Å
72	E	75.7	Confident	77.5	Confident	73 Å²	73	95.8 Å²	95.8	34%	0.341	47%	0.465	S	S	.	.	H	α-helix	trans	-67	-36.8	179.9	-172.7	59.6	-163.9	0	0	111.5	G68 L69 H74 R75 Q76	G68-E72 PolarHBondContact O-N 3.14Å; G68-E72 VanDerWaalsContact O-N 3.08Å; L69-E72 PolarHBondContact O-N 3.19Å; E72-H74 PolarHBondContact O-N 2.94Å; E72-R75 PolarHBondContact O-N 2.84Å; E72-R75 IonicContact OE1-CZ 3.3Å; E72-R75 IonicContact OE1-NE 3.98Å; E72-R75 PolarHBondContact OE1-NE 3.32Å; E72-R75 IonicContact OE1-NH2 2.73Å; E72-R75 PolarHBondContact OE1-NH2 2.77Å; E72-R75 IonicContact OE2-CZ 2.93Å; E72-R75 VanDerWaalsContact OE2-CZ 3.31Å; E72-R75 IonicContact OE2-NE 3.26Å; E72-R75 PolarHBondContact OE2-NE 2.89Å; E72-R75 IonicContact OE2-NH2 2.71Å; E72-R75 PolarHBondContact OE2-NH2 2.92Å; E72-R75 VanDerWaalsContact OE2-NH2 3.15Å; E72-Q76 HydrophobicContact CG-CG 4.28Å; E72-Q76 WeakPolarHBondContact O-CB 3.49Å; E72-Q76 VanDerWaalsContact O-CG 3.26Å; E72-Q76 WeakPolarHBondContact O-CG 3.35Å; E72-Q76 PolarHBondContact O-N 2.73Å; E72-Q76 PolarHBondContact OE1-NE2 3.25Å
73	M	80.2	Confident	78	Confident	88 Å²	88	93.8 Å²	93.8	43%	0.433	46%	0.463	S	S	.	.	H	α-helix	trans	-58.8	-46.2	171.9	-177.3	-176.1	69.3	0	0	111.7	L69 N70 L71 Q76 M77	L69-M73 VanDerWaalsContact O-CB 3.24Å; L69-M73 WeakPolarHBondContact O-CB 3.28Å; L69-M73 PolarHBondContact O-N 2.87Å; N70-M73 WeakPolarHBondContact OD1-CE 3.15Å; L71-M73 VanDerWaalsContact C-N 3.34Å; L71-M73 PolarHBondContact O-N 3.05Å; M73-Q76 PolarHBondContact O-N 3.27Å; M73-M77 WeakPolarHBondContact O-CB 3.34Å; M73-M77 PolarHBondContact O-N 2.86Å
74	H	79.3	Confident	78.5	Confident	108 Å²	108	89 Å²	89	50%	0.5	45%	0.453	S	S	.	.	H	α-helix	trans	-63.7	-40.4	175.4	-82.1	77.2	0	0	0	111.9	N70 L71 E72 M77 E78	N70-H74 PolarHBondContact O-N 2.92Å; N70-H74 PolarHBondContact O-ND1 3.14Å; N70-H74 PolarHBondContact OD1-CE1 3.05Å; N70-H74 PolarHBondContact OD1-ND1 3.2Å; L71-H74 PolarHBondContact O-N 3.47Å; E72-H74 PolarHBondContact O-N 2.94Å; H74-M77 PolarHBondContact O-N 2.99Å; H74-E78 PolarHBondContact O-N 2.87Å
75	R	83	Confident	79.1	Confident	143 Å²	143	87.5 Å²	87.5	54%	0.54	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-46.2	177.2	-161.8	176.7	75	118.2	5.2	111.6	L71 E72 E78 I79	L71-R75 WeakPolarHBondContact O-CB 3.39Å; L71-R75 PolarHBondContact O-N 3.28Å; E72-R75 PolarHBondContact O-N 2.84Å; E72-R75 IonicContact OE1-CZ 3.3Å; E72-R75 IonicContact OE1-NE 3.98Å; E72-R75 PolarHBondContact OE1-NE 3.32Å; E72-R75 IonicContact OE1-NH2 2.73Å; E72-R75 PolarHBondContact OE1-NH2 2.77Å; E72-R75 IonicContact OE2-CZ 2.93Å; E72-R75 VanDerWaalsContact OE2-CZ 3.31Å; E72-R75 IonicContact OE2-NE 3.26Å; E72-R75 PolarHBondContact OE2-NE 2.89Å; E72-R75 IonicContact OE2-NH2 2.71Å; E72-R75 PolarHBondContact OE2-NH2 2.92Å; E72-R75 VanDerWaalsContact OE2-NH2 3.15Å; R75-E78 PolarHBondContact O-N 2.97Å; R75-I79 HydrophobicContact CG-CD1 4.26Å; R75-I79 WeakPolarHBondContact O-CD1 3.48Å; R75-I79 VanDerWaalsContact O-CG1 3.25Å; R75-I79 WeakPolarHBondContact O-CG1 3.27Å; R75-I79 PolarHBondContact O-N 3.19Å
76	Q	82.4	Confident	79.9	Confident	95 Å²	95	87.4 Å²	87.4	44%	0.444	46%	0.455	S	S	.	.	H	α-helix	trans	-65.7	-38.1	176	-67.1	-63.6	-20.7	0	0	112	E72 M73 I79 A80	E72-Q76 HydrophobicContact CG-CG 4.28Å; E72-Q76 WeakPolarHBondContact O-CB 3.49Å; E72-Q76 VanDerWaalsContact O-CG 3.26Å; E72-Q76 WeakPolarHBondContact O-CG 3.35Å; E72-Q76 PolarHBondContact O-N 2.73Å; E72-Q76 PolarHBondContact OE1-NE2 3.25Å; M73-Q76 PolarHBondContact O-N 3.27Å; Q76-I79 PolarHBondContact O-N 3.22Å; Q76-A80 WeakPolarHBondContact O-CB 3.34Å; Q76-A80 PolarHBondContact O-N 2.96Å
77	M	81	Confident	80.6	Confident	92 Å²	92	88.5 Å²	88.5	45%	0.453	46%	0.455	S	S	.	.	H	α-helix	trans	-64.6	-39.3	175.8	-169.2	-175.9	-62.3	0	0	112.5	M73 H74 A80 K81	M73-M77 WeakPolarHBondContact O-CB 3.34Å; M73-M77 PolarHBondContact O-N 2.86Å; H74-M77 PolarHBondContact O-N 2.99Å; M77-A80 PolarHBondContact O-N 2.81Å; M77-K81 PolarHBondContact O-N 2.96Å
78	E	81.9	Confident	81.4	Confident	73 Å²	73	90.1 Å²	90.1	34%	0.341	47%	0.468	S	S	.	.	H	α-helix	trans	-71.7	-37.8	175.6	178.7	60.1	-171.9	0	0	112.2	H74 R75 A80 K81 R82	H74-E78 PolarHBondContact O-N 2.87Å; R75-E78 PolarHBondContact O-N 2.97Å; E78-A80 VanDerWaalsContact C-N 3.34Å; E78-K81 PolarHBondContact O-N 2.82Å; E78-R82 WeakPolarHBondContact O-CG 3.2Å; E78-R82 PolarHBondContact O-N 2.85Å; E78-R82 IonicContact OE1-CZ 2.71Å; E78-R82 IonicContact OE1-NE 2.78Å; E78-R82 PolarHBondContact OE1-NE 2.81Å; E78-R82 IonicContact OE1-NH2 3.42Å; E78-R82 PolarHBondContact OE1-NH2 3.47Å
79	I	84.8	Confident	82.1	Confident	69 Å²	69	94.8 Å²	94.8	35%	0.354	48%	0.478	S	S	.	.	H	α-helix	trans	-59.5	-46.2	170.4	-70.9	164.4	0	0	0	110.3	R75 Q76 R82 L83	R75-I79 HydrophobicContact CG-CD1 4.26Å; R75-I79 WeakPolarHBondContact O-CD1 3.48Å; R75-I79 VanDerWaalsContact O-CG1 3.25Å; R75-I79 WeakPolarHBondContact O-CG1 3.27Å; R75-I79 PolarHBondContact O-N 3.19Å; Q76-I79 PolarHBondContact O-N 3.22Å; I79-R82 PolarHBondContact O-N 3.06Å; I79-L83 HydrophobicContact CG2-CD1 4.26Å; I79-L83 WeakPolarHBondContact O-CB 3.38Å; I79-L83 PolarHBondContact O-N 3.03Å
80	A	79.3	Confident	82.7	Confident	55 Å²	55	93 Å²	93	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-63.2	-41.7	177.9	0	0	0	0	0	112.6	Q76 M77 E78 R82 L83 S84	Q76-A80 WeakPolarHBondContact O-CB 3.34Å; Q76-A80 PolarHBondContact O-N 2.96Å; M77-A80 PolarHBondContact O-N 2.81Å; E78-A80 VanDerWaalsContact C-N 3.34Å; A80-R82 PolarHBondContact O-N 2.95Å; A80-L83 PolarHBondContact O-N 2.91Å; A80-S84 WeakPolarHBondContact O-CB 3.19Å; A80-S84 PolarHBondContact O-N 2.82Å
81	K	85.8	Confident	83	Confident	132 Å²	132	91.3 Å²	91.3	57%	0.574	46%	0.462	S	S	*	.	H	α-helix	trans	-56.5	-48.3	171.6	-84.9	176.8	175.2	171.9	0	111.8	M77 E78 S84 A85	M77-K81 PolarHBondContact O-N 2.96Å; E78-K81 PolarHBondContact O-N 2.82Å; K81-S84 PolarHBondContact O-N 2.93Å; K81-A85 WeakPolarHBondContact O-CB 3.42Å; K81-A85 PolarHBondContact O-N 3.49Å
82	R	88.8	Confident	83.4	Confident	158 Å²	158	89.7 Å²	89.7	60%	0.596	46%	0.459	S	S	*	.	H	α-helix	trans	-65.8	-42.1	-179.7	-69.5	177.2	-170.8	-157.6	3.4	112.1	E78 I79 A80 A85 I86	E78-R82 WeakPolarHBondContact O-CG 3.2Å; E78-R82 PolarHBondContact O-N 2.85Å; E78-R82 IonicContact OE1-CZ 2.71Å; E78-R82 IonicContact OE1-NE 2.78Å; E78-R82 PolarHBondContact OE1-NE 2.81Å; E78-R82 IonicContact OE1-NH2 3.42Å; E78-R82 PolarHBondContact OE1-NH2 3.47Å; I79-R82 PolarHBondContact O-N 3.06Å; A80-R82 PolarHBondContact O-N 2.95Å; R82-A85 PolarHBondContact O-N 2.93Å; R82-I86 VanDerWaalsContact O-CG1 3.28Å; R82-I86 WeakPolarHBondContact O-CG1 3.33Å; R82-I86 PolarHBondContact O-N 2.75Å
83	L	85.8	Confident	83.8	Confident	97 Å²	97	94.8 Å²	94.8	51%	0.508	48%	0.48	S	S	.	.	H	α-helix	trans	-59.2	-45.9	172.9	-99.7	163.9	0	0	0	111.9	I79 A80 A85 I86 L87	I79-L83 HydrophobicContact CG2-CD1 4.26Å; I79-L83 WeakPolarHBondContact O-CB 3.38Å; I79-L83 PolarHBondContact O-N 3.03Å; A80-L83 PolarHBondContact O-N 2.91Å; L83-A85 PolarHBondContact O-N 2.65Å; L83-I86 PolarHBondContact O-N 3.03Å; L83-L87 WeakPolarHBondContact O-CB 3.45Å; L83-L87 VanDerWaalsContact O-CG 3.31Å; L83-L87 WeakPolarHBondContact O-CG 3.26Å; L83-L87 PolarHBondContact O-N 2.92Å
84	S	84.4	Confident	83.9	Confident	61 Å²	61	93.6 Å²	93.6	43%	0.427	48%	0.475	S	S	.	.	H	α-helix	trans	-62.5	-41.1	177.6	-169.7	0	0	0	0	112.6	A80 K81 L87 T88	A80-S84 WeakPolarHBondContact O-CB 3.19Å; A80-S84 PolarHBondContact O-N 2.82Å; K81-S84 PolarHBondContact O-N 2.93Å; S84-L87 PolarHBondContact O-N 2.9Å; S84-T88 WeakPolarHBondContact O-CB 3.37Å; S84-T88 PolarHBondContact O-N 2.91Å; S84-T88 PolarHBondContact O-OG1 2.83Å
85	A	84.1	Confident	84.2	Confident	51 Å²	51	91.7 Å²	91.7	42%	0.421	47%	0.474	S	S	.	.	H	α-helix	trans	-64.6	-43.4	174.9	0	0	0	0	0	112.4	K81 R82 L83 T88 Q89	K81-A85 WeakPolarHBondContact O-CB 3.42Å; K81-A85 PolarHBondContact O-N 3.49Å; R82-A85 PolarHBondContact O-N 2.93Å; L83-A85 PolarHBondContact O-N 2.65Å; A85-T88 PolarHBondContact O-N 3.09Å; A85-Q89 WeakPolarHBondContact O-CG 3.27Å; A85-Q89 PolarHBondContact O-N 2.88Å; A85-Q89 VanDerWaalsContact O-N 3.08Å
86	I	87.9	Confident	84.1	Confident	96 Å²	96	92.9 Å²	92.9	49%	0.492	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-46	175.6	-68.7	164.1	0	0	0	110.6	R82 L83 T88 Q89 V90	R82-I86 VanDerWaalsContact O-CG1 3.28Å; R82-I86 WeakPolarHBondContact O-CG1 3.33Å; R82-I86 PolarHBondContact O-N 2.75Å; L83-I86 PolarHBondContact O-N 3.03Å; I86-T88 VanDerWaalsContact C-N 3.27Å; I86-T88 PolarHBondContact O-N 2.92Å; I86-Q89 PolarHBondContact O-N 3.37Å; I86-Q89 VanDerWaalsContact O-N 3.1Å; I86-V90 HydrophobicContact CG2-CG2 4.2Å; I86-V90 WeakPolarHBondContact O-CG2 3.4Å; I86-V90 PolarHBondContact O-N 3.2Å
87	L	82.7	Confident	84.1	Confident	60 Å²	60	95.6 Å²	95.6	31%	0.314	50%	0.498	S	S	.	.	H	α-helix	trans	-59.2	-39.2	177	-75.8	163.5	0	0	0	111.8	L83 S84 Q89 V90 L91 V102 I106	L83-L87 WeakPolarHBondContact O-CB 3.45Å; L83-L87 VanDerWaalsContact O-CG 3.31Å; L83-L87 WeakPolarHBondContact O-CG 3.26Å; L83-L87 PolarHBondContact O-N 2.92Å; S84-L87 PolarHBondContact O-N 2.9Å; L87-Q89 VanDerWaalsContact C-N 3.34Å; L87-Q89 PolarHBondContact O-N 2.86Å; L87-V90 PolarHBondContact O-N 2.74Å; L87-L91 WeakPolarHBondContact O-CB 3.49Å; L87-L91 PolarHBondContact O-N 3.33Å; L87-V102 HydrophobicContact CD2-CG1 4.31Å; L87-I106 HydrophobicContact CB-CD1 4.17Å; L87-I106 HydrophobicContact CD1-CD1 3.96Å; L87-I106 HydrophobicContact CD1-CG1 4.1Å; L87-I106 HydrophobicContact CD2-CD1 4.38Å; L87-I106 HydrophobicContact CG-CD1 4.4Å
88	T	84.8	Confident	84.3	Confident	97 Å²	97	95.8 Å²	95.8	60%	0.595	50%	0.498	S	S	*	.	H	α-helix	trans	-66.3	-34.7	176.4	-55.9	0	0	0	0	112.2	S84 A85 I86 P92	S84-T88 WeakPolarHBondContact O-CB 3.37Å; S84-T88 PolarHBondContact O-N 2.91Å; S84-T88 PolarHBondContact O-OG1 2.83Å; A85-T88 PolarHBondContact O-N 3.09Å; I86-T88 VanDerWaalsContact C-N 3.27Å; I86-T88 PolarHBondContact O-N 2.92Å; T88-P92 WeakPolarHBondContact O-CD 3.45Å
89	Q	86.5	Confident	84.4	Confident	142 Å²	142	94.8 Å²	94.8	66%	0.664	49%	0.493	S	S	*	.	H	α-helix	trans	-76.2	-31.7	174.5	-70.2	179.4	11.7	0	0	113.4	A85 I86 L87 P92 F93	A85-Q89 WeakPolarHBondContact O-CG 3.27Å; A85-Q89 PolarHBondContact O-N 2.88Å; A85-Q89 VanDerWaalsContact O-N 3.08Å; I86-Q89 PolarHBondContact O-N 3.37Å; I86-Q89 VanDerWaalsContact O-N 3.1Å; L87-Q89 VanDerWaalsContact C-N 3.34Å; L87-Q89 PolarHBondContact O-N 2.86Å; Q89-P92 WeakPolarHBondContact O-CD 3.02Å; Q89-F93 WeakPolarHBondContact O-CD2 3.29Å; Q89-F93 VanDerWaalsContact O-CE2 3.27Å; Q89-F93 WeakPolarHBondContact O-CE2 3.48Å
90	V	85.3	Confident	84.4	Confident	71 Å²	71	95.3 Å²	95.3	43%	0.43	50%	0.503	S	S	.	.	H	α-helix	trans	-82.9	-31.6	-178.8	173.6	0	0	0	0	112.2	I86 L87 P92 F93	I86-V90 HydrophobicContact CG2-CG2 4.2Å; I86-V90 WeakPolarHBondContact O-CG2 3.4Å; I86-V90 PolarHBondContact O-N 3.2Å; L87-V90 PolarHBondContact O-N 2.74Å; V90-P92 VanDerWaalsContact C-CD 3.46Å; V90-F93 PolarHBondContact O-N 3.08Å
91	L	83.6	Confident	84.7	Confident	32 Å²	32	98.7 Å²	98.7	17%	0.168	51%	0.51	C	S	.	.	G	3₁₀ helix	trans	-47.1	-47.9	-177.8	-130.8	81.5	0	0	0	114.4	L87 F93 L94 Q99 V102 L103	L87-L91 WeakPolarHBondContact O-CB 3.49Å; L87-L91 PolarHBondContact O-N 3.33Å; L91-F93 PolarHBondContact O-N 2.75Å; L91-F93 VanDerWaalsContact O-N 3.1Å; L91-L94 PolarHBondContact O-N 2.78Å; L91-Q99 WeakPolarHBondContact O-CG 3.45Å; L91-Q99 PolarHBondContact O-NE2 2.85Å; L91-V102 HydrophobicContact CD1-CB 4.32Å; L91-V102 HydrophobicContact CD1-CG1 3.65Å; L91-L103 HydrophobicContact CD2-CD1 4.12Å; L91-L103 HydrophobicContact CD2-CD2 3.8Å; L91-L103 HydrophobicContact CD2-CG 3.91Å
92	P	83.4	Confident	84.5	Confident	90 Å²	90	94.3 Å²	94.3	58%	0.584	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-63	-16.2	-177.8	-24.6	36.4	0	0	0	115.3	T88 Q89 V90	T88-P92 WeakPolarHBondContact O-CD 3.45Å; Q89-P92 WeakPolarHBondContact O-CD 3.02Å; V90-P92 VanDerWaalsContact C-CD 3.46Å
93	F	85	Confident	84.3	Confident	181 Å²	181	91 Å²	91	79%	0.794	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-94.4	-4.8	-179.2	-60	-80	0	0	0	113.7	Q89 V90 L91	Q89-F93 WeakPolarHBondContact O-CD2 3.29Å; Q89-F93 VanDerWaalsContact O-CE2 3.27Å; Q89-F93 WeakPolarHBondContact O-CE2 3.48Å; V90-F93 PolarHBondContact O-N 3.08Å; L91-F93 PolarHBondContact O-N 2.75Å; L91-F93 VanDerWaalsContact O-N 3.1Å
94	L	82.9	Confident	84.2	Confident	63 Å²	63	90.2 Å²	90.2	33%	0.33	49%	0.49	S	S	.	.	S	Bend	trans	-89.4	152.1	176.6	-72.4	166.6	0	0	0	111.7	L91 H98 Q99 V102	L91-L94 PolarHBondContact O-N 2.78Å; L94-H98 HydrophobicContact CB-CB 4.25Å; L94-H98 HydrophobicContact CD2-CB 4.34Å; L94-Q99 HydrophobicContact CB-CG 3.99Å; L94-Q99 PolarHBondContact O-NE2 3.04Å; L94-V102 HydrophobicContact CD1-CG2 4.11Å
95	S	85.2	Confident	84	Confident	68 Å²	68	90.2 Å²	90.2	48%	0.476	49%	0.494	S	S	.	.			trans	-63.1	149.7	169.8	60	0	0	0	0	111	E97 H98 Q99	S95-E97 PolarHBondContact O-N 3.15Å; S95-E97 VanDerWaalsContact O-N 3.12Å; S95-H98 PolarHBondContact O-N 2.89Å; S95-H98 PolarHBondContact OG-ND1 3.04Å; S95-Q99 PolarHBondContact O-N 2.94Å
96	Q	81.4	Confident	83.8	Confident	167 Å²	167	89.6 Å²	89.6	78%	0.78	48%	0.483	S	S	*	.	H	α-helix	trans	-57.9	-32.6	-169.5	-159.4	177.5	30.4	0	0	113.8	Q99 S100	Q96-Q99 PolarHBondContact O-N 2.92Å; Q96-S100 PolarHBondContact O-N 2.95Å
97	E	82.5	Confident	83.5	Confident	152 Å²	152	89 Å²	89	71%	0.71	48%	0.478	S	S	*	.	H	α-helix	trans	-66.8	-44.3	174.3	-172.4	172.1	-152.9	0	0	112.3	S95 S100 Q101	S95-E97 PolarHBondContact O-N 3.15Å; S95-E97 VanDerWaalsContact O-N 3.12Å; E97-S100 WeakPolarHBondContact O-CB 3.47Å; E97-S100 PolarHBondContact O-N 2.76Å; E97-Q101 PolarHBondContact O-N 3.27Å
98	H	83.3	Confident	83.5	Confident	97 Å²	97	95 Å²	95	45%	0.449	50%	0.496	S	S	.	.	H	α-helix	trans	-68	-35	174.3	-72	121.3	0	0	0	112.3	L94 S95 S100 Q101 V102	L94-H98 HydrophobicContact CB-CB 4.25Å; L94-H98 HydrophobicContact CD2-CB 4.34Å; S95-H98 PolarHBondContact O-N 2.89Å; S95-H98 PolarHBondContact OG-ND1 3.04Å; H98-S100 VanDerWaalsContact C-N 3.28Å; H98-S100 PolarHBondContact O-N 3.23Å; H98-Q101 PolarHBondContact O-N 2.94Å; H98-V102 WeakPolarHBondContact O-CB 3.47Å; H98-V102 WeakPolarHBondContact O-CG2 3.38Å; H98-V102 PolarHBondContact O-N 3.36Å
99	Q	85.3	Confident	82.9	Confident	51 Å²	51	93.7 Å²	93.7	24%	0.238	50%	0.496	C	S	.	.	H	α-helix	trans	-56.6	-44.2	173	-71.1	-179.8	-20.3	0	0	111.2	L91 L94 S95 Q96 V102 L103	L91-Q99 WeakPolarHBondContact O-CG 3.45Å; L91-Q99 PolarHBondContact O-NE2 2.85Å; L94-Q99 HydrophobicContact CB-CG 3.99Å; L94-Q99 PolarHBondContact O-NE2 3.04Å; S95-Q99 PolarHBondContact O-N 2.94Å; Q96-Q99 PolarHBondContact O-N 2.92Å; Q99-V102 PolarHBondContact O-N 2.82Å; Q99-L103 WeakPolarHBondContact O-CB 3.41Å; Q99-L103 WeakPolarHBondContact O-CG 3.13Å; Q99-L103 PolarHBondContact O-N 2.97Å
100	S	84.4	Confident	82.4	Confident	81 Å²	81	93.2 Å²	93.2	57%	0.566	49%	0.492	S	S	*	.	H	α-helix	trans	-61.9	-45.8	177.1	-171.1	0	0	0	0	112.3	Q96 E97 H98 S104	Q96-S100 PolarHBondContact O-N 2.95Å; E97-S100 WeakPolarHBondContact O-CB 3.47Å; E97-S100 PolarHBondContact O-N 2.76Å; H98-S100 VanDerWaalsContact C-N 3.28Å; H98-S100 PolarHBondContact O-N 3.23Å; S100-S104 WeakPolarHBondContact O-CB 3.38Å; S100-S104 PolarHBondContact O-N 2.98Å
101	Q	85.4	Confident	82	Confident	125 Å²	125	96 Å²	96	58%	0.584	50%	0.5	S	S	*	.	H	α-helix	trans	-63.9	-43.6	177.2	-73.6	-173	-8	0	0	112.4	E97 H98 S104 A105	E97-Q101 PolarHBondContact O-N 3.27Å; H98-Q101 PolarHBondContact O-N 2.94Å; Q101-S104 PolarHBondContact O-N 3.29Å; Q101-A105 WeakPolarHBondContact O-CB 3.36Å; Q101-A105 PolarHBondContact O-N 2.89Å
102	V	82.6	Confident	81.4	Confident	41 Å²	41	98.8 Å²	98.8	25%	0.248	52%	0.518	C	S	.	.	H	α-helix	trans	-66	-41.8	-179.8	172.6	0	0	0	0	111.2	L87 L91 L94 H98 Q99 A105 I106	L87-V102 HydrophobicContact CD2-CG1 4.31Å; L91-V102 HydrophobicContact CD1-CB 4.32Å; L91-V102 HydrophobicContact CD1-CG1 3.65Å; L94-V102 HydrophobicContact CD1-CG2 4.11Å; H98-V102 WeakPolarHBondContact O-CB 3.47Å; H98-V102 WeakPolarHBondContact O-CG2 3.38Å; H98-V102 PolarHBondContact O-N 3.36Å; Q99-V102 PolarHBondContact O-N 2.82Å; V102-A105 PolarHBondContact O-N 3Å; V102-I106 HydrophobicContact CG1-CD1 3.79Å; V102-I106 HydrophobicContact CG1-CG1 4.43Å; V102-I106 VanDerWaalsContact O-CG1 3.26Å; V102-I106 WeakPolarHBondContact O-CG1 3.44Å; V102-I106 PolarHBondContact O-N 3.23Å
103	L	83.3	Confident	81	Confident	88 Å²	88	97.7 Å²	97.7	46%	0.461	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-44.6	173.4	-74.7	169.4	0	0	0	111.9	L91 Q99 A105 I106 E107	L91-L103 HydrophobicContact CD2-CD1 4.12Å; L91-L103 HydrophobicContact CD2-CD2 3.8Å; L91-L103 HydrophobicContact CD2-CG 3.91Å; Q99-L103 WeakPolarHBondContact O-CB 3.41Å; Q99-L103 WeakPolarHBondContact O-CG 3.13Å; Q99-L103 PolarHBondContact O-N 2.97Å; L103-A105 VanDerWaalsContact C-N 3.29Å; L103-A105 PolarHBondContact O-N 3.48Å; L103-I106 PolarHBondContact O-N 2.55Å; L103-E107 PolarHBondContact O-N 3.2Å
104	S	84.1	Confident	80.1	Confident	81 Å²	81	95.4 Å²	95.4	57%	0.566	50%	0.503	S	S	*	.	H	α-helix	trans	-60.6	-37.7	175.8	-176.8	0	0	0	0	112.6	S100 Q101 R108	S100-S104 WeakPolarHBondContact O-CB 3.38Å; S100-S104 PolarHBondContact O-N 2.98Å; Q101-S104 PolarHBondContact O-N 3.29Å; S104-R108 WeakPolarHBondContact O-CB 3.27Å; S104-R108 PolarHBondContact O-N 2.99Å; S104-R108 VanDerWaalsContact O-N 3.16Å
105	A	80.7	Confident	79.7	Confident	60 Å²	60	100.4 Å²	100.4	50%	0.496	53%	0.525	S	S	.	.	H	α-helix	trans	-70.4	-40.8	177.1	0	0	0	0	0	112.1	Q101 V102 L103 A109	Q101-A105 WeakPolarHBondContact O-CB 3.36Å; Q101-A105 PolarHBondContact O-N 2.89Å; V102-A105 PolarHBondContact O-N 3Å; L103-A105 VanDerWaalsContact C-N 3.29Å; L103-A105 PolarHBondContact O-N 3.48Å; A105-A109 WeakPolarHBondContact O-CB 3.48Å; A105-A109 PolarHBondContact O-N 2.79Å
106	I	79.8	Confident	79.3	Confident	38 Å²	38	101.3 Å²	101.3	20%	0.195	52%	0.521	C	S	.	.	H	α-helix	trans	-62.7	-46	175.6	-69.8	164.9	0	0	0	110.9	L87 V102 L103 R108 A109 K110	L87-I106 HydrophobicContact CB-CD1 4.17Å; L87-I106 HydrophobicContact CD1-CD1 3.96Å; L87-I106 HydrophobicContact CD1-CG1 4.1Å; L87-I106 HydrophobicContact CD2-CD1 4.38Å; L87-I106 HydrophobicContact CG-CD1 4.4Å; V102-I106 HydrophobicContact CG1-CD1 3.79Å; V102-I106 HydrophobicContact CG1-CG1 4.43Å; V102-I106 VanDerWaalsContact O-CG1 3.26Å; V102-I106 WeakPolarHBondContact O-CG1 3.44Å; V102-I106 PolarHBondContact O-N 3.23Å; L103-I106 PolarHBondContact O-N 2.55Å; I106-R108 VanDerWaalsContact C-N 3.34Å; I106-R108 PolarHBondContact O-N 2.94Å; I106-A109 PolarHBondContact O-N 3Å; I106-K110 PolarHBondContact O-N 3.24Å; I106-K110 VanDerWaalsContact O-N 3.17Å
107	E	81.2	Confident	78.6	Confident	83 Å²	83	97.4 Å²	97.4	39%	0.388	51%	0.506	S	S	.	.	H	α-helix	trans	-68.4	-36.1	-177.7	-139	59.9	-148.2	0	0	111.7	L103 K110 Q111	L103-E107 PolarHBondContact O-N 3.2Å; E107-K110 PolarHBondContact O-N 2.96Å; E107-K110 WeakPolarHBondContact OE1-CD 3.49Å; E107-K110 IonicContact OE1-NZ 3.45Å; E107-K110 PolarHBondContact OE1-NZ 2.96Å; E107-K110 IonicContact OE2-NZ 2.66Å; E107-K110 PolarHBondContact OE2-NZ 2.97Å; E107-Q111 WeakPolarHBondContact O-CG 3.17Å
108	R	82.1	Confident	78.2	Confident	186 Å²	186	94.5 Å²	94.5	70%	0.702	50%	0.495	S	S	*	.	H	α-helix	trans	-62.7	-41.8	170.3	-168.9	179.7	-168.9	131.4	5.7	112.1	S104 I106 K110 Q111	S104-R108 WeakPolarHBondContact O-CB 3.27Å; S104-R108 PolarHBondContact O-N 2.99Å; S104-R108 VanDerWaalsContact O-N 3.16Å; I106-R108 VanDerWaalsContact C-N 3.34Å; I106-R108 PolarHBondContact O-N 2.94Å; R108-K110 PolarHBondContact O-N 2.97Å; R108-Q111 PolarHBondContact O-N 2.92Å
109	A	73.9	Confident	77.8	Confident	70 Å²	70	93.4 Å²	93.4	58%	0.579	50%	0.498	S	S	*	.	H	α-helix	trans	-66.6	-21.4	179.3	0	0	0	0	0	113.7	A105 I106 Q111	A105-A109 WeakPolarHBondContact O-CB 3.48Å; A105-A109 PolarHBondContact O-N 2.79Å; I106-A109 PolarHBondContact O-N 3Å; A109-Q111 VanDerWaalsContact C-N 3.34Å
110	K	74.7	Confident	77.2	Confident	133 Å²	133	94.8 Å²	94.8	58%	0.578	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-16.6	170.4	-66.8	168.1	-179.4	164	0	113.8	I106 E107 R108	I106-K110 PolarHBondContact O-N 3.24Å; I106-K110 VanDerWaalsContact O-N 3.17Å; E107-K110 PolarHBondContact O-N 2.96Å; E107-K110 WeakPolarHBondContact OE1-CD 3.49Å; E107-K110 IonicContact OE1-NZ 3.45Å; E107-K110 PolarHBondContact OE1-NZ 2.96Å; E107-K110 IonicContact OE2-NZ 2.66Å; E107-K110 PolarHBondContact OE2-NZ 2.97Å; R108-K110 PolarHBondContact O-N 2.97Å
111	Q	77.7	Confident	76.4	Confident	130 Å²	130	94.9 Å²	94.9	61%	0.607	50%	0.504	S	S	*	.			trans	-104.3	16.9	-167.8	-69.4	174.7	2.7	0	0	113.5	E107 R108 A109 T113	E107-Q111 WeakPolarHBondContact O-CG 3.17Å; R108-Q111 PolarHBondContact O-N 2.92Å; A109-Q111 VanDerWaalsContact C-N 3.34Å; Q111-T113 PolarHBondContact O-N 3.48Å; Q111-T113 VanDerWaalsContact O-N 3.08Å
112	V	69.7	Low	75.8	Confident	89 Å²	89	91.6 Å²	91.6	54%	0.539	50%	0.498	S	S	.	.			trans	-53.3	116	179.4	177.7	0	0	0	0	110.5	E116	V112-E116 HydrophobicContact CG1-CB 4.34Å
113	T	75.6	Confident	75	Confident	67 Å²	67	92.2 Å²	92.2	41%	0.411	51%	0.507	S	S	.	.			trans	-80.9	157.8	-178.3	63	0	0	0	0	111.8	Q111 Q115 E116 L117	Q111-T113 PolarHBondContact O-N 3.48Å; Q111-T113 VanDerWaalsContact O-N 3.08Å; T113-Q115 PolarHBondContact O-N 3.34Å; T113-E116 WeakPolarHBondContact CB-OE2 3.48Å; T113-E116 WeakPolarHBondContact CG2-OE2 3.33Å; T113-E116 PolarHBondContact N-OE2 3.33Å; T113-E116 PolarHBondContact O-N 3Å; T113-E116 VanDerWaalsContact O-N 3.14Å; T113-E116 WeakPolarHBondContact OG1-CG 3.09Å; T113-E116 PolarHBondContact OG1-N 2.9Å; T113-E116 PolarHBondContact OG1-OE2 3.25Å; T113-L117 PolarHBondContact O-N 2.81Å
114	M	65.6	Low	73.8	Confident	134 Å²	134	93.6 Å²	93.6	66%	0.66	51%	0.511	S	S	*	.	H	α-helix	trans	-60	-26.1	172.6	-166.5	63.6	70.3	0	0	112.3	L117 N118	M114-L117 HydrophobicContact SD-CD2 4.02Å; M114-N118 WeakPolarHBondContact O-CB 2.88Å; M114-N118 VanDerWaalsContact O-CG 3.26Å; M114-N118 PolarHBondContact O-N 3.2Å; M114-N118 VanDerWaalsContact O-N 3.08Å; M114-N118 PolarHBondContact O-ND2 2.86Å
115	Q	75.4	Confident	72.8	Confident	168 Å²	168	94.1 Å²	94.1	79%	0.785	51%	0.507	S	S	*	.	H	α-helix	trans	-71.5	-43.9	173.4	-88.7	-179.2	-55.6	0	0	112.5	T113 N118 S119	T113-Q115 PolarHBondContact O-N 3.34Å; Q115-N118 PolarHBondContact O-N 3.02Å; Q115-S119 PolarHBondContact O-N 3.35Å
116	E	76	Confident	71.6	Confident	87 Å²	87	97.5 Å²	97.5	41%	0.407	51%	0.512	S	S	.	.	H	α-helix	trans	-65	-40.1	174.1	-71	160.4	125.6	0	0	111.5	V112 T113 N118 S119 V120	V112-E116 HydrophobicContact CG1-CB 4.34Å; T113-E116 WeakPolarHBondContact CB-OE2 3.48Å; T113-E116 WeakPolarHBondContact CG2-OE2 3.33Å; T113-E116 PolarHBondContact N-OE2 3.33Å; T113-E116 PolarHBondContact O-N 3Å; T113-E116 VanDerWaalsContact O-N 3.14Å; T113-E116 WeakPolarHBondContact OG1-CG 3.09Å; T113-E116 PolarHBondContact OG1-N 2.9Å; T113-E116 PolarHBondContact OG1-OE2 3.25Å; E116-N118 VanDerWaalsContact C-N 3.35Å; E116-N118 PolarHBondContact O-N 2.56Å; E116-S119 PolarHBondContact O-N 2.88Å; E116-S119 PolarHBondContact O-OG 3.42Å; E116-V120 WeakPolarHBondContact O-CG2 3.35Å; E116-V120 PolarHBondContact O-N 3.48Å
117	L	68.3	Low	70.2	Confident	85 Å²	85	101 Å²	101	45%	0.445	53%	0.531	S	S	.	.	H	α-helix	trans	-60.4	-44.3	175.3	-169.6	70.5	0	0	0	111.8	T113 M114 S119 V120 L121	T113-L117 PolarHBondContact O-N 2.81Å; M114-L117 HydrophobicContact SD-CD2 4.02Å; L117-S119 VanDerWaalsContact C-N 3.34Å; L117-S119 PolarHBondContact O-N 3.38Å; L117-V120 PolarHBondContact O-N 3.2Å; L117-L121 HydrophobicContact CG-CD1 4.43Å; L117-L121 WeakPolarHBondContact O-CG 3.47Å; L117-L121 PolarHBondContact O-N 2.93Å
118	N	72.1	Confident	68.8	Low	91 Å²	91	102.7 Å²	102.7	49%	0.487	55%	0.547	S	S	.	.	H	α-helix	trans	-65.4	-33.1	176.1	-79.1	-37.1	0	0	0	113	M114 Q115 E116 A122	M114-N118 WeakPolarHBondContact O-CB 2.88Å; M114-N118 VanDerWaalsContact O-CG 3.26Å; M114-N118 PolarHBondContact O-N 3.2Å; M114-N118 VanDerWaalsContact O-N 3.08Å; M114-N118 PolarHBondContact O-ND2 2.86Å; Q115-N118 PolarHBondContact O-N 3.02Å; E116-N118 VanDerWaalsContact C-N 3.35Å; E116-N118 PolarHBondContact O-N 2.56Å; N118-A122 WeakPolarHBondContact O-CB 3.42Å; N118-A122 PolarHBondContact O-N 3.49Å
119	S	76.4	Confident	67.1	Low	73 Å²	73	100.7 Å²	100.7	51%	0.51	54%	0.543	S	S	.	.	H	α-helix	trans	-72.6	-35.6	176.5	72	0	0	0	0	112.5	Q115 E116 L117 A122 A123	Q115-S119 PolarHBondContact O-N 3.35Å; E116-S119 PolarHBondContact O-N 2.88Å; E116-S119 PolarHBondContact O-OG 3.42Å; L117-S119 VanDerWaalsContact C-N 3.34Å; L117-S119 PolarHBondContact O-N 3.38Å; S119-A122 PolarHBondContact O-N 3.37Å; S119-A123 PolarHBondContact O-N 2.8Å
120	V	72.5	Confident	65.5	Low	81 Å²	81	101.5 Å²	101.5	49%	0.491	55%	0.545	S	S	.	.	H	α-helix	trans	-66.3	-43.3	172.5	174.4	0	0	0	0	111.3	E116 L117 A122 A123 Q124	E116-V120 WeakPolarHBondContact O-CG2 3.35Å; E116-V120 PolarHBondContact O-N 3.48Å; L117-V120 PolarHBondContact O-N 3.2Å; V120-A122 PolarHBondContact O-N 2.85Å; V120-A123 PolarHBondContact O-N 3.37Å; V120-Q124 PolarHBondContact O-N 2.9Å
121	L	68.2	Low	63.7	Low	83 Å²	83	99.3 Å²	99.3	44%	0.435	55%	0.546	S	S	.	.	H	α-helix	trans	-61.6	-41.8	174.6	-78.4	166.5	0	0	0	112.1	L117 Q124 I125	L117-L121 HydrophobicContact CG-CD1 4.43Å; L117-L121 WeakPolarHBondContact O-CG 3.47Å; L117-L121 PolarHBondContact O-N 2.93Å; L121-Q124 PolarHBondContact O-N 2.61Å; L121-I125 WeakPolarHBondContact O-CD1 3.35Å; L121-I125 VanDerWaalsContact O-CG1 3.28Å; L121-I125 WeakPolarHBondContact O-CG1 3.35Å; L121-I125 PolarHBondContact O-N 2.8Å; L121-I125 VanDerWaalsContact O-N 3.12Å
122	A	71.8	Confident	61.5	Low	56 Å²	56	101.9 Å²	101.9	46%	0.463	56%	0.556	S	S	.	*	H	α-helix	trans	-60.7	-45.3	175.4	0	0	0	0	0	111.9	N118 S119 V120 I125 E126	N118-A122 WeakPolarHBondContact O-CB 3.42Å; N118-A122 PolarHBondContact O-N 3.49Å; S119-A122 PolarHBondContact O-N 3.37Å; V120-A122 PolarHBondContact O-N 2.85Å; A122-I125 PolarHBondContact O-N 2.81Å; A122-E126 PolarHBondContact O-N 3.06Å
123	A	66.8	Low	59.5	Low	54 Å²	54	107 Å²	107	45%	0.446	57%	0.571	S	S	.	*	H	α-helix	trans	-61.7	-45.9	177.6	0	0	0	0	0	112.6	S119 V120 I125 E126 D127	S119-A123 PolarHBondContact O-N 2.8Å; V120-A123 PolarHBondContact O-N 3.37Å; A123-I125 VanDerWaalsContact C-N 3.26Å; A123-I125 PolarHBondContact O-N 3.19Å; A123-E126 PolarHBondContact O-N 3.11Å; A123-D127 PolarHBondContact O-N 2.83Å
124	Q	57.9	Low	57.3	Low	117 Å²	117	113.7 Å²	113.7	55%	0.547	59%	0.594	S	S	.	*	H	α-helix	trans	-61.2	-34.3	176.8	-74	-173	-29.6	0	0	112.8	V120 L121 E126 D127 V128	V120-Q124 PolarHBondContact O-N 2.9Å; L121-Q124 PolarHBondContact O-N 2.61Å; Q124-E126 VanDerWaalsContact C-N 3.26Å; Q124-E126 PolarHBondContact O-N 3.09Å; Q124-D127 PolarHBondContact O-N 3.04Å; Q124-V128 VanDerWaalsContact O-CG2 3.31Å; Q124-V128 WeakPolarHBondContact O-CG2 3.05Å; Q124-V128 PolarHBondContact O-N 2.97Å; Q124-V128 VanDerWaalsContact O-N 3.08Å
125	I	62.1	Low	55.5	Low	91 Å²	91	114.7 Å²	114.7	47%	0.467	60%	0.603	S	S	.	*	H	α-helix	trans	-68.1	-25.2	175.5	-70.3	165.8	0	0	0	111.9	L121 A122 A123 K129	L121-I125 WeakPolarHBondContact O-CD1 3.35Å; L121-I125 VanDerWaalsContact O-CG1 3.28Å; L121-I125 WeakPolarHBondContact O-CG1 3.35Å; L121-I125 PolarHBondContact O-N 2.8Å; L121-I125 VanDerWaalsContact O-N 3.12Å; A122-I125 PolarHBondContact O-N 2.81Å; A123-I125 VanDerWaalsContact C-N 3.26Å; A123-I125 PolarHBondContact O-N 3.19Å; I125-K129 WeakPolarHBondContact O-CD 3.45Å; I125-K129 VanDerWaalsContact O-CG 3.26Å; I125-K129 WeakPolarHBondContact O-CG 3.47Å; I125-K129 PolarHBondContact O-N 3.09Å
126	E	55.1	Low	53.2	Low	132 Å²	132	109.8 Å²	109.8	62%	0.617	60%	0.597	S	S	*	*	H	α-helix	trans	-84.3	-36.3	173.6	-60.6	-150.2	134.6	0	0	113.2	A122 A123 Q124 V128 K129 S130	A122-E126 PolarHBondContact O-N 3.06Å; A123-E126 PolarHBondContact O-N 3.11Å; Q124-E126 VanDerWaalsContact C-N 3.26Å; Q124-E126 PolarHBondContact O-N 3.09Å; E126-V128 VanDerWaalsContact C-N 3.35Å; E126-V128 PolarHBondContact O-N 3.4Å; E126-K129 PolarHBondContact O-N 2.89Å; E126-S130 WeakPolarHBondContact O-CB 3.46Å; E126-S130 PolarHBondContact O-N 2.81Å; E126-S130 PolarHBondContact O-OG 2.92Å
127	D	51.1	Low	50.9	Low	110 Å²	110	113.5 Å²	113.5	59%	0.588	62%	0.62	S	S	*	*	H	α-helix	trans	-61.4	-41.9	172.3	-84	-28.6	0	0	0	111.9	A123 Q124 K129 S130 S131	A123-D127 PolarHBondContact O-N 2.83Å; Q124-D127 PolarHBondContact O-N 3.04Å; D127-K129 VanDerWaalsContact C-N 3.31Å; D127-K129 PolarHBondContact O-N 3.48Å; D127-S130 PolarHBondContact O-N 3.15Å; D127-S130 VanDerWaalsContact O-N 3.1Å; D127-S131 PolarHBondContact O-N 3.11Å; D127-S131 VanDerWaalsContact O-N 3.08Å; D127-S131 PolarHBondContact O-OG 2.78Å
128	V	52	Low	49.2	Very low	119 Å²	119	117.3 Å²	117.3	72%	0.721	64%	0.64	S	S	*	*	H	α-helix	trans	-65.5	-32.3	176.3	170.9	0	0	0	0	112	Q124 E126	Q124-V128 VanDerWaalsContact O-CG2 3.31Å; Q124-V128 WeakPolarHBondContact O-CG2 3.05Å; Q124-V128 PolarHBondContact O-N 2.97Å; Q124-V128 VanDerWaalsContact O-N 3.08Å; E126-V128 VanDerWaalsContact C-N 3.35Å; E126-V128 PolarHBondContact O-N 3.4Å
129	K	45.2	Very low	47.3	Very low	144 Å²	144	118.7 Å²	118.7	63%	0.626	65%	0.645	S	S	*	*	H	α-helix	trans	-74.2	-27.2	172	-71.9	168.6	-172.5	170.8	0	113	I125 E126 D127	I125-K129 WeakPolarHBondContact O-CD 3.45Å; I125-K129 VanDerWaalsContact O-CG 3.26Å; I125-K129 WeakPolarHBondContact O-CG 3.47Å; I125-K129 PolarHBondContact O-N 3.09Å; E126-K129 PolarHBondContact O-N 2.89Å; D127-K129 VanDerWaalsContact C-N 3.31Å; D127-K129 PolarHBondContact O-N 3.48Å
130	S	41.7	Very low	44.9	Very low	87 Å²	87	118.9 Å²	118.9	61%	0.608	66%	0.659	S	S	*	*	H	α-helix	trans	-81.2	-29.1	-176.6	-60.3	0	0	0	0	112.9	E126 D127 K132	E126-S130 WeakPolarHBondContact O-CB 3.46Å; E126-S130 PolarHBondContact O-N 2.81Å; E126-S130 PolarHBondContact O-OG 2.92Å; D127-S130 PolarHBondContact O-N 3.15Å; D127-S130 VanDerWaalsContact O-N 3.1Å; S130-K132 VanDerWaalsContact C-N 3.29Å; S130-K132 PolarHBondContact O-N 3.22Å
131	S	37.2	Very low	43.1	Very low	87 Å²	87	120.9 Å²	120.9	61%	0.608	67%	0.667	S	S	*	*			trans	-75.6	68.7	-178.6	-65.3	0	0	0	0	113.8	D127 F133	D127-S131 PolarHBondContact O-N 3.11Å; D127-S131 VanDerWaalsContact O-N 3.08Å; D127-S131 PolarHBondContact O-OG 2.78Å; S131-F133 PolarHBondContact O-N 3.47Å
132	K	31.8	Very low	41.3	Very low	185 Å²	185	120.8 Å²	120.8	80%	0.804	67%	0.671	S	S	*	*			trans	-65.1	11.1	179.1	-95.4	-178.7	178.2	174.5	0	116.7	S130	S130-K132 VanDerWaalsContact C-N 3.29Å; S130-K132 PolarHBondContact O-N 3.22Å
133	F	25.8	Very low	39.7	Very low	197 Å²	197	125.4 Å²	125.4	86%	0.864	69%	0.687	S	S	*	*			trans	-137.5	80.2	178.5	-73.3	-80.4	0	0	0	111.6	S131	S131-F133 PolarHBondContact O-N 3.47Å
134	F	31.1	Very low	38.2	Very low	206 Å²	206	130.5 Å²	130.5	90%	0.904	70%	0.702	S	S	*	*			trans	-131.7	144.5	150.1	-132.4	-92.8	0	0	0	110.6
135	N	27.6	Very low	37.1	Very low	156 Å²	156	130.9 Å²	130.9	83%	0.834	70%	0.704	S	S	*	*			trans	-80.8	157.5	-165	-156.6	8.5	0	0	0	112.2	N137	N135-N137 PolarHBondContact O-N 2.9Å; N135-N137 VanDerWaalsContact O-N 3.08Å
136	G	26.8	Very low	35.8	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	71%	0.712	S	S	*	*	S	Bend	trans	-65.3	105.7	-164.9	0	0	0	0	0	115.6
137	N	26.8	Very low	34.8	Very low	165 Å²	165	133.4 Å²	133.4	88%	0.882	71%	0.711	S	S	*	*			trans	-177	100.4	134.3	-97.5	-4.1	0	0	0	109.1	N135	N135-N137 PolarHBondContact O-N 2.9Å; N135-N137 VanDerWaalsContact O-N 3.08Å
138	N	33.4	Very low	33.9	Very low	164 Å²	164	130.9 Å²	130.9	88%	0.877	71%	0.706	S	S	*	*			trans	-151.9	158.2	165.3	-154.6	-3.1	0	0	0	111.5	G140	N138-G140 PolarHBondContact O-N 2.95Å
139	M	31.5	Very low	32.9	Very low	120 Å²	120	130.8 Å²	130.8	59%	0.591	69%	0.693	S	S	*	*			trans	-61.5	114.4	-173	-73.3	-70.1	-118.7	0	0	112.8	L141 E256	M139-L141 PolarHBondContact O-N 2.98Å; M139-E256 WeakPolarHBondContact CE-OE1 3.21Å
140	G	26.7	Very low	32.4	Very low	78 Å²	78	130.3 Å²	130.3	80%	0.804	69%	0.691	S	S	*	*			trans	-75.7	68.3	167.5	0	0	0	0	0	111.7	N138 P142	N138-G140 PolarHBondContact O-N 2.95Å; G140-P142 WeakPolarHBondContact O-CD 3.3Å
141	L	34.6	Very low	32	Very low	123 Å²	123	133.4 Å²	133.4	64%	0.644	70%	0.696	S	S	*	*			trans	-62.1	123.2	169.2	-83.6	168.3	0	0	0	109.5	M139 L143	M139-L141 PolarHBondContact O-N 2.98Å; L141-L143 PolarHBondContact O-N 3.31Å
142	P	30.2	Very low	31.7	Very low	81 Å²	81	136.2 Å²	136.2	53%	0.526	70%	0.703	S	S	.	*			trans	-62.6	129.2	170.9	-20.6	33.6	0	0	0	109.8	G140 E144 Q145	G140-P142 WeakPolarHBondContact O-CD 3.3Å; P142-E144 PolarHBondContact O-N 2.92Å; P142-Q145 PolarHBondContact O-N 2.86Å
143	L	37.5	Very low	31.6	Very low	152 Å²	152	132 Å²	132	80%	0.796	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-22.4	-170.8	-166.7	62	0	0	0	113.4	L141 Q145 F146	L141-L143 PolarHBondContact O-N 3.31Å; L143-Q145 VanDerWaalsContact C-N 3.33Å; L143-Q145 PolarHBondContact O-N 2.85Å; L143-F146 WeakPolarHBondContact O-CB 3.31Å; L143-F146 PolarHBondContact O-N 2.64Å
144	E	35.2	Very low	31.9	Very low	162 Å²	162	128.2 Å²	128.2	76%	0.757	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-34.2	177.7	-59.7	-176.6	150.8	0	0	113.6	P142 F146 E147	P142-E144 PolarHBondContact O-N 2.92Å; E144-F146 PolarHBondContact O-N 2.99Å; E144-E147 PolarHBondContact O-N 2.81Å; E144-E147 VanDerWaalsContact O-N 3.12Å
145	Q	36.5	Very low	31.8	Very low	125 Å²	125	125.9 Å²	125.9	58%	0.584	69%	0.685	S	S	*	*	H	α-helix	trans	-66.9	-18.8	179.3	-76.4	-167.5	-16.8	0	0	113.1	P142 L143 E147	P142-Q145 PolarHBondContact O-N 2.86Å; L143-Q145 VanDerWaalsContact C-N 3.33Å; L143-Q145 PolarHBondContact O-N 2.85Å; Q145-E147 VanDerWaalsContact C-N 3.34Å
146	F	35.1	Very low	31.7	Very low	149 Å²	149	122.3 Å²	122.3	65%	0.654	69%	0.685	S	S	*	*	H	α-helix	trans	-76.8	-21.5	176.4	-144.7	-90.4	0	0	0	112.7	L143 E144 Y149	L143-F146 WeakPolarHBondContact O-CB 3.31Å; L143-F146 PolarHBondContact O-N 2.64Å; E144-F146 PolarHBondContact O-N 2.99Å; F146-Y149 PolarHBondContact O-N 3.42Å
147	E	32.3	Very low	31.6	Very low	127 Å²	127	123 Å²	123	59%	0.593	69%	0.692	S	S	*	*	H	α-helix	trans	-78.1	-29	178	-60.5	-154.3	115.4	0	0	112.6	E144 Q145 Y149 K150 Q151	E144-E147 PolarHBondContact O-N 2.81Å; E144-E147 VanDerWaalsContact O-N 3.12Å; Q145-E147 VanDerWaalsContact C-N 3.34Å; E147-Y149 VanDerWaalsContact C-N 3.25Å; E147-Y149 PolarHBondContact O-N 2.95Å; E147-K150 WeakPolarHBondContact O-CB 3.28Å; E147-K150 PolarHBondContact O-N 2.79Å; E147-K150 VanDerWaalsContact O-N 3.17Å; E147-Q151 PolarHBondContact O-N 3.36Å
148	A	33.8	Very low	31.6	Very low	57 Å²	57	119.5 Å²	119.5	47%	0.471	69%	0.687	S	S	.	*	H	α-helix	trans	-58.5	-39.5	169.4	0	0	0	0	0	111.6	K150 Q151	A148-K150 VanDerWaalsContact C-N 3.31Å; A148-K150 PolarHBondContact O-N 2.96Å; A148-Q151 PolarHBondContact O-N 3.02Å
149	Y	31.2	Very low	31.3	Very low	116 Å²	116	119.3 Å²	119.3	46%	0.455	69%	0.685	S	S	.	*	H	α-helix	trans	-66.2	-30.1	178	-123.4	-82.3	0	0	0	113	Y62 F146 E147	Y62-Y149 VanDerWaalsContact CE2-OH 3.32Å; Y62-Y149 WeakPolarHBondContact CE2-OH 3.38Å; F146-Y149 PolarHBondContact O-N 3.42Å; E147-Y149 VanDerWaalsContact C-N 3.25Å; E147-Y149 PolarHBondContact O-N 2.95Å
150	K	33.9	Very low	31.5	Very low	135 Å²	135	119.4 Å²	119.4	59%	0.587	70%	0.695	S	S	*	*	H	α-helix	trans	-66.7	-33.4	172.5	-83.6	-177.3	174.5	174.6	0	113	E147 A148 S153	E147-K150 WeakPolarHBondContact O-CB 3.28Å; E147-K150 PolarHBondContact O-N 2.79Å; E147-K150 VanDerWaalsContact O-N 3.17Å; A148-K150 VanDerWaalsContact C-N 3.31Å; A148-K150 PolarHBondContact O-N 2.96Å; K150-S153 PolarHBondContact O-N 3.07Å; K150-S153 PolarHBondContact O-OG 3.39Å
151	Q	34	Very low	31.7	Very low	151 Å²	151	119.1 Å²	119.1	71%	0.706	69%	0.692	S	S	*	*	H	α-helix	trans	-71.6	-37.8	-176.9	-65.7	-165.9	5.3	0	0	112.6	E147 A148 S153 V154	E147-Q151 PolarHBondContact O-N 3.36Å; A148-Q151 PolarHBondContact O-N 3.02Å; Q151-S153 VanDerWaalsContact C-N 3.3Å; Q151-S153 PolarHBondContact O-N 2.93Å; Q151-V154 PolarHBondContact O-N 3.41Å
152	L	30.5	Very low	31.4	Very low	147 Å²	147	120 Å²	120	77%	0.77	70%	0.702	S	S	*	*	H	α-helix	trans	-66.3	-28.9	176.6	-82.3	116.5	0	0	0	113.4	V154	L152-V154 PolarHBondContact O-N 3.02Å
153	S	29.9	Very low	31.2	Very low	97 Å²	97	122.4 Å²	122.4	68%	0.678	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-1	178.6	50.8	0	0	0	0	115.8	K150 Q151	K150-S153 PolarHBondContact O-N 3.07Å; K150-S153 PolarHBondContact O-OG 3.39Å; Q151-S153 VanDerWaalsContact C-N 3.3Å; Q151-S153 PolarHBondContact O-N 2.93Å
154	V	30.9	Very low	30.7	Very low	116 Å²	116	118.4 Å²	118.4	70%	0.703	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-15.8	-175.6	178.7	0	0	0	0	113.3	Q151 L152	Q151-V154 PolarHBondContact O-N 3.41Å; L152-V154 PolarHBondContact O-N 3.02Å
155	I	29	Very low	30.3	Very low	157 Å²	157	118.6 Å²	118.6	81%	0.805	72%	0.722	S	S	*	*	S	Bend	trans	-109.6	55.5	-171.8	-41.9	-177.5	0	0	0	111.4
156	G	26.2	Very low	29.8	Very low	81 Å²	81	120.4 Å²	120.4	84%	0.835	73%	0.73	S	S	*	*	S	Bend	trans	-162.3	35	-173.8	0	0	0	0	0	116.1
157	G	25.3	Very low	29.3	Very low	79 Å²	79	117.5 Å²	117.5	81%	0.814	73%	0.733	S	S	*	*	S	Bend	trans	-154.4	18.7	-166.5	0	0	0	0	0	119.5
158	A	26.6	Very low	29.1	Very low	93 Å²	93	115.4 Å²	115.4	77%	0.769	73%	0.733	S	S	*	*			trans	-158.8	116.6	171.9	0	0	0	0	0	114.5
159	N	26.1	Very low	28.7	Very low	159 Å²	159	120 Å²	120	85%	0.85	75%	0.75	S	S	*	*			trans	179.4	159.5	148.2	-101.7	-40.3	0	0	0	109.6
160	P	37	Very low	28.5	Very low	123 Å²	123	121.5 Å²	121.5	80%	0.799	76%	0.764	S	S	*	*			cis	-117.5	158.5	5.4	39.4	-27.8	0	0	0	115.1
161	G	30.4	Very low	28.2	Very low	71 Å²	71	120.9 Å²	120.9	73%	0.732	77%	0.772	S	S	*	*			trans	-154.7	105.9	167.6	0	0	0	0	0	110.8
162	V	27.2	Very low	28.1	Very low	143 Å²	143	119.4 Å²	119.4	87%	0.867	78%	0.779	S	S	*	*			trans	-79	130.2	-170.6	-80	0	0	0	0	113.9
163	S	27.1	Very low	28	Very low	130 Å²	130	118.6 Å²	118.6	91%	0.909	78%	0.775	S	S	*	*			trans	-177.5	140.7	136.3	-83.4	0	0	0	0	112.1
164	G	26.7	Very low	28	Very low	68 Å²	68	122.8 Å²	122.8	70%	0.701	78%	0.784	S	S	*	*			trans	110.4	88.5	148.5	0	0	0	0	0	119.6
165	L	26.4	Very low	28	Very low	167 Å²	167	122.1 Å²	122.1	87%	0.874	78%	0.784	S	S	*	*			trans	74.4	148.9	134.3	-61.1	172	0	0	0	122.3
166	H	26.7	Very low	28	Very low	162 Å²	162	118.8 Å²	118.8	75%	0.75	79%	0.788	S	S	*	*			trans	64	93.5	158.8	-91	-86.3	0	0	0	121.3
167	A	24.4	Very low	28.1	Very low	88 Å²	88	119 Å²	119	73%	0.727	79%	0.791	S	S	*	*			trans	-74	-175	137	0	0	0	0	0	111.2
168	S	28.5	Very low	28.3	Very low	84 Å²	84	120.7 Å²	120.7	59%	0.587	79%	0.79	S	S	*	*			trans	66.9	119.1	-164.2	68.2	0	0	0	0	111.9
169	N	24.5	Very low	28.5	Very low	154 Å²	154	122.9 Å²	122.9	82%	0.824	79%	0.794	S	S	*	*			cis	54	88.4	26.1	-173.6	21.2	0	0	0	113.4
170	L	27.8	Very low	28.8	Very low	146 Å²	146	120 Å²	120	76%	0.764	79%	0.786	S	S	*	*			trans	-157.5	118.9	157.5	-112.8	165.2	0	0	0	110.6
171	T	27.8	Very low	28.6	Very low	123 Å²	123	119.5 Å²	119.5	76%	0.755	79%	0.786	S	S	*	*			trans	-64.7	151.5	160.9	45.7	0	0	0	0	110.4
172	S	30.9	Very low	28.8	Very low	120 Å²	120	121.4 Å²	121.4	84%	0.839	79%	0.788	S	S	*	*			trans	-61.6	134.2	-173.9	51.3	0	0	0	0	114.4
173	N	28	Very low	28.9	Very low	130 Å²	130	121 Å²	121	70%	0.695	79%	0.786	S	S	*	*			trans	-40.3	151.7	170.2	-65.9	-43.7	0	0	0	115.6
174	H	30.5	Very low	29.5	Very low	185 Å²	185	120.9 Å²	120.9	86%	0.856	78%	0.782	S	S	*	*				-172.2	147.1	110.2	-96.5	-73.8	0	0	0	110.5
175	S	30.8	Very low	29.7	Very low	101 Å²	101	121.3 Å²	121.3	71%	0.706	79%	0.786	S	S	*	*			cis	-174.3	135.7	-38.5	46.4	0	0	0	0	110.6
176	G	29.1	Very low	30	Very low	87 Å²	87	118.1 Å²	118.1	90%	0.897	78%	0.778	S	S	*	*			trans	111.1	146.1	158.3	0	0	0	0	0	117.6
177	G	28.6	Very low	30.1	Very low	86 Å²	86	118 Å²	118	89%	0.887	78%	0.782	S	S	*	*			trans	124.8	95.7	174.9	0	0	0	0	0	113.7
178	S	28.6	Very low	30.4	Very low	114 Å²	114	121.6 Å²	121.6	80%	0.797	78%	0.784	S	S	*	*			trans	-126.6	139.6	-166.8	49.2	0	0	0	0	115
179	T	32.3	Very low	30.4	Very low	139 Å²	139	122.9 Å²	122.9	85%	0.853	79%	0.793	S	S	*	*			trans	-159.7	116.4	155.2	11.9	0	0	0	0	114.4
180	S	32.2	Very low	30.6	Very low	99 Å²	99	119.3 Å²	119.3	69%	0.692	79%	0.792	S	S	*	*			trans	38.1	114.4	139.8	60.3	0	0	0	0	124.3
181	S	32.5	Very low	30.5	Very low	112 Å²	112	118.3 Å²	118.3	78%	0.783	80%	0.797	S	S	*	*				88.9	146.5	115.3	69.6	0	0	0	0	124.9
182	S	33.7	Very low	30.6	Very low	112 Å²	112	117.1 Å²	117.1	78%	0.783	80%	0.8	S	S	*	*			trans	82	86.2	157	62.3	0	0	0	0	122.7
183	T	30.3	Very low	30.4	Very low	135 Å²	135	119.2 Å²	119.2	83%	0.828	80%	0.802	S	S	*	*				-78.7	-178.5	127.7	48.2	0	0	0	0	109.2
184	P	38	Very low	30.5	Very low	127 Å²	127	118 Å²	118	83%	0.825	81%	0.81	S	S	*	*			cis	-150.2	-174.4	21.2	45.8	-24.7	0	0	0	119
185	G	31.5	Very low	30.2	Very low	76 Å²	76	117.8 Å²	117.8	78%	0.784	81%	0.809	S	S	*	*			trans	127.9	144	150.7	0	0	0	0	0	116.4
186	S	32.9	Very low	30.1	Very low	101 Å²	101	119.3 Å²	119.3	71%	0.706	81%	0.814	S	S	*	*			cis	-166.5	141	-14.5	67.3	0	0	0	0	113.5
187	L	28.3	Very low	30.1	Very low	159 Å²	159	120.7 Å²	120.7	83%	0.832	81%	0.811	S	S	*	*			trans	64.8	165.4	144.3	-62	167.5	0	0	0	117.8
188	Q	30.7	Very low	29.9	Very low	163 Å²	163	121.8 Å²	121.8	76%	0.762	81%	0.805	S	S	*	*			cis	-155.3	145.9	15.4	-153.9	175.2	2	0	0	113.8
189	S	28.7	Very low	30	Very low	112 Å²	112	124.5 Å²	124.5	78%	0.783	81%	0.809	S	S	*	*			trans	48.1	150.3	151.3	57.2	0	0	0	0	122.5
190	G	28.7	Very low	29.7	Very low	78 Å²	78	125.5 Å²	125.5	80%	0.804	81%	0.809	S	S	*	*			cis	-167.9	-167.9	8.8	0	0	0	0	0	113.5
191	S	25.4	Very low	29.7	Very low	125 Å²	125	126.2 Å²	126.2	87%	0.874	81%	0.811	S	S	*	*			trans	-144.8	153	-166.3	-178.1	0	0	0	0	113.1
192	A	31.5	Very low	29.4	Very low	98 Å²	98	126.2 Å²	126.2	81%	0.81	81%	0.811	S	S	*	*			trans	-155	146.5	168.7	0	0	0	0	0	112.3
193	N	24.8	Very low	29	Very low	164 Å²	164	129.2 Å²	129.2	88%	0.877	82%	0.817	S	S	*	*			trans	-98.1	155	178.3	-82.6	-37.9	0	0	0	112.5
194	A	30.9	Very low	28.9	Very low	105 Å²	105	127.2 Å²	127.2	87%	0.868	81%	0.809	S	S	*	*			trans	-150.8	144.7	142.4	0	0	0	0	0	110.7
195	Q	24	Very low	28.3	Very low	180 Å²	180	128 Å²	128	84%	0.841	81%	0.813	S	S	*	*			trans	-118.5	153.6	173.4	-62.1	169.6	-19.1	0	0	108.4
196	T	28.9	Very low	28.1	Very low	133 Å²	133	129.3 Å²	129.3	82%	0.816	81%	0.811	S	S	*	*				175.4	145.3	126	26.6	0	0	0	0	114.5
197	S	30.2	Very low	27.7	Very low	117 Å²	117	128 Å²	128	82%	0.818	81%	0.813	S	S	*	*			trans	59	123.7	141.5	-55.3	0	0	0	0	122.3
198	S	24.5	Very low	27.5	Very low	109 Å²	109	127 Å²	127	76%	0.762	81%	0.809	S	S	*	*			trans	-84.3	161.3	163.7	49.3	0	0	0	0	112.9
199	L	29.5	Very low	27.4	Very low	171 Å²	171	124.7 Å²	124.7	90%	0.895	81%	0.808	S	S	*	*				-173	162.9	124.3	-98.1	166.2	0	0	0	111
200	L	26.1	Very low	27.2	Very low	160 Å²	160	124.1 Å²	124.1	84%	0.838	80%	0.804	S	S	*	*			trans	-117.7	177.2	-171.3	-63.2	165.8	0	0	0	110.6
201	P	31.5	Very low	27	Very low	114 Å²	114	126.3 Å²	126.3	74%	0.74	80%	0.802	S	S	*	*				-130.6	167.4	-63.1	38.7	-24.4	0	0	0	112.1
202	S	27.2	Very low	26.9	Very low	111 Å²	111	125 Å²	125	78%	0.776	79%	0.793	S	S	*	*			trans	-79.3	127.2	172.1	52.3	0	0	0	0	112.5
203	L	25.6	Very low	26.6	Very low	176 Å²	176	124.1 Å²	124.1	92%	0.921	79%	0.785	S	S	*	*			trans	-69.5	137.5	170.3	-77.7	165	0	0	0	111.2
204	S	26.9	Very low	26.6	Very low	93 Å²	93	120.9 Å²	120.9	65%	0.65	78%	0.781	S	S	*	*			trans	-154.8	118.7	172.9	-73	0	0	0	0	110.5	S206	S204-S206 PolarHBondContact O-N 2.78Å; S204-S206 VanDerWaalsContact O-N 3.1Å
205	P	26.7	Very low	26.4	Very low	142 Å²	142	124.1 Å²	124.1	92%	0.922	78%	0.783	S	S	*	*			trans	-87	71.4	-173.8	34.6	-35.5	0	0	0	112.7	G207	P205-G207 PolarHBondContact O-N 2.93Å
206	S	27.2	Very low	26.6	Very low	105 Å²	105	122.8 Å²	122.8	73%	0.734	78%	0.781	S	S	*	*			trans	-90.7	80.8	171.1	59.4	0	0	0	0	111.3	S204 N208	S204-S206 PolarHBondContact O-N 2.78Å; S204-S206 VanDerWaalsContact O-N 3.1Å; S206-N208 PolarHBondContact O-N 2.86Å
207	G	24.6	Very low	26.3	Very low	73 Å²	73	123.6 Å²	123.6	75%	0.753	78%	0.78	S	S	*	*			trans	-75.2	73.1	-175.8	0	0	0	0	0	115.2	P205	P205-G207 PolarHBondContact O-N 2.93Å
208	N	24.1	Very low	26	Very low	138 Å²	138	120.7 Å²	120.7	74%	0.738	77%	0.769	S	S	*	*			trans	-119.1	104.6	171.7	-88.3	-11.6	0	0	0	111.3	S206 S210	S206-N208 PolarHBondContact O-N 2.86Å; N208-S210 PolarHBondContact O-N 3.29Å
209	P	27.9	Very low	26	Very low	114 Å²	114	123.5 Å²	123.5	74%	0.74	77%	0.774	S	S	*	*			trans	-81.8	56.4	172.2	34.8	-35	0	0	0	111.6	V211	P209-V211 PolarHBondContact O-N 2.86Å; P209-V211 VanDerWaalsContact O-N 3.12Å
210	S	24.1	Very low	25.8	Very low	101 Å²	101	123.1 Å²	123.1	71%	0.706	77%	0.77	S	S	*	*			trans	-85.9	47.9	174.8	63.7	0	0	0	0	111.9	N208	N208-S210 PolarHBondContact O-N 3.29Å
211	V	24.8	Very low	25.7	Very low	124 Å²	124	120.1 Å²	120.1	75%	0.752	76%	0.762	S	S	*	*			trans	-120.6	52.3	-173.8	-70.1	0	0	0	0	111.8	P209	P209-V211 PolarHBondContact O-N 2.86Å; P209-V211 VanDerWaalsContact O-N 3.12Å
212	S	24.9	Very low	25.3	Very low	98 Å²	98	119.6 Å²	119.6	69%	0.685	77%	0.768	S	S	*	*	S	Bend	trans	-138.1	9.7	174.8	-49.5	0	0	0	0	113.8
213	A	24.3	Very low	25.1	Very low	78 Å²	78	119.5 Å²	119.5	65%	0.645	77%	0.774	S	S	*	*	S	Bend	trans	-119.5	2.7	-173.9	0	0	0	0	0	114.8	N217	A213-N217 PolarHBondContact O-ND2 3.03Å
214	A	24.8	Very low	24.9	Very low	96 Å²	96	115 Å²	115	79%	0.793	77%	0.769	S	S	*	*	S	Bend	trans	-109.9	-4.4	-167.9	0	0	0	0	0	115.5
215	L	27.3	Very low	24.8	Very low	173 Å²	173	115.5 Å²	115.5	91%	0.906	78%	0.779	S	S	*	*	S	Bend	trans	-111.3	0.7	-172.4	-135.3	147.4	0	0	0	113.9
216	L	27.2	Very low	24.7	Very low	153 Å²	153	113.5 Å²	113.5	80%	0.801	78%	0.775	S	S	*	*	S	Bend	trans	-106.6	-11.6	177.9	-80	163.9	0	0	0	114.3	G218	L216-G218 PolarHBondContact O-N 2.89Å
217	N	24.1	Very low	24.7	Very low	149 Å²	149	114.4 Å²	114.4	80%	0.797	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	30	-178	-62.8	-23.2	0	0	0	113.6	A213	A213-N217 PolarHBondContact O-ND2 3.03Å
218	G	23.1	Very low	24.6	Very low	57 Å²	57	117.8 Å²	117.8	59%	0.588	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	-8.8	-170.2	0	0	0	0	0	116.4	L216	L216-G218 PolarHBondContact O-N 2.89Å
219	L	24.9	Very low	24.7	Very low	167 Å²	167	114.5 Å²	114.5	87%	0.874	79%	0.785	S	S	*	*			trans	-126.3	84	-178.5	-74.4	163	0	0	0	108.4
220	M	24.5	Very low	24.7	Very low	164 Å²	164	115.3 Å²	115.3	81%	0.808	79%	0.791	S	S	*	*				48.2	92.3	72.2	-62.1	-69.8	-175.9	0	0	111.5
221	S	23.7	Very low	24.8	Very low	97 Å²	97	114.6 Å²	114.6	68%	0.678	80%	0.799	S	S	*	*				84.3	69.2	70.7	179.2	0	0	0	0	113.8
222	A	22.9	Very low	24.8	Very low	103 Å²	103	113 Å²	113	85%	0.851	80%	0.799	S	S	*	*			trans	-158.1	74.4	172.1	0	0	0	0	0	114.7
223	A	24	Very low	24.8	Very low	109 Å²	109	115.6 Å²	115.6	90%	0.901	80%	0.804	S	S	*	*			trans	-166	58.9	163.7	0	0	0	0	0	112.7
224	G	21.6	Very low	24.7	Very low	80 Å²	80	119.3 Å²	119.3	83%	0.825	81%	0.81	S	S	*	*			trans	-162.2	69.9	-174.3	0	0	0	0	0	114.2
225	A	24.9	Very low	24.8	Very low	105 Å²	105	122.2 Å²	122.2	87%	0.868	81%	0.812	S	S	*	*			trans	-141.4	129.9	173.3	0	0	0	0	0	109.9
226	A	24.1	Very low	24.6	Very low	100 Å²	100	122.1 Å²	122.1	83%	0.826	81%	0.807	S	S	*	*			trans	-84.3	156.7	-174.2	0	0	0	0	0	113.1
227	S	26.5	Very low	24.5	Very low	124 Å²	124	120 Å²	120	87%	0.867	80%	0.804	S	S	*	*			trans	-126	108.2	153.6	51.6	0	0	0	0	109.6
228	V	24	Very low	24.6	Very low	144 Å²	144	118.8 Å²	118.8	87%	0.873	81%	0.807	S	S	*	*			trans	-82.6	131.2	172.6	175.4	0	0	0	0	108.8
229	G	26.2	Very low	24.7	Very low	68 Å²	68	120 Å²	120	70%	0.701	82%	0.82	S	S	*	*			trans	-149.1	108.7	176.6	0	0	0	0	0	111.4
230	P	27.9	Very low	24.7	Very low	132 Å²	132	117.1 Å²	117.1	86%	0.857	81%	0.814	S	S	*	*			trans	-86.3	137.5	-178.9	33.2	-33.3	0	0	0	112.1
231	G	25.8	Very low	24.7	Very low	85 Å²	85	119.7 Å²	119.7	88%	0.876	81%	0.814	S	S	*	*			trans	173.9	118	172.5	0	0	0	0	0	111.6
232	A	23.5	Very low	24.8	Very low	92 Å²	92	121.7 Å²	121.7	76%	0.76	82%	0.816	S	S	*	*			trans	-123.7	168.4	-175.4	0	0	0	0	0	112.3
233	L	25	Very low	24.8	Very low	152 Å²	152	121.9 Å²	121.9	80%	0.796	81%	0.812	S	S	*	*			trans	86.4	122.8	162.3	-60.5	171.9	0	0	0	119.9
234	M	23.3	Very low	25	Very low	156 Å²	156	122.6 Å²	122.6	77%	0.768	81%	0.807	S	S	*	*			trans	71.3	150.8	149.2	-61.1	-59.8	-176.8	0	0	118.4
235	L	26.9	Very low	25.1	Very low	157 Å²	157	127.7 Å²	127.7	82%	0.822	81%	0.814	S	S	*	*			cis	-137.5	163.5	13.9	-160	76.8	0	0	0	112.4
236	Q	22.9	Very low	25.2	Very low	171 Å²	171	126.5 Å²	126.5	80%	0.799	81%	0.812	S	S	*	*			trans	-87.1	150.5	172.4	-56.9	167.7	-9	0	0	112.1
237	S	25.3	Very low	25.2	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	82%	0.816	S	S	*	*				168.7	117.8	121	63.2	0	0	0	0	115.7
238	S	25.2	Very low	25.1	Very low	124 Å²	124	136.8 Å²	136.8	87%	0.867	82%	0.819	S	S	*	*			trans	30.9	133.5	140.5	60.6	0	0	0	0	123.6
239	G	25.6	Very low	25.3	Very low	82 Å²	82	135 Å²	135	85%	0.845	82%	0.819	S	S	*	*			trans	177.4	93.2	160.7	0	0	0	0	0	117.5
240	S	24.8	Very low	25.3	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	83%	0.829	S	S	*	*			trans	-65.2	149.5	-173.8	-75.5	0	0	0	0	119.4
241	R	24.1	Very low	25.2	Very low	217 Å²	217	144 Å²	144	82%	0.819	83%	0.829	S	S	*	*			trans	86	125.6	138.5	-79.6	169.1	-163.6	-104.8	4	123.3
242	I	25.5	Very low	25.4	Very low	139 Å²	139	148.2 Å²	148.2	71%	0.713	83%	0.83	S	S	*	*			trans	69.4	111.7	139.9	-56.2	163.3	0	0	0	115.9
243	S	24.5	Very low	25.9	Very low	108 Å²	108	149.2 Å²	149.2	76%	0.755	82%	0.82	S	S	*	*				-156.8	157.8	70.6	-58.1	0	0	0	0	113.5
244	P	28.2	Very low	26.7	Very low	124 Å²	124	144 Å²	144	81%	0.805	80%	0.797	S	S	*	*			trans	-96.4	128.4	-177.8	35.4	-31.5	0	0	0	114.1
245	L	23.3	Very low	27.3	Very low	187 Å²	187	141.7 Å²	141.7	98%	0.979	79%	0.787	S	S	*	*			trans	-157.7	121.1	160.3	-109.7	168.3	0	0	0	108.8
246	G	27.4	Very low	27.8	Very low	79 Å²	79	138 Å²	138	81%	0.814	77%	0.766	S	S	*	*			trans	159	46.2	-171.5	0	0	0	0	0	114.3
247	R	23.3	Very low	28.5	Very low	244 Å²	244	132.2 Å²	132.2	92%	0.921	74%	0.74	S	S	*	*			trans	-80.4	165.6	164.8	-99.6	-177.5	170.7	170.2	-2.2	109.6
248	E	24	Very low	29.4	Very low	197 Å²	197	130.3 Å²	130.3	92%	0.921	72%	0.718	S	S	*	*			trans	80.5	59.2	173.3	-48.7	-158.1	134.2	0	0	116.8
249	A	28.6	Very low	29.9	Very low	106 Å²	106	127.5 Å²	127.5	88%	0.876	69%	0.692	S	S	*	*			trans	-131.3	4.7	150	0	0	0	0	0	113.4	K251	A249-K251 PolarHBondContact O-N 3.31Å
250	E	25.3	Very low	30.4	Very low	196 Å²	196	126.1 Å²	126.1	92%	0.916	66%	0.661	S	S	*	*			trans	-96.5	87.3	-177.8	-70.6	-169.1	111.1	0	0	112.8
251	K	27	Very low	30.8	Very low	194 Å²	194	122.6 Å²	122.6	84%	0.843	64%	0.639	S	S	*	*			trans	-160.9	147.2	155.4	-121.4	168.5	-174.8	175.4	0	112.2	A249	A249-K251 PolarHBondContact O-N 3.31Å
252	L	29.2	Very low	31.2	Very low	172 Å²	172	112.3 Å²	112.3	90%	0.901	60%	0.6	S	S	*	*			trans	67.8	63.4	169.7	-54.6	173.4	0	0	0	116.8
253	M	34.4	Very low	31.6	Very low	114 Å²	114	106.5 Å²	106.5	56%	0.562	57%	0.572	S	S	*	*			trans	-93.3	134.7	139.7	-76.5	-177.3	69.3	0	0	108.9	D257 K258	M253-D257 HydrophobicContact CE-CB 4.16Å; M253-K258 HydrophobicContact CE-CG 4.24Å
254	S	42.1	Very low	32	Very low	43 Å²	43	103 Å²	103	30%	0.301	55%	0.55	S	S	.	*			trans	-61.5	158.5	169.3	-176.1	0	0	0	0	110.2	E256 D257 K258	S254-E256 PolarHBondContact O-N 3.49Å; S254-E256 PolarHBondContact OG-N 2.82Å; S254-E256 VanDerWaalsContact OG-N 3.12Å; S254-E256 PolarHBondContact OG-OE2 2.96Å; S254-D257 WeakPolarHBondContact CB-OD2 3.33Å; S254-D257 PolarHBondContact N-OD2 3.34Å; S254-K258 WeakPolarHBondContact O-CE 3.41Å
255	N	35.7	Very low	32.3	Very low	107 Å²	107	97.3 Å²	97.3	57%	0.572	51%	0.513	S	S	*	.	H	α-helix	trans	-67.3	-25.7	165.4	-75.8	-14.2	0	0	0	111.3	K258 Q259	N255-K258 WeakPolarHBondContact O-CB 3.45Å; N255-K258 PolarHBondContact O-N 3.03Å; N255-K258 PolarHBondContact OD1-NZ 2.96Å; N255-Q259 WeakPolarHBondContact O-CG 3.29Å; N255-Q259 PolarHBondContact O-N 3.49Å; N255-Q259 VanDerWaalsContact O-N 3.09Å
256	E	37	Very low	32.8	Very low	80 Å²	80	89.6 Å²	89.6	37%	0.374	48%	0.477	S	S	.	.	H	α-helix	trans	-68.8	-38.9	178	-60.5	153.6	136.2	0	0	111.5	M139 S254 K258 Q259 R260	M139-E256 WeakPolarHBondContact CE-OE1 3.21Å; S254-E256 PolarHBondContact O-N 3.49Å; S254-E256 PolarHBondContact OG-N 2.82Å; S254-E256 VanDerWaalsContact OG-N 3.12Å; S254-E256 PolarHBondContact OG-OE2 2.96Å; E256-K258 VanDerWaalsContact C-N 3.27Å; E256-K258 PolarHBondContact O-N 3.5Å; E256-Q259 CarbonylContact O-C 3.54Å; E256-Q259 WeakPolarHBondContact O-CB 3.32Å; E256-Q259 PolarHBondContact O-N 3.04Å; E256-Q259 VanDerWaalsContact O-N 3.15Å; E256-R260 WeakPolarHBondContact O-CG 3.31Å; E256-R260 PolarHBondContact O-N 3.06Å
257	D	38.7	Very low	33.1	Very low	48 Å²	48	88.6 Å²	88.6	26%	0.257	46%	0.461	S	S	.	.	H	α-helix	trans	-66.4	-30.4	176.3	-65.3	-55.5	0	0	0	112.4	R57 M253 S254 R260 A261	R57-D257 WeakPolarHBondContact CD-OD1 3.42Å; M253-D257 HydrophobicContact CE-CB 4.16Å; S254-D257 WeakPolarHBondContact CB-OD2 3.33Å; S254-D257 PolarHBondContact N-OD2 3.34Å; D257-R260 PolarHBondContact O-N 3.12Å; D257-A261 PolarHBondContact O-N 3.16Å; D257-A261 VanDerWaalsContact O-N 3.07Å
258	K	43.1	Very low	33.5	Very low	67 Å²	67	78.2 Å²	78.2	29%	0.291	43%	0.427	S	S	.	.	H	α-helix	trans	-68.4	-43.6	172.5	-56.5	167.1	-159.5	164.9	0	110.1	M253 S254 N255 E256 A261 A262	M253-K258 HydrophobicContact CE-CG 4.24Å; S254-K258 WeakPolarHBondContact O-CE 3.41Å; N255-K258 WeakPolarHBondContact O-CB 3.45Å; N255-K258 PolarHBondContact O-N 3.03Å; N255-K258 PolarHBondContact OD1-NZ 2.96Å; E256-K258 VanDerWaalsContact C-N 3.27Å; E256-K258 PolarHBondContact O-N 3.5Å; K258-A261 PolarHBondContact O-N 3.28Å; K258-A262 PolarHBondContact O-N 3.26Å; K258-A262 VanDerWaalsContact O-N 3.12Å
259	Q	36.5	Very low	33.8	Very low	65 Å²	65	69.8 Å²	69.8	30%	0.304	39%	0.392	S	S	.	.	H	α-helix	trans	-63.9	-37.9	174.4	-71.2	164.5	-19.1	0	0	112	N255 E256 A262 A263 H931	N255-Q259 WeakPolarHBondContact O-CG 3.29Å; N255-Q259 PolarHBondContact O-N 3.49Å; N255-Q259 VanDerWaalsContact O-N 3.09Å; E256-Q259 CarbonylContact O-C 3.54Å; E256-Q259 WeakPolarHBondContact O-CB 3.32Å; E256-Q259 PolarHBondContact O-N 3.04Å; E256-Q259 VanDerWaalsContact O-N 3.15Å; Q259-A262 CarbonylContact O-C 3.59Å; Q259-A262 PolarHBondContact O-N 2.88Å; Q259-A263 VanDerWaalsContact O-CB 3.28Å; Q259-A263 WeakPolarHBondContact O-CB 3.47Å; Q259-A263 PolarHBondContact O-N 3.14Å; Q259-H931 PolarHBondContact NE2-CE1 2.83Å
260	R	35.6	Very low	33.9	Very low	53 Å²	53	66.2 Å²	66.2	20%	0.2	37%	0.365	C	S	.	.	H	α-helix	trans	-66.5	-37.1	174.8	-75.1	-173.9	173.5	149.9	1.4	113.2	V60 E64 E256 D257 A262 A263 A264	V60-R260 HydrophobicContact CG1-CB 4.34Å; V60-R260 HydrophobicContact CG1-CG 3.73Å; E64-R260 WeakPolarHBondContact OE1-CG 3.3Å; E64-R260 IonicContact OE1-NE 3.15Å; E64-R260 PolarHBondContact OE1-NE 2.66Å; E64-R260 IonicContact OE2-CZ 3.42Å; E64-R260 VanDerWaalsContact OE2-CZ 3.22Å; E64-R260 IonicContact OE2-NE 3.92Å; E64-R260 PolarHBondContact OE2-NE 3.37Å; E64-R260 IonicContact OE2-NH2 3.97Å; E64-R260 PolarHBondContact OE2-NH2 3.24Å; E256-R260 WeakPolarHBondContact O-CG 3.31Å; E256-R260 PolarHBondContact O-N 3.06Å; D257-R260 PolarHBondContact O-N 3.12Å; R260-A262 VanDerWaalsContact C-N 3.34Å; R260-A263 PolarHBondContact O-N 3.2Å; R260-A264 VanDerWaalsContact O-CB 3.25Å; R260-A264 WeakPolarHBondContact O-CB 3.42Å; R260-A264 PolarHBondContact O-N 2.99Å
261	A	33.9	Very low	33.8	Very low	35 Å²	35	61.3 Å²	61.3	29%	0.289	35%	0.352	S	S	.	.	H	α-helix	trans	-62.7	-41.8	171.7	0	0	0	0	0	111.7	D257 K258 A265 V556	D257-A261 PolarHBondContact O-N 3.16Å; D257-A261 VanDerWaalsContact O-N 3.07Å; K258-A261 PolarHBondContact O-N 3.28Å; A261-A265 WeakPolarHBondContact O-CB 3.47Å; A261-A265 PolarHBondContact O-N 2.98Å; A261-V556 HydrophobicContact CB-CG2 4.29Å
262	A	33	Very low	33.8	Very low	0 Å²	0	59 Å²	59	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-68.9	-38.7	175.6	0	0	0	0	0	113.3	K258 Q259 R260 A265 A266 V556	K258-A262 PolarHBondContact O-N 3.26Å; K258-A262 VanDerWaalsContact O-N 3.12Å; Q259-A262 CarbonylContact O-C 3.59Å; Q259-A262 PolarHBondContact O-N 2.88Å; R260-A262 VanDerWaalsContact C-N 3.34Å; A262-A265 CarbonylContact O-C 3.6Å; A262-A265 WeakPolarHBondContact O-CB 3.42Å; A262-A265 PolarHBondContact O-N 2.65Å; A262-A266 PolarHBondContact O-N 2.79Å; A262-V556 HydrophobicContact CB-CG1 4.34Å
263	A	33	Very low	33.7	Very low	17 Å²	17	56.3 Å²	56.3	14%	0.14	33%	0.328	C	S	.	.	H	α-helix	trans	-71.2	-35.1	177.1	0	0	0	0	0	111.9	Q259 R260 A266 A267	Q259-A263 VanDerWaalsContact O-CB 3.28Å; Q259-A263 WeakPolarHBondContact O-CB 3.47Å; Q259-A263 PolarHBondContact O-N 3.14Å; R260-A263 PolarHBondContact O-N 3.2Å; A263-A266 PolarHBondContact O-N 3.49Å; A263-A267 WeakPolarHBondContact O-CB 3.34Å; A263-A267 PolarHBondContact O-N 3.26Å
264	A	33.1	Very low	33.2	Very low	35 Å²	35	59 Å²	59	29%	0.289	34%	0.344	S	S	.	.	H	α-helix	trans	-66	-38.9	169.3	0	0	0	0	0	111.2	R260 A267 A268	R260-A264 VanDerWaalsContact O-CB 3.25Å; R260-A264 WeakPolarHBondContact O-CB 3.42Å; R260-A264 PolarHBondContact O-N 2.99Å; A264-A267 PolarHBondContact O-N 2.84Å; A264-A268 WeakPolarHBondContact O-CB 3.31Å; A264-A268 PolarHBondContact O-N 2.71Å
265	A	35.1	Very low	32.4	Very low	4 Å²	4	62.1 Å²	62.1	3%	0.033	37%	0.366	C	S	.	.	H	α-helix	trans	-62.8	-41	171.2	0	0	0	0	0	111.7	A261 A262 V556 R656 L954	A261-A265 WeakPolarHBondContact O-CB 3.47Å; A261-A265 PolarHBondContact O-N 2.98Å; A262-A265 CarbonylContact O-C 3.6Å; A262-A265 WeakPolarHBondContact O-CB 3.42Å; A262-A265 PolarHBondContact O-N 2.65Å; A265-V556 HydrophobicContact CB-CG1 4.15Å; A265-R656 PolarHBondContact O-NH1 2.82Å; A265-R656 PolarHBondContact O-NH2 3.33Å; A265-L954 HydrophobicContact CB-CD1 4.31Å
266	A	33.1	Very low	32.1	Very low	25 Å²	25	65 Å²	65	21%	0.207	38%	0.381	C	S	.	.	H	α-helix	trans	-65.6	-42.9	173	0	0	0	0	0	112.4	A262 A263 A268 A269 L913 L954	A262-A266 PolarHBondContact O-N 2.79Å; A263-A266 PolarHBondContact O-N 3.49Å; A266-A268 PolarHBondContact O-N 2.89Å; A266-A269 PolarHBondContact O-N 2.78Å; A266-L913 HydrophobicContact CB-CD1 4.36Å; A266-L913 HydrophobicContact CB-CD2 4.38Å; A266-L954 HydrophobicContact CB-CD2 4.32Å
267	A	32.8	Very low	31.5	Very low	58 Å²	58	72.5 Å²	72.5	48%	0.479	41%	0.406	S	S	.	.	H	α-helix	trans	-76.7	-18.9	-174.5	0	0	0	0	0	114.8	A263 A264 A269 G270	A263-A267 WeakPolarHBondContact O-CB 3.34Å; A263-A267 PolarHBondContact O-N 3.26Å; A264-A267 PolarHBondContact O-N 2.84Å; A267-A269 PolarHBondContact O-N 2.87Å; A267-G270 PolarHBondContact O-N 2.86Å
268	A	33.3	Very low	31	Very low	26 Å²	26	76.1 Å²	76.1	22%	0.215	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-8.8	173.2	0	0	0	0	0	113.8	A264 A266 E672 Y699	A264-A268 WeakPolarHBondContact O-CB 3.31Å; A264-A268 PolarHBondContact O-N 2.71Å; A266-A268 PolarHBondContact O-N 2.89Å; A268-E672 WeakPolarHBondContact CB-OE1 3.35Å; A268-Y699 PolarHBondContact O-OH 2.64Å
269	A	30.6	Very low	30.2	Very low	21 Å²	21	78.9 Å²	78.9	17%	0.174	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-37	165.4	0	0	0	0	0	113	A266 A267 Y699 L757	A266-A269 PolarHBondContact O-N 2.78Å; A267-A269 PolarHBondContact O-N 2.87Å; A269-Y699 HydrophobicContact CB-CE1 4.39Å; A269-Y699 PolarHBondContact O-OH 3.45Å; A269-L757 WeakPolarHBondContact O-CD1 3.41Å
270	G	29.5	Very low	29.8	Very low	30 Å²	30	79.4 Å²	79.4	31%	0.309	49%	0.486	S	S	.	.	S	Bend	trans	-112.5	31.5	-162.4	0	0	0	0	0	116.5	A267	A267-G270 PolarHBondContact O-N 2.86Å
271	S	24.1	Very low	29.5	Very low	93 Å²	93	85.1 Å²	85.1	65%	0.65	52%	0.52	S	S	*	.			trans	-157.3	66.2	-176.7	-75.4	0	0	0	0	114.8
272	F	26.1	Very low	29.3	Very low	146 Å²	146	86.8 Å²	86.8	64%	0.64	54%	0.541	S	S	*	.			trans	-143.4	30.2	174.1	-96.2	-60.5	0	0	0	117.9
273	L	28	Very low	29.1	Very low	115 Å²	115	92.9 Å²	92.9	60%	0.602	58%	0.581	S	S	*	*			trans	-138.1	115.6	164.9	-80.1	-177.8	0	0	0	114
274	L	23.9	Very low	29	Very low	172 Å²	172	98.6 Å²	98.6	90%	0.901	62%	0.618	S	S	*	*			trans	-174.1	74.5	142.8	-109.8	167.5	0	0	0	112.2
275	S	24.1	Very low	28.7	Very low	108 Å²	108	105 Å²	105	76%	0.755	65%	0.646	S	S	*	*			trans	-164.4	80.8	161.7	-87.3	0	0	0	0	113.8
276	N	28.9	Very low	28.4	Very low	168 Å²	168	111.3 Å²	111.3	90%	0.898	69%	0.685	S	S	*	*				-151.4	156.8	125.4	-147.6	-12.9	0	0	0	111.2
277	R	24.7	Very low	28.3	Very low	236 Å²	236	115.4 Å²	115.4	89%	0.891	71%	0.709	S	S	*	*			trans	-89.8	146	-179	-71.3	174.8	165.5	-170.6	-4.4	111.6
278	S	27.6	Very low	28.4	Very low	124 Å²	124	118.5 Å²	118.5	87%	0.867	72%	0.724	S	S	*	*			trans	-130.6	140.7	138.2	67.7	0	0	0	0	109.4
279	S	27.3	Very low	28.4	Very low	126 Å²	126	123 Å²	123	88%	0.881	75%	0.751	S	S	*	*			trans	-103.9	121.8	179.8	51.5	0	0	0	0	109.7
280	G	29	Very low	28.5	Very low	76 Å²	76	127.6 Å²	127.6	78%	0.784	78%	0.779	S	S	*	*			trans	-159.8	139.4	176.9	0	0	0	0	0	111
281	N	29.1	Very low	28.6	Very low	172 Å²	172	133.8 Å²	133.8	92%	0.92	81%	0.805	S	S	*	*			trans	-92.3	140.5	-171.6	-70.7	-32.4	0	0	0	112.9
282	G	28.3	Very low	29	Very low	71 Å²	71	134.5 Å²	134.5	73%	0.732	81%	0.808	S	S	*	*			trans	75.5	113	135.1	0	0	0	0	0	118.9
283	P	30.4	Very low	29.3	Very low	128 Å²	128	134.7 Å²	134.7	83%	0.831	81%	0.814	S	S	*	*			trans	-87.3	133.5	166.5	33.9	-31.1	0	0	0	112.1
284	C	29.4	Very low	29.3	Very low	136 Å²	136	135.8 Å²	135.8	92%	0.919	83%	0.826	S	S	*	*			trans	-153.5	151.8	154.4	-98.6	0	0	0	0	110.4
285	L	26.8	Very low	29.4	Very low	169 Å²	169	131 Å²	131	89%	0.885	82%	0.818	S	S	*	*			trans	-96.6	-180	-173.7	-68.7	163.3	0	0	0	112.2
286	V	29.8	Very low	29.7	Very low	138 Å²	138	133.6 Å²	133.6	84%	0.836	82%	0.822	S	S	*	*			trans	113.3	137.4	162.7	178.7	0	0	0	0	114.2
287	P	30.1	Very low	29.6	Very low	110 Å²	110	133.4 Å²	133.4	71%	0.714	82%	0.82	S	S	*	*			trans	-98.6	174.7	-154.1	-0.8	23.6	0	0	0	115.8
288	P	35.3	Very low	29.7	Very low	123 Å²	123	126.3 Å²	126.3	80%	0.799	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-81.6	147.1	-177.4	33.3	-35.9	0	0	0	114.3
289	P	33.2	Very low	29.7	Very low	121 Å²	121	124 Å²	124	79%	0.786	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-90.3	158.9	165.5	35.9	-33	0	0	0	112.6
290	P	33.6	Very low	29.9	Very low	117 Å²	117	124.7 Å²	124.7	76%	0.76	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-97	166.5	-173.7	38.4	-36.8	0	0	0	114.6
291	N	31.2	Very low	30	Very low	161 Å²	161	124.4 Å²	124.4	86%	0.861	82%	0.817	S	S	*	*			trans	-162.9	146.3	140.8	-102.9	-29.7	0	0	0	112.8
292	P	33.3	Very low	30.1	Very low	108 Å²	108	124.1 Å²	124.1	70%	0.701	81%	0.81	S	S	*	*			trans	-100.2	-156.2	175.9	40.5	-34.8	0	0	0	112.6
293	I	30.6	Very low	30.1	Very low	150 Å²	150	128.7 Å²	128.7	77%	0.769	81%	0.81	S	S	*	*			trans	86.3	96.4	-179.7	-54.2	165.9	0	0	0	111.6
294	T	29	Very low	30.5	Very low	138 Å²	138	128 Å²	128	85%	0.847	81%	0.806	S	S	*	*				63.7	106.8	80.6	-50.4	0	0	0	0	112.6
295	G	25.2	Very low	30.7	Very low	72 Å²	72	125 Å²	125	74%	0.742	80%	0.798	S	S	*	*			trans	-97.7	171.3	-172.2	0	0	0	0	0	115.8
296	L	30.1	Very low	30.8	Very low	162 Å²	162	127 Å²	127	85%	0.848	80%	0.8	S	S	*	*			trans	-151.5	132	166.5	-148	81.2	0	0	0	112.6
297	L	28	Very low	31	Very low	163 Å²	163	126.1 Å²	126.1	85%	0.853	80%	0.797	S	S	*	*			trans	23.3	131.1	151.4	-63.9	167.7	0	0	0	122.8
298	G	27.6	Very low	31.3	Very low	87 Å²	87	123.8 Å²	123.8	90%	0.897	79%	0.793	S	S	*	*			trans	106	131.3	137.5	0	0	0	0	0	117.8
299	G	27.5	Very low	31.1	Very low	77 Å²	77	123.3 Å²	123.3	79%	0.794	79%	0.788	S	S	*	*			cis	135.5	88.6	-17.2	0	0	0	0	0	116.9
300	C	31.2	Very low	31	Very low	140 Å²	140	125.6 Å²	125.6	95%	0.946	79%	0.786	S	S	*	*			trans	-153	147.4	157.2	-75.2	0	0	0	0	105.9
301	G	30.6	Very low	31	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	79%	0.79	S	S	*	*			cis	125.6	131.2	13.3	0	0	0	0	0	108.6
302	E	30.5	Very low	31.2	Very low	165 Å²	165	125 Å²	125	77%	0.771	78%	0.782	S	S	*	*			cis	-149.1	-169.1	2	-51	-175	114.1	0	0	107.9
303	F	29.6	Very low	31.1	Very low	167 Å²	167	125.3 Å²	125.3	73%	0.732	79%	0.786	S	S	*	*			cis	-152.4	-152.4	4	-133.6	-28.5	0	0	0	110.1
304	P	38.5	Very low	31.1	Very low	114 Å²	114	123 Å²	123	74%	0.74	79%	0.789	S	S	*	*			trans	-129.7	-179	-144	45.8	-27.8	0	0	0	119.1
305	G	33.2	Very low	31.3	Very low	73 Å²	73	120.1 Å²	120.1	75%	0.753	79%	0.788	S	S	*	*			trans	-160	41.3	178.7	0	0	0	0	0	118.7
306	F	29.3	Very low	31.7	Very low	210 Å²	210	125.6 Å²	125.6	92%	0.921	80%	0.799	S	S	*	*			trans	71.8	153.2	168.4	-88	-103.4	0	0	0	121.2
307	P	33.7	Very low	31.7	Very low	120 Å²	120	121.6 Å²	121.6	78%	0.779	80%	0.797	S	S	*	*			trans	-142.4	-178.4	-151.2	44.6	-25.3	0	0	0	118.9
308	G	35.8	Very low	31.8	Very low	61 Å²	61	118 Å²	118	63%	0.629	80%	0.8	S	S	*	*			trans	167.6	100.4	155.8	0	0	0	0	0	112.5
309	T	31.5	Very low	32	Very low	113 Å²	113	117.6 Å²	117.6	69%	0.693	80%	0.795	S	S	*	*				63.9	123.9	71.9	68.5	0	0	0	0	114.2
310	F	30.7	Very low	32	Very low	170 Å²	170	121.6 Å²	121.6	75%	0.746	80%	0.798	S	S	*	*			cis	-141.7	165.4	6.9	-71.8	-83.8	0	0	0	111.1
311	P	35	Very low	32.3	Very low	129 Å²	129	123.2 Å²	123.2	84%	0.838	80%	0.796	S	S	*	*				-142.7	170	104.5	39.6	-26.9	0	0	0	115.2
312	I	33.8	Very low	32.2	Very low	137 Å²	137	123.1 Å²	123.1	70%	0.703	80%	0.795	S	S	*	*			trans	-135.5	117.8	178.6	-53.4	179.5	0	0	0	105.4
313	S	31.7	Very low	32.3	Very low	113 Å²	113	127.2 Å²	127.2	79%	0.79	80%	0.803	S	S	*	*				55.7	145.1	82.3	-79.8	0	0	0	0	114.8
314	A	31.7	Very low	32.3	Very low	101 Å²	101	124.8 Å²	124.8	84%	0.835	81%	0.807	S	S	*	*			cis	-162.6	165.8	-16.7	0	0	0	0	0	108.4
315	G	32.5	Very low	32.3	Very low	79 Å²	79	125.4 Å²	125.4	81%	0.814	81%	0.811	S	S	*	*			trans	-175.5	120.5	173.7	0	0	0	0	0	113.8
316	L	32.3	Very low	32.3	Very low	187 Å²	187	126.9 Å²	126.9	98%	0.979	81%	0.81	S	S	*	*			trans	-125.1	156.1	178.2	-69.8	168.4	0	0	0	109.7
317	G	30.3	Very low	32.5	Very low	78 Å²	78	121.3 Å²	121.3	80%	0.804	80%	0.797	S	S	*	*			trans	139.7	99.8	160.6	0	0	0	0	0	114.9
318	G	30	Very low	32.4	Very low	88 Å²	88	123.3 Å²	123.3	91%	0.907	80%	0.8	S	S	*	*			trans	-73.4	-178.4	-178.4	0	0	0	0	0	116.7
319	G	32	Very low	32.7	Very low	78 Å²	78	125.4 Å²	125.4	80%	0.804	80%	0.803	S	S	*	*			trans	174.7	120.1	173.7	0	0	0	0	0	111.5
320	D	28.9	Very low	32.6	Very low	161 Å²	161	125.2 Å²	125.2	86%	0.861	81%	0.806	S	S	*	*			trans	-71.9	154.5	178.3	-73.2	-80	0	0	0	113.7
321	I	35.7	Very low	32.6	Very low	173 Å²	173	124.4 Å²	124.4	89%	0.887	81%	0.808	S	S	*	*				172.3	120.2	123.5	-86.5	153.3	0	0	0	107.7
322	G	28.8	Very low	32.5	Very low	69 Å²	69	122.9 Å²	122.9	71%	0.711	80%	0.8	S	S	*	*			trans	-102	167.5	-174.2	0	0	0	0	0	115.1
323	R	33	Very low	32.5	Very low	250 Å²	250	125.5 Å²	125.5	94%	0.943	81%	0.81	S	S	*	*			trans	-165.4	120.9	155.7	-112.4	174.8	-173.6	-165.1	1.6	111.8
324	S	29.5	Very low	32.5	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	81%	0.814	S	S	*	*			trans	-92.9	148	154.1	-53.3	0	0	0	0	108.4
325	P	38.8	Very low	32.8	Very low	127 Å²	127	129.3 Å²	129.3	83%	0.825	81%	0.807	S	S	*	*				-144	169.1	116.4	36.5	-21.2	0	0	0	115.2
326	S	32.7	Very low	32.5	Very low	104 Å²	104	131 Å²	131	73%	0.727	81%	0.805	S	S	*	*			trans	-77.4	160.9	-168.1	54.2	0	0	0	0	118
327	S	33.7	Very low	32.4	Very low	92 Å²	92	133.8 Å²	133.8	64%	0.643	80%	0.802	S	S	*	*				81	113.5	127.7	61.9	0	0	0	0	124.6
328	L	31.4	Very low	32.5	Very low	162 Å²	162	133.4 Å²	133.4	85%	0.848	80%	0.799	S	S	*	*				77.8	168.5	125.4	-59.7	174	0	0	0	118.7
329	P	42.1	Very low	32.8	Very low	105 Å²	105	135.1 Å²	135.1	68%	0.682	80%	0.797	S	S	*	*				-142.4	-168.8	-83.9	41.5	-20.3	0	0	0	116.5
330	S	30.2	Very low	32.7	Very low	110 Å²	110	136.7 Å²	136.7	77%	0.769	80%	0.796	S	S	*	*			trans	84.6	152.6	166.4	-43.4	0	0	0	0	116.2
331	I	31	Very low	33.1	Very low	153 Å²	153	134.8 Å²	134.8	79%	0.785	79%	0.79	S	S	*	*			cis	-152.6	158.6	13.4	-155.3	164.3	0	0	0	114.5
332	S	32	Very low	33	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	78%	0.784	S	S	*	*			trans	87.6	151.1	150.9	79.4	0	0	0	0	123.5
333	Q	34.1	Very low	33.3	Very low	193 Å²	193	137.8 Å²	137.8	90%	0.902	79%	0.791	S	S	*	*			trans	90.8	156.2	163.5	-52.1	-133.2	22.1	0	0	119.2
334	Q	32	Very low	33.5	Very low	188 Å²	188	130.4 Å²	130.4	88%	0.879	78%	0.784	S	S	*	*			trans	-125.2	172.6	-148	-105.8	-172.9	-51.2	0	0	113.6
335	P	37.7	Very low	33.7	Very low	105 Å²	105	128.7 Å²	128.7	68%	0.682	78%	0.784	S	S	*	*			trans	-96.6	-177.5	-166	39.4	-38.6	0	0	0	115.5
336	C	26.5	Very low	33.4	Very low	114 Å²	114	126.3 Å²	126.3	77%	0.77	78%	0.783	S	S	*	*			trans	98.4	120.4	158.9	-64.7	0	0	0	0	119.5
337	R	29.2	Very low	34	Very low	246 Å²	246	128 Å²	128	93%	0.928	79%	0.791	S	S	*	*			trans	43.6	115.9	145.1	-62.2	-174.5	177.3	-158.9	-0.6	119.9
338	G	32.5	Very low	34	Very low	71 Å²	71	127.6 Å²	127.6	73%	0.732	80%	0.802	S	S	*	*			trans	-105.5	167.5	130.9	0	0	0	0	0	110.1
339	S	37.7	Very low	34.1	Very low	123 Å²	123	123.3 Å²	123.3	86%	0.86	80%	0.797	S	S	*	*			cis	-172.2	147.8	-14.6	41.2	0	0	0	0	108.8
340	S	28.4	Very low	33.7	Very low	112 Å²	112	130 Å²	130	78%	0.783	81%	0.809	S	S	*	*			trans	-146.2	122	-179.8	56.7	0	0	0	0	111.8
341	T	38.1	Very low	34	Very low	121 Å²	121	129.2 Å²	129.2	74%	0.742	80%	0.803	S	S	*	*			trans	-172.5	145.7	175	46.6	0	0	0	0	107.4
342	D	33.8	Very low	34.2	Very low	142 Å²	142	127.2 Å²	127.2	76%	0.759	80%	0.802	S	S	*	*			cis	-162.5	158.4	-20.7	-89.3	-40.5	0	0	0	106.7
343	D	35.1	Very low	34.3	Very low	163 Å²	163	130 Å²	130	87%	0.872	81%	0.81	S	S	*	*				161.4	161	115.5	-131.8	-37.3	0	0	0	114.7
344	A	36.4	Very low	34.4	Very low	95 Å²	95	125.9 Å²	125.9	79%	0.785	80%	0.802	S	S	*	*			trans	-20.3	137.6	-175.8	0	0	0	0	0	122.8
345	G	34.8	Very low	34.4	Very low	80 Å²	80	121 Å²	121	83%	0.825	80%	0.802	S	S	*	*			trans	178.9	89.9	163	0	0	0	0	0	115.2
346	G	31.6	Very low	34.2	Very low	78 Å²	78	119.2 Å²	119.2	80%	0.804	80%	0.803	S	S	*	*			trans	-74.9	161.2	-167.4	0	0	0	0	0	118.2
347	P	45.5	Very low	34.7	Very low	138 Å²	138	121.5 Å²	121.5	90%	0.896	81%	0.806	S	S	*	*			trans	-107.6	167.2	-172.5	40.8	-35.9	0	0	0	116
348	G	33.1	Very low	34.9	Very low	84 Å²	84	117.1 Å²	117.1	87%	0.866	80%	0.796	S	S	*	*			trans	154.3	128	148.8	0	0	0	0	0	119.8
349	G	33.6	Very low	34.8	Very low	72 Å²	72	121.1 Å²	121.1	74%	0.742	80%	0.8	S	S	*	*			trans	114.1	118	133	0	0	0	0	0	121.5
350	R	33.6	Very low	34.4	Very low	247 Å²	247	119 Å²	119	93%	0.932	80%	0.797	S	S	*	*			trans	67.3	161.6	145.6	-68	177.2	167.7	-172.3	-5.6	119.4
351	S	36.4	Very low	34.7	Very low	93 Å²	93	118.5 Å²	118.5	65%	0.65	79%	0.794	S	S	*	*			cis	-171.9	132.3	-34.9	56	0	0	0	0	112.3
352	S	36.4	Very low	34.2	Very low	110 Å²	110	119.6 Å²	119.6	77%	0.769	80%	0.795	S	S	*	*			trans	59.8	150.7	145.1	-50.9	0	0	0	0	123.4
353	N	33.5	Very low	34	Very low	156 Å²	156	122.5 Å²	122.5	83%	0.834	80%	0.801	S	S	*	*			trans	73.3	150.1	158.8	-73.4	13.7	0	0	0	120.3
354	S	35.5	Very low	33.7	Very low	105 Å²	105	119.9 Å²	119.9	73%	0.734	80%	0.796	S	S	*	*			cis	-174.5	141.2	-25.6	52.3	0	0	0	0	112.6
355	G	33.9	Very low	33.3	Very low	85 Å²	85	119.1 Å²	119.1	88%	0.876	80%	0.797	S	S	*	*			trans	105.8	142.5	157.6	0	0	0	0	0	116.5
356	G	33	Very low	33	Very low	68 Å²	68	123.5 Å²	123.5	70%	0.701	80%	0.801	S	S	*	*			cis	156.1	168.8	-11.8	0	0	0	0	0	114.1
357	I	35.8	Very low	33.3	Very low	162 Å²	162	124.8 Å²	124.8	83%	0.831	80%	0.795	S	S	*	*			trans	71.5	133.3	154	-69.8	166.6	0	0	0	115.9
358	Q	33.8	Very low	32.6	Very low	154 Å²	154	126.5 Å²	126.5	72%	0.72	79%	0.79	S	S	*	*			cis	-158.2	154.8	1.3	-124.9	177.7	-2.1	0	0	113.9
359	L	30.8	Very low	32.6	Very low	155 Å²	155	126.8 Å²	126.8	81%	0.812	78%	0.779	S	S	*	*			trans	28.8	141	142.5	-67.9	167.9	0	0	0	123.9
360	G	29.5	Very low	32.4	Very low	78 Å²	78	128.3 Å²	128.3	80%	0.804	78%	0.778	S	S	*	*			trans	176.3	116.6	153.9	0	0	0	0	0	112.8
361	S	33.7	Very low	32.2	Very low	102 Å²	102	124 Å²	124	71%	0.713	77%	0.773	S	S	*	*			trans	-143.9	137.7	-172.9	60.8	0	0	0	0	114.4
362	N	28.4	Very low	31.8	Very low	145 Å²	145	124.7 Å²	124.7	78%	0.775	78%	0.778	S	S	*	*			trans	59.1	126.8	164.7	-59.6	-13.6	0	0	0	118.4
363	F	29.9	Very low	31.6	Very low	202 Å²	202	123.8 Å²	123.8	89%	0.886	78%	0.777	S	S	*	*				-170.6	166	111.5	-113.9	-83.7	0	0	0	112.7
364	S	28	Very low	31.2	Very low	109 Å²	109	124.4 Å²	124.4	76%	0.762	78%	0.78	S	S	*	*			trans	-43.3	151	-177.8	52.5	0	0	0	0	119.4
365	G	29.1	Very low	31	Very low	78 Å²	78	123.6 Å²	123.6	80%	0.804	78%	0.779	S	S	*	*			trans	-168.9	60.9	172.4	0	0	0	0	0	117.7
366	L	27.4	Very low	30.7	Very low	173 Å²	173	127.1 Å²	127.1	91%	0.906	78%	0.778	S	S	*	*			trans	-142.6	160.1	164.6	-82.6	175.3	0	0	0	108.4
367	P	38.9	Very low	31.1	Very low	104 Å²	104	128.5 Å²	128.5	68%	0.675	78%	0.775	S	S	*	*			cis	-125.5	-175	1.9	42.7	-29.6	0	0	0	113.5
368	H	31.1	Very low	30.6	Very low	174 Å²	174	128.4 Å²	128.4	81%	0.806	78%	0.775	S	S	*	*				-170.2	129.9	127.5	-115.1	-81.9	0	0	0	115.6
369	S	32.5	Very low	30.5	Very low	90 Å²	90	129.4 Å²	129.4	63%	0.629	79%	0.785	S	S	*	*			trans	31.5	98.5	148.7	50.2	0	0	0	0	123
370	S	29.7	Very low	30.3	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	78%	0.784	S	S	*	*				49	137	111.4	66.9	0	0	0	0	124.3
371	L	28.4	Very low	30.8	Very low	157 Å²	157	130.9 Å²	130.9	82%	0.822	78%	0.78	S	S	*	*			trans	91.7	103.3	146.6	-74.3	164.7	0	0	0	122.5
372	S	29.2	Very low	31	Very low	108 Å²	108	131.4 Å²	131.4	76%	0.755	78%	0.781	S	S	*	*				91.5	147.8	122.4	77.1	0	0	0	0	122.1
373	A	30.5	Very low	31.4	Very low	91 Å²	91	129.9 Å²	129.9	75%	0.752	78%	0.779	S	S	*	*			trans	69.5	144.9	162.9	0	0	0	0	0	119.2
374	L	26.4	Very low	31.8	Very low	168 Å²	168	128.9 Å²	128.9	88%	0.88	78%	0.779	S	S	*	*			cis	-169.6	179.4	-30.3	-124.1	171.7	0	0	0	109.5
375	A	30.6	Very low	32.2	Very low	88 Å²	88	130 Å²	130	73%	0.727	78%	0.782	S	S	*	*			trans	70.6	102.7	154.4	0	0	0	0	0	120.8
376	N	28	Very low	32.8	Very low	159 Å²	159	132.5 Å²	132.5	85%	0.85	78%	0.784	S	S	*	*				-109	171.2	122.4	-126	-18.9	0	0	0	105.9
377	P	41.2	Very low	33.3	Very low	97 Å²	97	130.7 Å²	130.7	63%	0.63	78%	0.78	S	S	*	*			cis	-139.4	-172.4	-1.4	43.1	-24.3	0	0	0	115.5
378	L	25.8	Very low	33.5	Very low	161 Å²	161	132 Å²	132	84%	0.843	79%	0.789	S	S	*	*			trans	51.8	123	148.8	-74.3	166.6	0	0	0	122.3
379	L	30.5	Very low	33.5	Very low	175 Å²	175	127.7 Å²	127.7	92%	0.916	79%	0.791	S	S	*	*			trans	-164.8	143.7	138.2	-110.6	163.6	0	0	0	113.3
380	L	28.4	Very low	33.6	Very low	152 Å²	152	126.9 Å²	126.9	80%	0.796	80%	0.797	S	S	*	*			trans	-97.8	154.7	165.1	-101.1	152.9	0	0	0	108.5
381	P	39.1	Very low	33.8	Very low	112 Å²	112	129 Å²	129	73%	0.727	80%	0.8	S	S	*	*				-153.7	-152.6	80.2	43.5	-21.7	0	0	0	111.2
382	P	38.7	Very low	33.9	Very low	113 Å²	113	129.7 Å²	129.7	73%	0.734	80%	0.803	S	S	*	*			cis	-129	175.4	-9.4	40.8	-23	0	0	0	115.8
383	P	35.9	Very low	34	Very low	113 Å²	113	127.5 Å²	127.5	73%	0.734	80%	0.798	S	S	*	*			trans	-98.1	166.8	-175	38.4	-36.1	0	0	0	115.3
384	M	38.5	Very low	34.2	Very low	181 Å²	181	131.3 Å²	131.3	89%	0.892	81%	0.805	S	S	*	*			trans	-135.9	142.4	166.9	-74.7	-88.2	83.4	0	0	110.6
385	T	36	Very low	34.5	Very low	133 Å²	133	128 Å²	128	82%	0.816	80%	0.796	S	S	*	*			trans	-143.7	147.4	172	53.1	0	0	0	0	110.3
386	P	41.4	Very low	34.5	Very low	129 Å²	129	129 Å²	129	84%	0.838	80%	0.798	S	S	*	*			trans	-137.5	111.6	160.3	34.2	-16.9	0	0	0	114.2
387	T	39	Very low	34.8	Very low	135 Å²	135	126.7 Å²	126.7	83%	0.828	79%	0.794	S	S	*	*			trans	-105.9	150.1	142.2	44.7	0	0	0	0	107.4
388	P	42.6	Very low	34.5	Very low	133 Å²	133	128.3 Å²	128.3	86%	0.864	80%	0.802	S	S	*	*				-161.4	178.4	107.8	40.7	-21.7	0	0	0	117.8
389	G	31.9	Very low	34.8	Very low	83 Å²	83	126.6 Å²	126.6	86%	0.856	80%	0.801	S	S	*	*			trans	121.9	129.6	152.8	0	0	0	0	0	114.5
390	G	34.1	Very low	35	Very low	72 Å²	72	125.4 Å²	125.4	74%	0.742	80%	0.801	S	S	*	*			cis	-165.1	-176.8	-4	0	0	0	0	0	107.8
391	N	32.9	Very low	35.2	Very low	149 Å²	149	123.4 Å²	123.4	80%	0.797	80%	0.8	S	S	*	*			cis	-149.5	159.5	3.5	-87.3	-13.1	0	0	0	106.9
392	L	30.4	Very low	34.6	Very low	171 Å²	171	121.4 Å²	121.4	90%	0.895	80%	0.799	S	S	*	*			cis	89.3	123.9	38.2	-66.3	179.2	0	0	0	116.3
393	G	33	Very low	34.2	Very low	63 Å²	63	120.9 Å²	120.9	65%	0.649	80%	0.798	S	S	*	*			trans	139.9	102.8	-178.4	0	0	0	0	0	110.2
394	L	33.9	Very low	33.8	Very low	170 Å²	170	120.5 Å²	120.5	89%	0.89	79%	0.794	S	S	*	*				72.7	132.4	53.9	-55.6	176.3	0	0	0	113.4
395	S	32.2	Very low	33.3	Very low	98 Å²	98	119.9 Å²	119.9	69%	0.685	79%	0.791	S	S	*	*			cis	-169.1	152.1	-8	49.6	0	0	0	0	114
396	S	31.1	Very low	32.9	Very low	111 Å²	111	120.4 Å²	120.4	78%	0.776	79%	0.788	S	S	*	*			trans	56.5	122	147.8	63.9	0	0	0	0	123.6
397	S	35.3	Very low	32.4	Very low	109 Å²	109	121.8 Å²	121.8	76%	0.762	78%	0.784	S	S	*	*				-170.6	166.3	122.8	61.7	0	0	0	0	113.1
398	T	34.2	Very low	31.7	Very low	132 Å²	132	123.6 Å²	123.6	81%	0.81	78%	0.78	S	S	*	*			trans	61.2	117.6	169.6	58.4	0	0	0	0	120.2
399	P	31.5	Very low	30.8	Very low	124 Å²	124	122.4 Å²	122.4	81%	0.805	76%	0.758	S	S	*	*			trans	-126.7	130.4	160.1	36	-21.5	0	0	0	114
400	T	34.9	Very low	30.5	Very low	151 Å²	151	129.5 Å²	129.5	93%	0.926	76%	0.759	S	S	*	*			trans	-146.5	144.6	160.4	15.4	0	0	0	0	110.8
401	S	32.2	Very low	30	Very low	110 Å²	110	135 Å²	135	77%	0.769	76%	0.763	S	S	*	*			trans	-82.4	169	-176.4	36.1	0	0	0	0	113
402	G	27.8	Very low	29.6	Very low	69 Å²	69	134.6 Å²	134.6	71%	0.711	76%	0.76	S	S	*	*			cis	-123.1	162.2	7.8	0	0	0	0	0	114.8
403	S	29.3	Very low	29.3	Very low	103 Å²	103	133.6 Å²	133.6	72%	0.72	76%	0.755	S	S	*	*			cis	64.6	143.1	10.5	112.3	0	0	0	0	115.1
404	V	27.8	Very low	29.1	Very low	105 Å²	105	139 Å²	139	64%	0.636	76%	0.764	S	S	*	*			cis	-158	-162.1	-4.1	94.6	0	0	0	0	109.8
405	M	28.5	Very low	29.3	Very low	168 Å²	168	135.5 Å²	135.5	83%	0.828	75%	0.751	S	S	*	*			trans	106.7	97	167.2	-53.5	-58.7	176.3	0	0	111.4
406	D	26.3	Very low	29	Very low	143 Å²	143	138.6 Å²	138.6	77%	0.765	75%	0.752	S	S	*	*			cis	61.6	139.6	18.5	-150.6	-7.5	0	0	0	114.6
407	E	30.8	Very low	28.6	Very low	158 Å²	158	140.9 Å²	140.9	74%	0.738	75%	0.751	S	S	*	*			trans	-122.2	128.6	-150.3	-169.9	-159.7	126.7	0	0	113.8
408	K	25.7	Very low	28.4	Very low	174 Å²	174	139.9 Å²	139.9	76%	0.757	76%	0.757	S	S	*	*			trans	-165.2	121.4	148.5	-109.6	137.2	-162.1	150.2	0	117.3
409	R	22.9	Very low	28.2	Very low	108 Å²	108	136.6 Å²	136.6	41%	0.408	75%	0.75	S	S	.	*				39.4	120.5	125.8	-64.7	175.3	132.5	-129	-5.1	119.7	G8 S10	G8-R409 PolarHBondContact O-NH2 2.62Å; S10-R409 PolarHBondContact O-NH1 3.18Å; S10-R409 PolarHBondContact OG-NE 3.06Å; S10-R409 PolarHBondContact OG-NH1 2.7Å; S10-R409 VanDerWaalsContact OG-NH1 3.09Å
410	R	26.5	Very low	28.3	Very low	231 Å²	231	138.9 Å²	138.9	87%	0.872	75%	0.749	S	S	*	*				-172.8	120.2	103.7	-98.6	160.3	-169.8	-159.9	2.6	110.4
411	K	23.5	Very low	28.2	Very low	187 Å²	187	138.3 Å²	138.3	81%	0.813	74%	0.736	S	S	*	*				72.2	110.8	100.6	-96.2	-159.9	171.9	-162.2	0	115.6
412	L	24.1	Very low	28.3	Very low	142 Å²	142	139.8 Å²	139.8	74%	0.743	74%	0.735	S	S	*	*				55.4	98.6	121.2	-165.8	103.9	0	0	0	118.4
413	N	24.5	Very low	28.5	Very low	149 Å²	149	140 Å²	140	80%	0.797	74%	0.738	S	S	*	*				179	133.3	118.7	-95.6	-4.7	0	0	0	112.6
414	E	28.5	Very low	28.6	Very low	178 Å²	178	139.8 Å²	139.8	83%	0.832	73%	0.729	S	S	*	*			trans	-86.9	173.3	145.2	-104.8	-161.3	128.7	0	0	108.9
415	P	38.1	Very low	28.7	Very low	95 Å²	95	146.8 Å²	146.8	62%	0.617	74%	0.744	S	S	*	*			cis	-135.1	-159.8	-11	28.8	-4.6	0	0	0	112.9
416	K	25	Very low	28.8	Very low	163 Å²	163	147 Å²	147	71%	0.709	74%	0.736	S	S	*	*			trans	101.4	122.4	143.5	-85.8	171.1	168.6	-95.3	0	121.9
417	E	24	Very low	29	Very low	160 Å²	160	146.6 Å²	146.6	75%	0.748	73%	0.731	S	S	*	*			trans	86.2	135.3	134.7	-75.7	164.2	-153	0	0	121.7
418	G	30.2	Very low	29	Very low	87 Å²	87	145.6 Å²	145.6	90%	0.897	73%	0.73	S	S	*	*			trans	85.9	119.5	-178.1	0	0	0	0	0	113.9
419	G	30.5	Very low	29	Very low	64 Å²	64	144.9 Å²	144.9	66%	0.66	74%	0.735	S	S	*	*			cis	149.5	142.9	-7	0	0	0	0	0	111.5
420	H	33.4	Very low	29.4	Very low	171 Å²	171	146.5 Å²	146.5	79%	0.792	75%	0.752	S	S	*	*			trans	66.3	147.7	175.1	-66.7	-118.2	0	0	0	115.9
421	E	32.4	Very low	29.5	Very low	139 Å²	139	143.3 Å²	143.3	65%	0.65	75%	0.749	S	S	*	*			cis	-161.3	158.3	-15.7	-118.9	179.7	129.1	0	0	110.7
422	N	33.9	Very low	29.6	Very low	141 Å²	141	145.9 Å²	145.9	75%	0.754	75%	0.753	S	S	*	*			trans	42.4	131.8	151.1	-52.2	-37.2	0	0	0	120.3
423	G	33.3	Very low	29.7	Very low	74 Å²	74	144.5 Å²	144.5	76%	0.763	76%	0.755	S	S	*	*			cis	147.6	-177.4	9.8	0	0	0	0	0	109.3
424	N	31.2	Very low	29.8	Very low	98 Å²	98	144 Å²	144	52%	0.524	76%	0.757	S	S	.	*			cis	-174.6	128.6	-22.2	156.6	65.7	0	0	0	108.4	R426	N424-R426 VanDerWaalsContact OD1-CG 3.3Å; N424-R426 WeakPolarHBondContact OD1-CG 3.28Å; N424-R426 PolarHBondContact OD1-N 3.42Å
425	W	28.7	Very low	30.5	Very low	253 Å²	253	140.4 Å²	140.4	96%	0.958	75%	0.75	S	S	*	*			trans	-141.8	73.8	158.3	-78.8	120	0	0	0	112.1
426	R	30.6	Very low	30.1	Very low	173 Å²	173	144 Å²	144	65%	0.653	76%	0.758	S	S	*	*			trans	-29.6	157.8	139.4	-83.5	170.6	163.8	-151.5	-1.7	113.7	N424	N424-R426 VanDerWaalsContact OD1-CG 3.3Å; N424-R426 WeakPolarHBondContact OD1-CG 3.28Å; N424-R426 PolarHBondContact OD1-N 3.42Å
427	M	31.6	Very low	30.2	Very low	134 Å²	134	147.1 Å²	147.1	66%	0.66	77%	0.765	S	S	*	*			cis	-166.2	172.7	18	-117.4	154.3	153.9	0	0	108.1
428	N	30.2	Very low	30.4	Very low	136 Å²	136	143.3 Å²	143.3	73%	0.727	77%	0.769	S	S	*	*			cis	-140.3	158.9	13.2	-88.9	-46.7	0	0	0	110.7
429	D	26.7	Very low	30.5	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	76%	0.763	S	S	*	*			trans	-120.9	144.8	155.1	-109.7	-50.1	0	0	0	107.8
430	D	30.9	Very low	30.5	Very low	143 Å²	143	146 Å²	146	77%	0.765	76%	0.764	S	S	*	*			trans	-174.1	135	157.9	-105.1	-32.8	0	0	0	108.3
431	M	28.9	Very low	30.4	Very low	164 Å²	164	146.4 Å²	146.4	81%	0.808	77%	0.771	S	S	*	*			cis	-153.2	157.9	-0.4	-160.9	-167.6	-114.7	0	0	110.1
432	R	24.9	Very low	30.3	Very low	240 Å²	240	143.5 Å²	143.5	91%	0.906	78%	0.779	S	S	*	*			trans	-132.7	127.5	170.9	-113.3	-169.6	179.6	-149	3.3	110.7
433	S	26.6	Very low	30.2	Very low	113 Å²	113	140.6 Å²	140.6	79%	0.79	78%	0.782	S	S	*	*			trans	177.7	157.7	142.9	43.8	0	0	0	0	113.6
434	V	26.4	Very low	30	Very low	138 Å²	138	144.5 Å²	144.5	84%	0.836	79%	0.791	S	S	*	*			trans	-162.4	157	-169.8	175.6	0	0	0	0	105.6
435	P	42.8	Very low	29.9	Very low	104 Å²	104	143.7 Å²	143.7	68%	0.675	81%	0.806	S	S	*	*			cis	-131.7	-179.8	-0.8	23.1	2.6	0	0	0	117.5
436	E	29.2	Very low	30	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	80%	0.802	S	S	*	*			trans	58.6	135.7	143.9	-79.2	-176.3	-153.7	0	0	122.8
437	R	28.9	Very low	29.9	Very low	227 Å²	227	145 Å²	145	86%	0.857	81%	0.811	S	S	*	*				-159.5	146.2	55.9	-81.3	-175.1	163.4	-165.1	-3.7	115.1
438	G	27.9	Very low	29.6	Very low	80 Å²	80	144.4 Å²	144.4	83%	0.825	82%	0.82	S	S	*	*			trans	76.6	154.2	156.2	0	0	0	0	0	117.6
439	S	32.1	Very low	29.5	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	82%	0.821	S	S	*	*			cis	-163.7	151.1	-9.5	55.2	0	0	0	0	113.4
440	S	30.8	Very low	29.8	Very low	100 Å²	100	139.7 Å²	139.7	70%	0.699	82%	0.822	S	S	*	*			trans	67.4	129.3	150.8	66.9	0	0	0	0	122.8
441	L	31.2	Very low	29.7	Very low	179 Å²	179	140.5 Å²	140.5	94%	0.937	83%	0.826	S	S	*	*			trans	67.4	138.6	152.4	-58.6	160.4	0	0	0	118
442	G	30.1	Very low	29.8	Very low	78 Å²	78	144.3 Å²	144.3	80%	0.804	83%	0.831	S	S	*	*			cis	168.5	164.1	-6.9	0	0	0	0	0	111.7
443	G	30.8	Very low	30	Very low	80 Å²	80	141 Å²	141	83%	0.825	83%	0.826	S	S	*	*			trans	146.5	139.9	170.4	0	0	0	0	0	115.9
444	T	28.6	Very low	30.4	Very low	155 Å²	155	141.3 Å²	141.3	95%	0.951	83%	0.826	S	S	*	*			trans	-131.1	143.3	174.6	57.5	0	0	0	0	110.3
445	G	30.7	Very low	30.6	Very low	82 Å²	82	141.8 Å²	141.8	85%	0.845	82%	0.822	S	S	*	*			trans	-163.7	89.1	-167	0	0	0	0	0	117.6
446	R	29.4	Very low	29.8	Very low	229 Å²	229	143.4 Å²	143.4	86%	0.864	83%	0.826	S	S	*	*			trans	-40.1	151.6	173.2	-68.1	170.1	165.6	-173.2	-3.9	119.6
447	R	28.7	Very low	29.9	Very low	225 Å²	225	143.3 Å²	143.3	85%	0.849	83%	0.83	S	S	*	*			trans	73.6	114	134.4	-82.9	-177.2	173	-167.1	-3.2	122.2
448	S	26.4	Very low	29.6	Very low	121 Å²	121	137.3 Å²	137.3	85%	0.846	82%	0.822	S	S	*	*				60.8	113	113.3	-179.1	0	0	0	0	121.5
449	G	26.7	Very low	29.9	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	82%	0.822	S	S	*	*				131.2	118.6	118.2	0	0	0	0	0	118.1
450	S	34.2	Very low	29.6	Very low	123 Å²	123	143 Å²	143	86%	0.86	83%	0.826	S	S	*	*			trans	-153.4	139.6	154.5	56.2	0	0	0	0	111.1
451	N	27.5	Very low	29.6	Very low	160 Å²	160	146.6 Å²	146.6	86%	0.856	84%	0.837	S	S	*	*			trans	-88.7	148.5	178.7	-82.8	-36.5	0	0	0	111.4
452	R	31.3	Very low	29.4	Very low	244 Å²	244	142.6 Å²	142.6	92%	0.921	82%	0.824	S	S	*	*				179.5	124.4	121.2	-98.6	164.2	-175.9	-155.7	0.6	113.2
453	Q	28.9	Very low	29.2	Very low	171 Å²	171	144.6 Å²	144.6	80%	0.799	83%	0.825	S	S	*	*			trans	-105.1	169.6	138.7	-75	-167.2	-13.7	0	0	108
454	P	35.6	Very low	29	Very low	119 Å²	119	144.3 Å²	144.3	77%	0.773	82%	0.823	S	S	*	*				-143.5	135.9	101.6	36.2	-21.6	0	0	0	116
455	L	30.4	Very low	28.9	Very low	147 Å²	147	145.7 Å²	145.7	77%	0.77	82%	0.818	S	S	*	*			trans	36.7	114.2	133.6	-60	177	0	0	0	121.4
456	N	26.4	Very low	28.8	Very low	139 Å²	139	148.8 Å²	148.8	74%	0.743	82%	0.815	S	S	*	*				70	112.9	116.6	-167.1	19.5	0	0	0	120.4
457	L	30.8	Very low	28.5	Very low	169 Å²	169	143.2 Å²	143.2	89%	0.885	81%	0.807	S	S	*	*			trans	-155.3	136.2	143.2	-110.9	160.4	0	0	0	109.7
458	S	23.8	Very low	28.5	Very low	100 Å²	100	138.9 Å²	138.9	70%	0.699	81%	0.806	S	S	*	*			trans	-126.1	154.3	168.3	-63.9	0	0	0	0	108.9
459	P	34	Very low	28.4	Very low	126 Å²	126	142.9 Å²	142.9	82%	0.818	80%	0.804	S	S	*	*				-135.8	158.5	129.7	37	-27.3	0	0	0	113
460	Q	25.5	Very low	28.6	Very low	183 Å²	183	145.4 Å²	145.4	86%	0.855	81%	0.806	S	S	*	*			trans	-81.8	150.7	168.4	-68.3	-168.3	1.1	0	0	111.6
461	L	30.9	Very low	28.3	Very low	175 Å²	175	146 Å²	146	92%	0.916	81%	0.805	S	S	*	*			trans	-139.9	163.9	144.7	-102.6	171.4	0	0	0	108.7
462	S	27.1	Very low	28.2	Very low	95 Å²	95	145.3 Å²	145.3	66%	0.664	81%	0.807	S	S	*	*			trans	-133.9	162.6	-152.7	63.6	0	0	0	0	115.7
463	S	25.5	Very low	27.9	Very low	120 Å²	120	138.8 Å²	138.8	84%	0.839	80%	0.799	S	S	*	*			trans	76.1	133.1	166.5	77.9	0	0	0	0	118.4
464	G	27.6	Very low	27.9	Very low	75 Å²	75	136.7 Å²	136.7	77%	0.773	80%	0.803	S	S	*	*			trans	165.1	106.1	177.7	0	0	0	0	0	109.4
465	H	26.5	Very low	27.3	Very low	184 Å²	184	135.5 Å²	135.5	85%	0.852	80%	0.803	S	S	*	*			trans	-93.7	124.6	-175	-70.9	79.3	0	0	0	111.4
466	N	27.5	Very low	27.2	Very low	147 Å²	147	134.9 Å²	134.9	79%	0.786	81%	0.808	S	S	*	*			trans	-166.3	120.8	130.4	-114.2	-38.6	0	0	0	115.6
467	T	23.9	Very low	27.3	Very low	112 Å²	112	132.9 Å²	132.9	69%	0.687	81%	0.811	S	S	*	*			trans	19	107.7	133.5	-36.8	0	0	0	0	118.9
468	T	29.1	Very low	26.9	Very low	134 Å²	134	131.8 Å²	131.8	82%	0.822	81%	0.811	S	S	*	*			trans	-152.3	149.7	152.8	-74.1	0	0	0	0	109.7
469	Y	23.4	Very low	27.1	Very low	205 Å²	205	130.4 Å²	130.4	80%	0.804	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-83.5	142.2	-172.8	-64.3	-99.8	0	0	0	112.4	T471	Y469-T471 PolarHBondContact O-N 3.43Å
470	P	30.5	Very low	26.8	Very low	125 Å²	125	131 Å²	131	81%	0.812	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-78.9	118.1	174.2	31	-32.5	0	0	0	111.4
471	T	28	Very low	26.7	Very low	136 Å²	136	127.2 Å²	127.2	83%	0.834	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-75.8	137.4	167.7	45.5	0	0	0	0	110.5	Y469	Y469-T471 PolarHBondContact O-N 3.43Å
472	T	26.6	Very low	26.7	Very low	145 Å²	145	126.7 Å²	126.7	89%	0.89	81%	0.812	S	S	*	*			trans	-89.3	112.9	-177.9	49	0	0	0	0	111.9
473	S	24	Very low	26.7	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	81%	0.813	S	S	*	*			trans	-136.7	103.8	168.8	60.7	0	0	0	0	110.8
474	S	28	Very low	26.9	Very low	128 Å²	128	128.2 Å²	128.2	90%	0.895	81%	0.811	S	S	*	*			trans	-160.2	119.3	171.1	-78.2	0	0	0	0	110.4
475	A	23.7	Very low	27.1	Very low	94 Å²	94	129.8 Å²	129.8	78%	0.777	81%	0.81	S	S	*	*			trans	-89.6	151.1	170.2	0	0	0	0	0	110.6	A477	A475-A477 PolarHBondContact O-N 3.32Å
476	P	29	Very low	27.3	Very low	134 Å²	134	125 Å²	125	87%	0.87	81%	0.81	S	S	*	*			trans	-76.2	108.9	172.9	30.5	-32.3	0	0	0	110.5
477	A	27.9	Very low	27.5	Very low	97 Å²	97	130 Å²	130	80%	0.802	82%	0.819	S	S	*	*			trans	-79.9	145.4	172.5	0	0	0	0	0	111.6	A475 G479	A475-A477 PolarHBondContact O-N 3.32Å; A477-G479 PolarHBondContact O-N 2.77Å
478	V	23.4	Very low	28.2	Very low	146 Å²	146	130.4 Å²	130.4	89%	0.885	82%	0.823	S	S	*	*			trans	-70.1	121	176.2	177	0	0	0	0	110.1
479	G	27.1	Very low	28.3	Very low	71 Å²	71	129 Å²	129	73%	0.732	82%	0.819	S	S	*	*			trans	-113.4	115.5	174.4	0	0	0	0	0	111.7	A477	A477-G479 PolarHBondContact O-N 2.77Å
480	T	26.8	Very low	28.8	Very low	137 Å²	137	128.2 Å²	128.2	84%	0.84	82%	0.822	S	S	*	*			trans	-74.7	145.1	174	42.3	0	0	0	0	111.6
481	A	24.8	Very low	28.6	Very low	105 Å²	105	126.8 Å²	126.8	87%	0.868	82%	0.821	S	S	*	*			trans	-71.5	140.9	-179.7	0	0	0	0	0	112.6
482	N	29.4	Very low	28.4	Very low	164 Å²	164	125.3 Å²	125.3	88%	0.877	82%	0.816	S	S	*	*			trans	-149.2	151.7	145.4	-154.3	-1.8	0	0	0	110.4
483	S	28.7	Very low	28.4	Very low	96 Å²	96	127.3 Å²	127.3	67%	0.671	82%	0.816	S	S	*	*			trans	-103.2	143	-169.8	55.9	0	0	0	0	113.1
484	N	30.2	Very low	28.6	Very low	150 Å²	150	128.7 Å²	128.7	80%	0.802	82%	0.819	S	S	*	*				-168.3	152.2	108.1	-135.7	-18.4	0	0	0	116.5
485	S	31.5	Very low	28.8	Very low	109 Å²	109	128.2 Å²	128.2	76%	0.762	81%	0.813	S	S	*	*			trans	44.6	113.2	147.3	63.2	0	0	0	0	122.8
486	G	30.4	Very low	28.8	Very low	83 Å²	83	127.9 Å²	127.9	86%	0.856	81%	0.81	S	S	*	*			trans	-178.5	125.3	155.7	0	0	0	0	0	111
487	R	30.5	Very low	28.6	Very low	253 Å²	253	126.9 Å²	126.9	96%	0.955	81%	0.807	S	S	*	*			trans	-104.5	158	-168.6	-111.6	-166.9	162.1	-167.6	-5.2	114.5
488	P	38.6	Very low	28.6	Very low	119 Å²	119	128.3 Å²	128.3	77%	0.773	81%	0.805	S	S	*	*			trans	-112.3	172	-163	43	-36.7	0	0	0	116.3
489	S	32.1	Very low	28.7	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	80%	0.804	S	S	*	*			trans	-168.5	142.8	165.6	97.2	0	0	0	0	108.6
490	Q	33	Very low	28.4	Very low	187 Å²	187	140.3 Å²	140.3	87%	0.874	81%	0.813	S	S	*	*			cis	-146.3	-168.5	-7.5	-63.6	-161.5	74.9	0	0	109.9
491	A	26.4	Very low	28.2	Very low	96 Å²	96	143.3 Å²	143.3	79%	0.793	81%	0.814	S	S	*	*			trans	-89.2	-176.1	169	0	0	0	0	0	110.8
492	S	24.5	Very low	28.3	Very low	104 Å²	104	147.3 Å²	147.3	73%	0.727	82%	0.815	S	S	*	*			cis	-171.6	150.8	-10.5	139.4	0	0	0	0	107
493	E	27.1	Very low	28	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	81%	0.809	S	S	*	*			trans	172.5	154.2	139	-101.2	173.4	-169.2	0	0	114.8
494	V	27.4	Very low	27.8	Very low	135 Å²	135	144.9 Å²	144.9	82%	0.818	81%	0.811	S	S	*	*			trans	-153.6	126.5	175.4	170.4	0	0	0	0	108
495	P	31.7	Very low	27.6	Very low	118 Å²	118	147.6 Å²	147.6	77%	0.766	82%	0.815	S	S	*	*				-154.2	135.1	112.3	35.7	-15.8	0	0	0	118.9
496	A	24.3	Very low	27.4	Very low	87 Å²	87	149.4 Å²	149.4	72%	0.719	82%	0.817	S	S	*	*			trans	52.5	133.3	133.3	0	0	0	0	0	125
497	S	25.4	Very low	27.3	Very low	114 Å²	114	152.1 Å²	152.1	80%	0.797	82%	0.816	S	S	*	*			trans	78.4	147.2	156.2	87.6	0	0	0	0	117.3
498	T	27.6	Very low	27.3	Very low	126 Å²	126	148.1 Å²	148.1	77%	0.773	81%	0.808	S	S	*	*			cis	-149.6	158.9	8	-41.7	0	0	0	0	112.4
499	R	24.6	Very low	27	Very low	226 Å²	226	145.7 Å²	145.7	85%	0.853	79%	0.794	S	S	*	*			trans	96.7	88.1	141.2	-147	177.1	-146.3	171.2	7.2	121.8
500	W	20.9	Very low	27.4	Very low	243 Å²	243	142.4 Å²	142.4	92%	0.92	78%	0.777	S	S	*	*			trans	22.6	108.9	133.2	-64.4	82.3	0	0	0	120.9
501	K	22.6	Very low	28.1	Very low	200 Å²	200	136.7 Å²	136.7	87%	0.87	76%	0.756	S	S	*	*				175.9	167.8	117.4	-100	-179	179.4	-175.8	0	112.3
502	Q	27.9	Very low	29.4	Very low	189 Å²	189	132.2 Å²	132.2	88%	0.883	72%	0.72	S	S	*	*			trans	71.3	114.9	-172	-55.7	179.4	-7.6	0	0	112.5
503	S	23.2	Very low	31	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	70%	0.703	S	S	*	*			cis	86.2	113.3	30.2	-155.4	0	0	0	0	114.8
504	S	24.4	Very low	33.7	Very low	101 Å²	101	123.7 Å²	123.7	71%	0.706	67%	0.673	S	S	*	*			trans	69.3	76.9	151.5	-45.1	0	0	0	0	119
505	K	25.8	Very low	36.5	Very low	208 Å²	208	117.3 Å²	117.3	90%	0.904	64%	0.635	S	S	*	*			trans	-169.8	157.6	137.5	-101.4	146.2	-171	178.2	0	111.6
506	N	26.6	Very low	39.2	Very low	147 Å²	147	114 Å²	114	79%	0.786	61%	0.609	S	S	*	*			trans	48.6	88.3	-175.4	-90	17.4	0	0	0	116.4	Q508	N506-Q508 PolarHBondContact O-N 2.8Å
507	V	29.6	Very low	42.1	Very low	139 Å²	139	110.1 Å²	110.1	84%	0.842	58%	0.576	S	S	*	*			trans	-77.4	98.1	144.3	178.6	0	0	0	0	106.6	S509	V507-S509 PolarHBondContact O-N 3.17Å
508	Q	29	Very low	45	Very low	170 Å²	170	105.5 Å²	105.5	79%	0.794	54%	0.542	S	S	*	.			trans	-62.9	127.4	152.9	-71.3	174.8	-72.1	0	0	106.2	N506 G510	N506-Q508 PolarHBondContact O-N 2.8Å; Q508-G510 PolarHBondContact O-N 3.06Å
509	S	32.6	Very low	47.7	Very low	67 Å²	67	102 Å²	102	47%	0.469	52%	0.519	S	S	.	.			trans	-65	101.2	-175.5	37.4	0	0	0	0	110.3	V507 Y514	V507-S509 PolarHBondContact O-N 3.17Å; S509-Y514 PolarHBondContact OG-OH 2.92Å
510	G	40.9	Very low	50.1	Low	38 Å²	38	94.8 Å²	94.8	39%	0.392	50%	0.501	S	S	.	.			trans	-59.4	148	165.9	0	0	0	0	0	109.9	Q508 G512 A513	Q508-G510 PolarHBondContact O-N 3.06Å; G510-G512 PolarHBondContact O-N 2.91Å; G510-G512 VanDerWaalsContact O-N 3.1Å; G510-A513 PolarHBondContact O-N 2.84Å; G510-A513 VanDerWaalsContact O-N 3.08Å
511	P	48.5	Very low	52.7	Low	67 Å²	67	88 Å²	88	44%	0.435	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	121.9	174.9	25.8	-33.7	0	0	0	108.5	A530 S531 T536 C943	P511-A530 VanDerWaalsContact O-O 3.06Å; P511-S531 WeakPolarHBondContact O-CA 3.44Å; P511-T536 HydrophobicContact CB-CG2 3.6Å; P511-T536 HydrophobicContact CG-CG2 3.77Å; P511-C943 WeakPolarHBondContact CB-O 3.26Å
512	G	52	Low	55.2	Low	2 Å²	2	80.9 Å²	80.9	2%	0.021	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	121.3	-18.6	-170	0	0	0	0	0	115.2	G510 Y514 S515 A530	G510-G512 PolarHBondContact O-N 2.91Å; G510-G512 VanDerWaalsContact O-N 3.1Å; G512-Y514 PolarHBondContact O-N 3.13Å; G512-S515 PolarHBondContact O-N 2.73Å; G512-S515 VanDerWaalsContact O-N 3.1Å; G512-A530 WeakPolarHBondContact CA-O 3.42Å
513	A	59.8	Low	57.8	Low	45 Å²	45	77.8 Å²	77.8	37%	0.372	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.2	179.2	0	0	0	0	0	115	G510	G510-A513 PolarHBondContact O-N 2.84Å; G510-A513 VanDerWaalsContact O-N 3.08Å
514	Y	82.4	Confident	60.7	Low	68 Å²	68	75.7 Å²	75.7	27%	0.267	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-1.1	-177	-51.3	-80.7	0	0	0	113.8	S509 G512 L905 T906 H907	S509-Y514 PolarHBondContact OG-OH 2.92Å; G512-Y514 PolarHBondContact O-N 3.13Å; Y514-L905 CarbonylContact O-C 3.59Å; Y514-L905 VanDerWaalsContact O-CA 3.3Å; Y514-L905 WeakPolarHBondContact O-CA 3.5Å; Y514-T906 WeakPolarHBondContact CD1-O 3.39Å; Y514-T906 PolarHBondContact O-N 2.86Å; Y514-H907 HydrophobicContact CD1-CB 4.07Å; Y514-H907 AromaticContact CD1-ND1 3.47Å; Y514-H907 WeakPolarHBondContact CD1-ND1 3.48Å; Y514-H907 HydrophobicContact CD2-CB 4.44Å; Y514-H907 AromaticContact CD2-ND1 3.46Å; Y514-H907 WeakPolarHBondContact CD2-ND1 3.5Å; Y514-H907 AromaticContact CE1-ND1 3.29Å; Y514-H907 VanDerWaalsContact CE1-ND1 3.29Å; Y514-H907 WeakPolarHBondContact CE1-ND1 3.41Å; Y514-H907 AromaticContact CE2-CE1 3.81Å; Y514-H907 AromaticContact CE2-ND1 3.32Å; Y514-H907 VanDerWaalsContact CE2-ND1 3.32Å; Y514-H907 WeakPolarHBondContact CE2-ND1 3.42Å; Y514-H907 HydrophobicContact CG-CB 3.92Å; Y514-H907 AromaticContact CG-ND1 3.55Å; Y514-H907 AromaticContact CZ-CE1 3.68Å; Y514-H907 AromaticContact CZ-ND1 3.21Å
515	S	86.2	Confident	63.6	Low	1 Å²	1	76.5 Å²	76.5	1%	0.007	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.5	-178.6	175.2	0	0	0	0	112	G512 C527 L905 Y940	G512-S515 PolarHBondContact O-N 2.73Å; G512-S515 VanDerWaalsContact O-N 3.1Å; S515-C527 WeakPolarHBondContact O-CB 3.49Å; S515-C527 PolarHBondContact O-N 2.94Å; S515-C527 WeakPolarHBondContact OG-CB 3.48Å; S515-L905 WeakPolarHBondContact OG-CD2 3.21Å; S515-Y940 WeakPolarHBondContact CB-O 3.33Å; S515-Y940 PolarHBondContact OG-O 3.01Å
516	F	88.6	Confident	66.3	Low	49 Å²	49	71.1 Å²	71.1	22%	0.215	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.9	179.6	-59.8	-92.3	0	0	0	110	T524 R525 P526 F903 R904 T906	F516-T524 HydrophobicContact CB-CG2 4.01Å; F516-R525 CarbonylContact C-O 3.56Å; F516-R525 VanDerWaalsContact CA-O 3.3Å; F516-R525 WeakPolarHBondContact CA-O 3.39Å; F516-P526 HydrophobicContact CD1-CG 4.35Å; F516-P526 HydrophobicContact CE1-CG 4.16Å; F516-F903 CarbonylContact O-C 3.56Å; F516-F903 WeakPolarHBondContact O-CA 3.4Å; F516-R904 PolarHBondContact N-O 3.26Å; F516-R904 PolarHBondContact O-N 3.41Å; F516-T906 HydrophobicContact CD2-CG2 4.42Å; F516-T906 HydrophobicContact CE2-CG2 4.44Å; F516-T906 WeakPolarHBondContact CE2-OG1 3.25Å
517	I	85.8	Confident	68.9	Low	5 Å²	5	64.2 Å²	64.2	3%	0.026	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126	165.7	-66.6	161.8	0	0	0	107.2	L519 T524 R525 C527 P900 F903	I517-L519 HydrophobicContact CG2-CD2 4.22Å; I517-T524 WeakPolarHBondContact O-CA 3.39Å; I517-R525 HydrophobicContact CB-CG 3.84Å; I517-R525 HydrophobicContact CG2-CG 4.28Å; I517-R525 PolarHBondContact N-O 2.8Å; I517-R525 PolarHBondContact O-N 2.85Å; I517-C527 HydrophobicContact CD1-CB 4.41Å; I517-C527 HydrophobicContact CG1-CB 4.09Å; I517-P900 HydrophobicContact CB-CB 4.26Å; I517-P900 HydrophobicContact CD1-CB 3.87Å; I517-P900 HydrophobicContact CD1-CG 3.76Å; I517-P900 HydrophobicContact CG1-CB 3.76Å; I517-P900 HydrophobicContact CG1-CG 4.01Å; I517-P900 HydrophobicContact CG2-CB 3.53Å; I517-F903 HydrophobicContact CG1-CD1 3.87Å; I517-F903 HydrophobicContact CG1-CE1 3.83Å
518	V	86	Confident	71.1	Confident	16 Å²	16	61.4 Å²	61.4	10%	0.097	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	136	169.4	-171.1	0	0	0	0	108.1	T524 H902 R904	V518-T524 HydrophobicContact CG2-CG2 4.11Å; V518-H902 HydrophobicContact CB-CB 4.11Å; V518-H902 WeakPolarHBondContact CB-ND1 3.46Å; V518-H902 PolarHBondContact N-O 2.85Å; V518-R904 HydrophobicContact CG2-CB 3.87Å
519	L	84.9	Confident	73.4	Confident	53 Å²	53	57 Å²	57	28%	0.277	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-102.1	155.4	178.3	-62	175.8	0	0	0	110.3	I517 N521 G522 Q523	I517-L519 HydrophobicContact CG2-CD2 4.22Å; L519-N521 VanDerWaalsContact CB-OD1 3.3Å; L519-N521 WeakPolarHBondContact CB-OD1 3.45Å; L519-N521 PolarHBondContact O-N 3.05Å; L519-G522 PolarHBondContact O-N 3.43Å; L519-Q523 WeakPolarHBondContact CB-O 3.43Å; L519-Q523 PolarHBondContact N-O 3.26Å
520	P	74.1	Confident	75.3	Confident	74 Å²	74	53.8 Å²	53.8	48%	0.481	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-7.2	179.2	-26.4	35.8	0	0	0	115.9	P871	P520-P871 WeakPolarHBondContact O-CB 3.34Å; P520-P871 WeakPolarHBondContact O-CD 3.36Å; P520-P871 VanDerWaalsContact O-CG 3.26Å; P520-P871 WeakPolarHBondContact O-CG 3.38Å
521	N	75.8	Confident	76.7	Confident	100 Å²	100	55 Å²	55	54%	0.535	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	11.2	171.1	70.6	-10	0	0	0	113.3	L519 Q523	L519-N521 VanDerWaalsContact CB-OD1 3.3Å; L519-N521 WeakPolarHBondContact CB-OD1 3.45Å; L519-N521 PolarHBondContact O-N 3.05Å; N521-Q523 PolarHBondContact ND2-OE1 3.4Å; N521-Q523 PolarHBondContact O-N 3.37Å; N521-Q523 VanDerWaalsContact OD1-CB 3.29Å; N521-Q523 WeakPolarHBondContact OD1-CB 3.27Å; N521-Q523 PolarHBondContact OD1-N 3.29Å; N521-Q523 VanDerWaalsContact OD1-N 3.1Å
522	G	75.8	Confident	77.7	Confident	52 Å²	52	53.7 Å²	53.7	54%	0.536	32%	0.32	S	S	.	.	S	Bend	trans	76.8	-7.7	-177.9	0	0	0	0	0	115.4	L519	L519-G522 PolarHBondContact O-N 3.43Å
523	Q	81.1	Confident	78.4	Confident	123 Å²	123	58.9 Å²	58.9	58%	0.575	35%	0.353	S	S	*	.			trans	-74.9	149.8	176.9	-62.2	179.1	-21.9	0	0	111.1	L519 N521	L519-Q523 WeakPolarHBondContact CB-O 3.43Å; L519-Q523 PolarHBondContact N-O 3.26Å; N521-Q523 PolarHBondContact ND2-OE1 3.4Å; N521-Q523 PolarHBondContact O-N 3.37Å; N521-Q523 VanDerWaalsContact OD1-CB 3.29Å; N521-Q523 WeakPolarHBondContact OD1-CB 3.27Å; N521-Q523 PolarHBondContact OD1-N 3.29Å; N521-Q523 VanDerWaalsContact OD1-N 3.1Å
524	T	85	Confident	78.9	Confident	64 Å²	64	59 Å²	59	39%	0.393	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	147.2	173.9	41.3	0	0	0	0	112	F516 I517 V518 R904	F516-T524 HydrophobicContact CB-CG2 4.01Å; I517-T524 WeakPolarHBondContact O-CA 3.39Å; V518-T524 HydrophobicContact CG2-CG2 4.11Å; T524-R904 VanDerWaalsContact CG2-NH1 3.35Å
525	R	84.9	Confident	78.5	Confident	118 Å²	118	55.8 Å²	55.8	45%	0.445	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	141.7	168	65	-178.3	178.8	117.1	-8	110.3	F516 I517 C527	F516-R525 CarbonylContact C-O 3.56Å; F516-R525 VanDerWaalsContact CA-O 3.3Å; F516-R525 WeakPolarHBondContact CA-O 3.39Å; I517-R525 HydrophobicContact CB-CG 3.84Å; I517-R525 HydrophobicContact CG2-CG 4.28Å; I517-R525 PolarHBondContact N-O 2.8Å; I517-R525 PolarHBondContact O-N 2.85Å; R525-C527 PolarHBondContact O-N 3.03Å
526	P	82	Confident	78.1	Confident	96 Å²	96	56.9 Å²	56.9	62%	0.623	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.8	137.8	176.7	-26.9	35.2	0	0	0	112.6	F516 A528	F516-P526 HydrophobicContact CD1-CG 4.35Å; F516-P526 HydrophobicContact CE1-CG 4.16Å; P526-A528 PolarHBondContact O-N 2.91Å; P526-A528 VanDerWaalsContact O-N 3.17Å
527	C	82.2	Confident	77.6	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.007	37%	0.366	C	S	.	.			trans	-83.5	92.6	-175.9	-169.3	0	0	0	0	111.3	S515 I517 R525 L529 A530 S531	S515-C527 WeakPolarHBondContact O-CB 3.49Å; S515-C527 PolarHBondContact O-N 2.94Å; S515-C527 WeakPolarHBondContact OG-CB 3.48Å; I517-C527 HydrophobicContact CD1-CB 4.41Å; I517-C527 HydrophobicContact CG1-CB 4.09Å; R525-C527 PolarHBondContact O-N 3.03Å; C527-L529 PolarHBondContact O-N 2.81Å; C527-L529 VanDerWaalsContact O-N 3.11Å; C527-A530 HydrophobicContact CB-CB 3.97Å; C527-A530 WeakPolarHBondContact O-CB 3.23Å; C527-A530 PolarHBondContact O-N 3.26Å; C527-S531 PolarHBondContact O-N 3.24Å
528	A	76.3	Confident	77.2	Confident	80 Å²	80	59.7 Å²	59.7	66%	0.661	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.7	178.4	0	0	0	0	0	114	P526 A532	P526-A528 PolarHBondContact O-N 2.91Å; P526-A528 VanDerWaalsContact O-N 3.17Å; A528-A532 PolarHBondContact O-N 3.23Å
529	L	76.4	Confident	76.9	Confident	77 Å²	77	68.1 Å²	68.1	40%	0.403	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-39	173.7	-66.2	174.1	0	0	0	112	C527 S531 A532 A535 P900 Y940	C527-L529 PolarHBondContact O-N 2.81Å; C527-L529 VanDerWaalsContact O-N 3.11Å; L529-S531 VanDerWaalsContact C-N 3.28Å; L529-S531 PolarHBondContact O-N 2.61Å; L529-A532 WeakPolarHBondContact O-CB 3.24Å; L529-A532 PolarHBondContact O-N 3.48Å; L529-A535 WeakPolarHBondContact O-CB 3.19Å; L529-P900 HydrophobicContact CD1-CG 4.44Å; L529-Y940 HydrophobicContact CB-CD1 4.13Å; L529-Y940 HydrophobicContact CB-CD2 4.49Å; L529-Y940 HydrophobicContact CB-CE1 4.46Å; L529-Y940 HydrophobicContact CB-CG 4.14Å; L529-Y940 HydrophobicContact CD1-CD1 4.48Å
530	A	72.4	Confident	76.7	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-31.8	178.6	0	0	0	0	0	112.2	P511 G512 C527 A535 Y940 A942	P511-A530 VanDerWaalsContact O-O 3.06Å; G512-A530 WeakPolarHBondContact CA-O 3.42Å; C527-A530 HydrophobicContact CB-CB 3.97Å; C527-A530 WeakPolarHBondContact O-CB 3.23Å; C527-A530 PolarHBondContact O-N 3.26Å; A530-A535 VanDerWaalsContact O-CB 3.26Å; A530-A535 WeakPolarHBondContact O-CB 3.44Å; A530-Y940 HydrophobicContact CB-CD2 3.93Å; A530-A942 HydrophobicContact CB-CB 4.16Å; A530-A942 WeakPolarHBondContact O-CB 3.37Å
531	S	70.1	Confident	77.4	Confident	64 Å²	64	64.3 Å²	64.3	45%	0.448	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	4.2	178.6	-54.4	0	0	0	0	114.8	P511 C527 L529	P511-S531 WeakPolarHBondContact O-CA 3.44Å; C527-S531 PolarHBondContact O-N 3.24Å; L529-S531 VanDerWaalsContact C-N 3.28Å; L529-S531 PolarHBondContact O-N 2.61Å
532	A	70.2	Confident	78.1	Confident	40 Å²	40	59.5 Å²	59.5	33%	0.331	38%	0.376	S	S	.	.	S	Bend	trans	-74.8	144.6	179.5	0	0	0	0	0	111.2	A528 L529 G534 A535	A528-A532 PolarHBondContact O-N 3.23Å; L529-A532 WeakPolarHBondContact O-CB 3.24Å; L529-A532 PolarHBondContact O-N 3.48Å; A532-G534 PolarHBondContact O-N 3.34Å; A532-G534 VanDerWaalsContact O-N 3.14Å; A532-A535 HydrophobicContact CB-CB 4.46Å; A532-A535 WeakPolarHBondContact O-CB 3.37Å; A532-A535 PolarHBondContact O-N 2.84Å
533	P	65.8	Low	78.7	Confident	111 Å²	111	61.1 Å²	61.1	72%	0.721	37%	0.366	S	S	*	.	H	α-helix	trans	-56.8	-34.1	178	-27.6	35.5	0	0	0	113.8	A535 T537	P533-A535 PolarHBondContact O-N 3.48Å; P533-T537 WeakPolarHBondContact O-CB 3.24Å; P533-T537 WeakPolarHBondContact O-CG2 3.17Å; P533-T537 PolarHBondContact O-OG1 3.06Å
534	G	70.9	Confident	79.2	Confident	46 Å²	46	60.2 Å²	60.2	47%	0.474	36%	0.358	S	S	.	.	H	α-helix	trans	-70.8	-10.6	174.7	0	0	0	0	0	115.2	A532 T537 R937	A532-G534 PolarHBondContact O-N 3.34Å; A532-G534 VanDerWaalsContact O-N 3.14Å; G534-T537 WeakPolarHBondContact CA-OG1 3.36Å; G534-R937 PolarHBondContact O-NH1 3.48Å
535	A	73.9	Confident	79.7	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.008	34%	0.341	C	S	.	.	H	α-helix	trans	-68.1	-44.6	-176.8	0	0	0	0	0	112	L529 A530 A532 P533 L541 R937 Y940 A942	L529-A535 WeakPolarHBondContact O-CB 3.19Å; A530-A535 VanDerWaalsContact O-CB 3.26Å; A530-A535 WeakPolarHBondContact O-CB 3.44Å; A532-A535 HydrophobicContact CB-CB 4.46Å; A532-A535 WeakPolarHBondContact O-CB 3.37Å; A532-A535 PolarHBondContact O-N 2.84Å; P533-A535 PolarHBondContact O-N 3.48Å; A535-L541 VanDerWaalsContact O-CD1 3.31Å; A535-L541 WeakPolarHBondContact O-CD1 3.44Å; A535-R937 WeakPolarHBondContact O-CD 3.5Å; A535-R937 PolarHBondContact O-NH1 3.17Å; A535-Y940 HydrophobicContact CB-CE2 3.98Å; A535-A942 HydrophobicContact CB-CB 3.87Å
536	T	78.1	Confident	80	Confident	25 Å²	25	54.8 Å²	54.8	15%	0.153	33%	0.333	C	S	.	.	H	α-helix	trans	-101.5	-10.1	179.6	61.7	0	0	0	0	114.1	P511 R543 A942 C943 L944	P511-T536 HydrophobicContact CB-CG2 3.6Å; P511-T536 HydrophobicContact CG-CG2 3.77Å; T536-R543 PolarHBondContact O-NH1 3.45Å; T536-A942 HydrophobicContact CG2-CB 4.34Å; T536-C943 WeakPolarHBondContact CG2-O 3.47Å; T536-L944 HydrophobicContact CG2-CD2 4.06Å
537	T	77	Confident	80.6	Confident	79 Å²	79	53.9 Å²	53.9	49%	0.485	32%	0.32	S	S	.	.	H	α-helix	trans	-99.4	-4.9	-168.8	57.9	0	0	0	0	115.9	P533 G534 R543	P533-T537 WeakPolarHBondContact O-CB 3.24Å; P533-T537 WeakPolarHBondContact O-CG2 3.17Å; P533-T537 PolarHBondContact O-OG1 3.06Å; G534-T537 WeakPolarHBondContact CA-OG1 3.36Å; T537-R543 PolarHBondContact O-NH2 3.3Å
538	A	78	Confident	80.9	Confident	33 Å²	33	54 Å²	54	27%	0.273	32%	0.321	S	S	.	.	S	Bend	trans	-60.6	156.6	177.6	0	0	0	0	0	112.9	L541 R543	A538-L541 HydrophobicContact CB-CD1 3.71Å; A538-L541 HydrophobicContact CB-CG 4.16Å; A538-R543 PolarHBondContact O-NH2 3.33Å; A538-R543 VanDerWaalsContact O-NH2 3.16Å
539	Q	79.1	Confident	81.7	Confident	194 Å²	194	50.4 Å²	50.4	91%	0.907	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	152.4	168.7	-67.9	-178.2	-26.5	0	0	109.8	L541	Q539-L541 VanDerWaalsContact C-N 3.25Å; Q539-L541 PolarHBondContact O-N 3.34Å
540	G	81.5	Confident	82.4	Confident	44 Å²	44	47.9 Å²	47.9	45%	0.454	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-10.1	-174.5	0	0	0	0	0	115.2	F981	G540-F981 VanDerWaalsContact O-CD1 3.27Å; G540-F981 WeakPolarHBondContact O-CD1 3.17Å; G540-F981 VanDerWaalsContact O-CE1 3.25Å; G540-F981 WeakPolarHBondContact O-CE1 3.26Å
541	L	88.2	Confident	83.5	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	28%	0.28	C	S	.	.			trans	-87.4	134.6	176.2	-61.6	177.2	0	0	0	112.3	A535 A538 Q539 D922 R937 L944	A535-L541 VanDerWaalsContact O-CD1 3.31Å; A535-L541 WeakPolarHBondContact O-CD1 3.44Å; A538-L541 HydrophobicContact CB-CD1 3.71Å; A538-L541 HydrophobicContact CB-CG 4.16Å; Q539-L541 VanDerWaalsContact C-N 3.25Å; Q539-L541 PolarHBondContact O-N 3.34Å; L541-D922 HydrophobicContact CD2-CB 4.36Å; L541-R937 HydrophobicContact CD2-CG 4.28Å; L541-L944 HydrophobicContact CB-CD1 4.35Å; L541-L944 HydrophobicContact CB-CD2 4.37Å; L541-L944 HydrophobicContact CD1-CD2 4Å; L541-L944 HydrophobicContact CD2-CD1 4.08Å
542	P	90.5	Very high	84.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.277	C	S	.	.			trans	-64.8	145.8	176.1	30.4	-40.4	0	0	0	112	W923 A935 L944 L945 V979 F981	P542-W923 HydrophobicContact CG-CB 4.5Å; P542-W923 HydrophobicContact CG-CD2 3.61Å; P542-W923 HydrophobicContact CG-CE3 3.88Å; P542-W923 HydrophobicContact CG-CG 3.91Å; P542-W923 HydrophobicContact CG-CZ2 4.34Å; P542-W923 HydrophobicContact CG-CZ3 4.35Å; P542-A935 HydrophobicContact CG-CB 4.24Å; P542-L944 HydrophobicContact CG-CB 4.47Å; P542-L944 HydrophobicContact CG-CD1 3.82Å; P542-L945 HydrophobicContact CB-CD2 3.89Å; P542-L945 HydrophobicContact CG-CD2 4.39Å; P542-V979 HydrophobicContact CB-CG1 3.53Å; P542-F981 HydrophobicContact CB-CE1 4.36Å
543	R	89.5	Confident	85.7	Confident	85 Å²	85	46.3 Å²	46.3	32%	0.321	26%	0.264	S	S	.	.			trans	-120.3	-31	-177.8	-53.6	-57.1	-175.6	117.3	8.1	114	T536 T537 A538 I980 F981	T536-R543 PolarHBondContact O-NH1 3.45Å; T537-R543 PolarHBondContact O-NH2 3.3Å; A538-R543 PolarHBondContact O-NH2 3.33Å; A538-R543 VanDerWaalsContact O-NH2 3.16Å; R543-I980 WeakPolarHBondContact CA-O 3.29Å; R543-I980 WeakPolarHBondContact CB-O 3.28Å; R543-I980 PolarHBondContact N-O 3.43Å; R543-F981 WeakPolarHBondContact CG-O 3.31Å
544	R	92	Very high	86.9	Confident	104 Å²	104	43.3 Å²	43.3	39%	0.392	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	140.9	175.8	-170.7	179.4	72.9	-163	-1.2	110	I980	R544-I980 HydrophobicContact CB-CB 4.4Å; R544-I980 PolarHBondContact N-O 3.21Å; R544-I980 WeakPolarHBondContact O-CB 3.45Å; R544-I980 PolarHBondContact O-N 2.77Å
545	L	93.9	Very high	88	Confident	10 Å²	10	42.9 Å²	42.9	5%	0.052	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	112.8	161.1	-65.5	178.5	0	0	0	108.5	L925 V933 L945 V965 Y977 V979	L545-L925 HydrophobicContact CD1-CD1 4.31Å; L545-V933 HydrophobicContact CD1-CG1 3.7Å; L545-L945 HydrophobicContact CD1-CD1 3.85Å; L545-L945 HydrophobicContact CG-CD1 3.72Å; L545-L945 HydrophobicContact CG-CD2 4.18Å; L545-V965 HydrophobicContact CD2-CB 4.22Å; L545-V965 HydrophobicContact CD2-CG2 3.96Å; L545-Y977 HydrophobicContact CB-CD1 3.68Å; L545-Y977 HydrophobicContact CB-CE1 4.45Å; L545-Y977 HydrophobicContact CB-CG 3.98Å; L545-V979 HydrophobicContact CD2-CG2 3.89Å
546	Q	93	Very high	89	Confident	59 Å²	59	42.9 Å²	42.9	28%	0.276	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	109.1	176.7	175.8	165.6	-47	0	0	109.5	L548 Y977 E978 I980	Q546-L548 HydrophobicContact CG-CD2 4.49Å; Q546-L548 PolarHBondContact O-N 2.87Å; Q546-Y977 CarbonylContact O-C 3.52Å; Q546-Y977 VanDerWaalsContact O-CA 3.27Å; Q546-Y977 WeakPolarHBondContact O-CA 3.44Å; Q546-E978 HydrophobicContact CB-CB 4.48Å; Q546-E978 PolarHBondContact N-O 3.1Å; Q546-E978 PolarHBondContact O-N 3.08Å; Q546-I980 HydrophobicContact CB-CD1 4.15Å; Q546-I980 HydrophobicContact CB-CG1 3.79Å
547	H	92.8	Very high	89.8	Confident	76 Å²	76	41.7 Å²	41.7	35%	0.352	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	127.7	177.7	-172.6	-104.9	0	0	0	111	A549 S550 N975 Y977	H547-A549 PolarHBondContact NE2-O 3.4Å; H547-S550 PolarHBondContact CE1-N 2.91Å; H547-S550 PolarHBondContact CE1-OG 2.91Å; H547-S550 PolarHBondContact NE2-N 2.76Å; H547-S550 PolarHBondContact NE2-OG 2.66Å; H547-N975 WeakPolarHBondContact NE2-CB 3.4Å; H547-N975 PolarHBondContact NE2-OD1 3.43Å; H547-Y977 HydrophobicContact CB-CD1 3.95Å; H547-Y977 HydrophobicContact CB-CE1 3.83Å; H547-Y977 AromaticContact CD2-CE1 3.74Å; H547-Y977 AromaticContact CD2-CZ 3.83Å
548	L	90.2	Very high	90.7	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.026	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-33.7	-179.6	-65.4	-172.9	0	0	0	113	Q546 L635 F964 L976 E978	Q546-L548 HydrophobicContact CG-CD2 4.49Å; Q546-L548 PolarHBondContact O-N 2.87Å; L548-L635 WeakPolarHBondContact O-CD2 3.5Å; L548-F964 HydrophobicContact CD1-CD1 4.12Å; L548-F964 HydrophobicContact CD1-CE1 3.68Å; L548-L976 HydrophobicContact CB-CD2 4.04Å; L548-L976 HydrophobicContact CB-CG 4.18Å; L548-L976 HydrophobicContact CD1-CD2 4.16Å; L548-L976 HydrophobicContact CD1-CG 4.35Å; L548-L976 PolarHBondContact N-O 3.21Å; L548-E978 HydrophobicContact CD1-CB 3.94Å; L548-E978 HydrophobicContact CD2-CB 4.21Å; L548-E978 HydrophobicContact CG-CB 4.09Å
549	A	91.3	Very high	91.6	Very high	3 Å²	3	36.8 Å²	36.8	3%	0.025	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	151.9	-176.4	0	0	0	0	0	112.3	H547 L551 I626 I640 L976	H547-A549 PolarHBondContact NE2-O 3.4Å; A549-L551 HydrophobicContact CB-CD2 4.18Å; A549-I626 HydrophobicContact CB-CG2 3.51Å; A549-I640 HydrophobicContact CB-CD1 3.89Å; A549-L976 HydrophobicContact CB-CB 4.29Å; A549-L976 HydrophobicContact CB-CD2 4.41Å; A549-L976 PolarHBondContact O-N 3.28Å
550	S	93	Very high	92.5	Very high	25 Å²	25	28 Å²	28	18%	0.175	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.2	161	-56.2	0	0	0	0	108.8	H547 P552 A974 N975	H547-S550 PolarHBondContact CE1-N 2.91Å; H547-S550 PolarHBondContact CE1-OG 2.91Å; H547-S550 PolarHBondContact NE2-N 2.76Å; H547-S550 PolarHBondContact NE2-OG 2.66Å; S550-P552 WeakPolarHBondContact O-CD 3.33Å; S550-A974 CarbonylContact C-O 3.52Å; S550-A974 WeakPolarHBondContact CA-O 3.47Å; S550-N975 VanDerWaalsContact CB-OD1 3.3Å; S550-N975 WeakPolarHBondContact CB-OD1 3.48Å; S550-N975 PolarHBondContact OG-OD1 3.49Å
551	L	94.1	Very high	93.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	112	-177.6	-47.7	179.5	0	0	0	109.1	A549 H553 A610 T612 W621 L623 I626 I640 R973 A974	A549-L551 HydrophobicContact CB-CD2 4.18Å; L551-H553 PolarHBondContact O-N 2.72Å; L551-A610 HydrophobicContact CD1-CB 4.45Å; L551-T612 HydrophobicContact CD1-CG2 4.45Å; L551-W621 HydrophobicContact CB-CD2 4.08Å; L551-W621 HydrophobicContact CB-CE3 4.23Å; L551-W621 HydrophobicContact CB-CH2 4.08Å; L551-W621 HydrophobicContact CB-CZ2 3.92Å; L551-W621 HydrophobicContact CB-CZ3 4.24Å; L551-W621 HydrophobicContact CD1-CB 4.28Å; L551-W621 HydrophobicContact CD1-CD2 4.07Å; L551-W621 HydrophobicContact CD1-CG 3.85Å; L551-W621 HydrophobicContact CD2-CD2 4.36Å; L551-W621 HydrophobicContact CD2-CE3 4.2Å; L551-W621 HydrophobicContact CG-CD2 4.4Å; L551-L623 HydrophobicContact CD1-CD2 4.42Å; L551-I626 HydrophobicContact CD2-CD1 3.74Å; L551-I640 HydrophobicContact CD2-CG2 3.92Å; L551-R973 VanDerWaalsContact O-CA 3.32Å; L551-R973 WeakPolarHBondContact O-CA 3.25Å; L551-A974 HydrophobicContact CB-CB 4.25Å; L551-A974 HydrophobicContact CD1-CB 4.39Å; L551-A974 PolarHBondContact N-O 3.03Å; L551-A974 PolarHBondContact O-N 3.08Å
552	P	93.7	Very high	93.3	Very high	59 Å²	59	27 Å²	27	38%	0.383	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	103.9	-172.9	30.3	-34	0	0	0	111.7	S550 W621 I640	S550-P552 WeakPolarHBondContact O-CD 3.33Å; P552-W621 HydrophobicContact CG-CH2 4.36Å; P552-W621 WeakPolarHBondContact O-CH2 3.27Å; P552-I640 WeakPolarHBondContact CG-O 3.31Å
553	H	92.9	Very high	93.2	Very high	11 Å²	11	27.3 Å²	27.3	5%	0.051	15%	0.147	C	C	.	.			trans	-82.7	-41.2	173.1	-151.7	-32.5	0	0	0	111.4	L551 D555 V557 T612 A614 S617 K619 K972	L551-H553 PolarHBondContact O-N 2.72Å; H553-D555 VanDerWaalsContact C-N 3.33Å; H553-V557 HydrophobicContact CB-CG2 3.53Å; H553-T612 PolarHBondContact CD2-O 2.99Å; H553-T612 VanDerWaalsContact CD2-O 3.29Å; H553-T612 PolarHBondContact CD2-OG1 3.34Å; H553-T612 PolarHBondContact NE2-O 3.11Å; H553-A614 HydrophobicContact CB-CB 4.47Å; H553-A614 VanDerWaalsContact CD2-CB 3.48Å; H553-A614 WeakPolarHBondContact CD2-CB 3.38Å; H553-A614 WeakPolarHBondContact NE2-CB 3.39Å; H553-A614 PolarHBondContact NE2-N 3.48Å; H553-S617 PolarHBondContact CE1-OG 2.75Å; H553-S617 PolarHBondContact NE2-O 2.84Å; H553-K619 WeakPolarHBondContact ND1-CD 3.17Å; H553-K619 WeakPolarHBondContact ND1-CE 3.19Å; H553-K619 PolarHBondContact ND1-NZ 3.23Å; H553-K619 PolarHBondContact O-NZ 3.19Å; H553-K972 PolarHBondContact N-O 2.89Å
554	G	91.1	Very high	92.6	Very high	49 Å²	49	25.9 Å²	25.9	51%	0.505	15%	0.148	S	C	.	.	S	Bend	trans	95.4	-18.5	178	0	0	0	0	0	113.7	K972	G554-K972 PolarHBondContact N-O 3Å; G554-K972 WeakPolarHBondContact O-CD 3.45Å; G554-K972 PolarHBondContact O-NZ 3.3Å
555	D	94.8	Very high	91.4	Very high	36 Å²	36	22.4 Å²	22.4	19%	0.193	14%	0.14	C	C	.	.	S	Bend	trans	-123.3	166.8	158.8	-99.8	-38.3	0	0	0	111.6	H553 V557 A614 R615 K972	H553-D555 VanDerWaalsContact C-N 3.33Å; D555-V557 PolarHBondContact O-N 2.88Å; D555-A614 HydrophobicContact CB-CB 4.15Å; D555-R615 HydrophobicContact CB-CB 3.86Å; D555-R615 VanDerWaalsContact OD2-CD 3.32Å; D555-R615 WeakPolarHBondContact OD2-CD 3.44Å; D555-K972 CarbonylContact O-C 3.56Å; D555-K972 VanDerWaalsContact O-CA 3.32Å; D555-K972 WeakPolarHBondContact O-CA 3.47Å; D555-K972 IonicContact OD1-NZ 3.27Å; D555-K972 PolarHBondContact OD1-NZ 3.46Å
556	V	93.9	Very high	90.3	Very high	1 Å²	1	22 Å²	22	1%	0.006	14%	0.138	C	C	.	.			trans	-56.3	123.2	-175.4	177	0	0	0	0	110.3	A261 A262 A265 C558 A614 Y654 L954 K972	A261-V556 HydrophobicContact CB-CG2 4.29Å; A262-V556 HydrophobicContact CB-CG1 4.34Å; A265-V556 HydrophobicContact CB-CG1 4.15Å; V556-C558 PolarHBondContact O-N 2.85Å; V556-A614 WeakPolarHBondContact O-CA 3.35Å; V556-A614 VanDerWaalsContact O-CB 3.25Å; V556-A614 WeakPolarHBondContact O-CB 3.49Å; V556-Y654 HydrophobicContact CB-CE1 3.95Å; V556-L954 HydrophobicContact CG1-CD1 3.34Å; V556-K972 HydrophobicContact CG2-CG 4.32Å
557	V	96.3	Very high	88.7	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.144	C	C	.	.			trans	-83.9	105.5	-177.7	-176.4	0	0	0	0	109.3	H553 D555 A559 V560 G613 G968 S969 R973 A974	H553-V557 HydrophobicContact CB-CG2 3.53Å; D555-V557 PolarHBondContact O-N 2.88Å; V557-A559 WeakPolarHBondContact CG1-O 3.26Å; V557-V560 HydrophobicContact CG1-CG1 3.74Å; V557-G613 CarbonylContact C-O 3.5Å; V557-G613 WeakPolarHBondContact CA-O 3.45Å; V557-G968 CarbonylContact O-C 3.6Å; V557-S969 PolarHBondContact N-O 3.31Å; V557-R973 VanDerWaalsContact CG2-C 3.48Å; V557-R973 WeakPolarHBondContact CG2-O 3.49Å; V557-A974 HydrophobicContact CG1-CB 4.27Å; V557-A974 HydrophobicContact CG2-CB 4.43Å
558	C	95.9	Very high	86.9	Confident	8 Å²	8	22.1 Å²	22.1	5%	0.054	16%	0.162	C	C	.	.			trans	-101.3	-14.2	-173.5	-64.6	0	0	0	0	113.3	V556 G613 V655	V556-C558 PolarHBondContact O-N 2.85Å; C558-G613 PolarHBondContact N-O 2.82Å; C558-V655 WeakPolarHBondContact CB-O 3.46Å
559	A	96.9	Very high	85.4	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	141.9	172.6	0	0	0	0	0	111	V557 G613 V655 I658	V557-A559 WeakPolarHBondContact CG1-O 3.26Å; A559-G613 PolarHBondContact N-O 2.86Å; A559-G613 PolarHBondContact O-N 3.35Å; A559-V655 HydrophobicContact CB-CG1 3.92Å; A559-I658 HydrophobicContact CB-CD1 3.97Å; A559-I658 HydrophobicContact CB-CG1 3.98Å
560	V	97.1	Very high	83.2	Confident	9 Å²	9	29.5 Å²	29.5	6%	0.055	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	153.7	167.1	-62.4	0	0	0	0	111	V557 Y611 T612 T955 D957 V966 A974	V557-V560 HydrophobicContact CG1-CG1 3.74Å; V560-Y611 CarbonylContact C-O 3.55Å; V560-Y611 WeakPolarHBondContact CA-O 3.38Å; V560-T612 HydrophobicContact CG1-CG2 4.18Å; V560-T955 HydrophobicContact CB-CG2 4.37Å; V560-T955 HydrophobicContact CG1-CG2 3.95Å; V560-T955 HydrophobicContact CG2-CG2 3.95Å; V560-T955 PolarHBondContact N-OG1 3.12Å; V560-D957 HydrophobicContact CG2-CB 4.23Å; V560-V966 HydrophobicContact CB-CG1 3.87Å; V560-V966 HydrophobicContact CG1-CG2 4.47Å; V560-V966 HydrophobicContact CG2-CG1 3.83Å; V560-A974 HydrophobicContact CG1-CB 4.44Å
561	T	95	Very high	81	Confident	11 Å²	11	29 Å²	29	7%	0.067	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	137.4	172	-59.4	0	0	0	0	109.6	Y611 I658 L660 D957	T561-Y611 PolarHBondContact N-O 2.83Å; T561-Y611 PolarHBondContact O-N 2.86Å; T561-I658 PolarHBondContact OG1-O 2.94Å; T561-I658 VanDerWaalsContact OG1-O 3.08Å; T561-L660 HydrophobicContact CG2-CD1 4.09Å; T561-L660 HydrophobicContact CG2-CG 4.07Å; T561-D957 WeakPolarHBondContact CA-OD2 3.42Å
562	L	92.5	Very high	78.3	Confident	15 Å²	15	33.7 Å²	33.7	8%	0.079	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	149.5	171.2	-69.8	171.7	0	0	0	110.7	F609 A610 L623 D957 V966	L562-F609 WeakPolarHBondContact CA-O 3.45Å; L562-A610 HydrophobicContact CD2-CB 3.95Å; L562-L623 HydrophobicContact CD2-CD1 3.51Å; L562-D957 PolarHBondContact N-OD2 3.39Å; L562-V966 HydrophobicContact CD1-CB 4.3Å; L562-V966 HydrophobicContact CD1-CG1 3.86Å; L562-V966 HydrophobicContact CD2-CB 4.12Å; L562-V966 HydrophobicContact CD2-CG1 3.79Å; L562-V966 HydrophobicContact CG-CB 4.29Å; L562-V966 HydrophobicContact CG-CG1 3.55Å
563	G	86.5	Confident	75.6	Confident	6 Å²	6	37.7 Å²	37.7	6%	0.062	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	173.1	175.8	0	0	0	0	0	114.2	F609	G563-F609 PolarHBondContact N-O 3.22Å; G563-F609 PolarHBondContact O-N 2.93Å
564	P	78.7	Confident	72.9	Confident	55 Å²	55	39 Å²	39	36%	0.357	27%	0.27	S	S	.	.	S	Bend	trans	-68.6	174.1	168	31.6	-36.3	0	0	0	111.7	V664	P564-V664 HydrophobicContact CG-CB 4.42Å; P564-V664 HydrophobicContact CG-CG1 3.89Å; P564-V664 HydrophobicContact CG-CG2 3.56Å
565	C	66.8	Low	70	Confident	32 Å²	32	41.2 Å²	41.2	22%	0.216	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-60.9	129.9	180	-163.5	0	0	0	0	112.5	R569 A607 F609	C565-R569 PolarHBondContact SG-O 3.27Å; C565-A607 PolarHBondContact N-O 3.26Å; C565-F609 VanDerWaalsContact CA-CD2 3.43Å; C565-F609 HydrophobicContact CB-CD2 3.88Å; C565-F609 HydrophobicContact CB-CE2 3.43Å; C565-F609 VanDerWaalsContact CB-CE2 3.43Å; C565-F609 HydrophobicContact CB-CZ 4.07Å; C565-F609 WeakPolarHBondContact SG-CE2 3.43Å; C565-F609 WeakPolarHBondContact SG-CZ 3.47Å
566	P	69	Low	66.9	Low	1 Å²	1	44.1 Å²	44.1	1%	0.006	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-63.5	139	175.5	23.8	-32.7	0	0	0	112.1	G568 R569 Y611 L620 L681	P566-G568 PolarHBondContact O-N 2.82Å; P566-R569 HydrophobicContact CG-CB 4.42Å; P566-R569 HydrophobicContact CG-CG 4.4Å; P566-R569 PolarHBondContact O-N 3.02Å; P566-R569 VanDerWaalsContact O-N 3.11Å; P566-Y611 WeakPolarHBondContact CG-OH 3.44Å; P566-L620 HydrophobicContact CG-CD2 4Å; P566-L681 HydrophobicContact CB-CB 3.93Å; P566-L681 HydrophobicContact CB-CD1 4.21Å
567	V	61.2	Low	63.8	Low	67 Å²	67	51.1 Å²	51.1	41%	0.406	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	130.3	-175.1	-176.2	0	0	0	0	111.2	V664 N682	V567-V664 HydrophobicContact CG2-CB 4.41Å; V567-N682 WeakPolarHBondContact CG1-OD1 3.41Å
568	G	55.2	Low	60.7	Low	71 Å²	71	56.5 Å²	56.5	73%	0.732	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	3	179.8	0	0	0	0	0	115.7	P566	P566-G568 PolarHBondContact O-N 2.82Å
569	R	58.7	Low	57.5	Low	63 Å²	63	61.5 Å²	61.5	24%	0.238	41%	0.411	C	S	.	.			trans	-104.7	139.7	161.3	-61.9	-167.8	-179.6	-151.4	0.8	109.6	C565 P566 L643 G683 P684	C565-R569 PolarHBondContact SG-O 3.27Å; P566-R569 HydrophobicContact CG-CB 4.42Å; P566-R569 HydrophobicContact CG-CG 4.4Å; P566-R569 PolarHBondContact O-N 3.02Å; P566-R569 VanDerWaalsContact O-N 3.11Å; R569-L643 PolarHBondContact NH1-O 2.76Å; R569-G683 PolarHBondContact NE-O 3.36Å; R569-G683 PolarHBondContact NH2-O 3.32Å; R569-P684 PolarHBondContact NH2-O 2.93Å
570	A	44.3	Very low	54.2	Low	99 Å²	99	69.6 Å²	69.6	82%	0.818	45%	0.453	S	S	*	.			trans	-101.1	120.9	170.2	0	0	0	0	0	108.9	S572	A570-S572 PolarHBondContact O-N 2.87Å
571	S	45.9	Very low	50.8	Low	15 Å²	15	73 Å²	73	11%	0.105	49%	0.49	C	S	.	.			trans	-60.5	130.7	161.9	50.4	0	0	0	0	108.7	L573	S571-L573 PolarHBondContact O-N 3.16Å
572	S	38.4	Very low	47.6	Very low	99 Å²	99	78 Å²	78	69%	0.692	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-0.3	-168.4	55	0	0	0	0	115.7	A570	A570-S572 PolarHBondContact O-N 2.87Å
573	L	37.1	Very low	44.5	Very low	142 Å²	142	89.1 Å²	89.1	74%	0.743	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140	10.4	-170.9	-129.9	78.2	0	0	0	115.6	S571 A628	S571-L573 PolarHBondContact O-N 3.16Å; L573-A628 HydrophobicContact CD2-CB 4.31Å
574	A	35.2	Very low	41.7	Very low	40 Å²	40	96.7 Å²	96.7	33%	0.331	61%	0.606	S	S	.	*	S	Bend	trans	-138.1	142	-179.2	0	0	0	0	0	113.3	A607	A574-A607 HydrophobicContact CB-CB 4.49Å
575	S	30.1	Very low	39.3	Very low	94 Å²	94	99 Å²	99	66%	0.657	63%	0.63	S	S	*	*			trans	-75.8	157.1	-164.4	-48.4	0	0	0	0	115.7	D577	S575-D577 VanDerWaalsContact C-N 3.34Å; S575-D577 PolarHBondContact O-N 3.18Å
576	A	29.5	Very low	37.4	Very low	97 Å²	97	101.3 Å²	101.3	80%	0.802	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	3.3	-168.4	0	0	0	0	0	116.5
577	D	29.4	Very low	35.7	Very low	148 Å²	148	106.9 Å²	106.9	79%	0.791	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-0.8	-161.8	-63	-63.6	0	0	0	116.2	S575	S575-D577 VanDerWaalsContact C-N 3.34Å; S575-D577 PolarHBondContact O-N 3.18Å
578	T	30.7	Very low	34.1	Very low	113 Å²	113	111 Å²	111	69%	0.693	72%	0.717	S	S	*	*	S	Bend	trans	-100.2	6.7	-168.3	-26.2	0	0	0	0	115.4
579	C	28.8	Very low	33.1	Very low	114 Å²	114	114.7 Å²	114.7	77%	0.77	73%	0.726	S	S	*	*	S	Bend	trans	-116.8	-0.8	-166.3	-61.5	0	0	0	0	117
580	L	28.5	Very low	31.6	Very low	171 Å²	171	119.2 Å²	119.2	90%	0.895	76%	0.755	S	S	*	*			trans	-136.8	48.9	-177	-75	177.1	0	0	0	114.2	S582	L580-S582 VanDerWaalsContact C-N 3.3Å; L580-S582 PolarHBondContact O-N 2.82Å
581	G	26.3	Very low	30.9	Very low	81 Å²	81	120.5 Å²	120.5	84%	0.835	76%	0.757	S	S	*	*			trans	-77.7	33	-175.5	0	0	0	0	0	117.8
582	S	26.1	Very low	30.1	Very low	116 Å²	116	125.6 Å²	125.6	81%	0.811	79%	0.788	S	S	*	*			trans	-163.2	86	172.5	-84.5	0	0	0	0	114.7	L580	L580-S582 VanDerWaalsContact C-N 3.3Å; L580-S582 PolarHBondContact O-N 2.82Å
583	R	27.7	Very low	29.6	Very low	248 Å²	248	127.6 Å²	127.6	94%	0.936	80%	0.796	S	S	*	*			trans	-139.9	149.3	152.2	-77.5	-164.3	167	-178.2	-4.1	109.9
584	N	29.6	Very low	29.1	Very low	165 Å²	165	127.4 Å²	127.4	88%	0.882	80%	0.8	S	S	*	*			trans	-81.5	141.1	-163.7	-74.1	-22.2	0	0	0	114.9
585	A	28	Very low	28.8	Very low	104 Å²	104	128.8 Å²	128.8	86%	0.86	82%	0.819	S	S	*	*			trans	42.5	119.2	138.3	0	0	0	0	0	121.2
586	G	26.3	Very low	28.7	Very low	80 Å²	80	130.1 Å²	130.1	83%	0.825	83%	0.828	S	S	*	*				116.3	93.5	122.4	0	0	0	0	0	118.7
587	S	33.5	Very low	29.2	Very low	118 Å²	118	132 Å²	132	83%	0.825	83%	0.832	S	S	*	*			trans	-174.6	131.7	141.2	57.5	0	0	0	0	110.9
588	D	26.4	Very low	28.9	Very low	154 Å²	154	128 Å²	128	82%	0.824	83%	0.826	S	S	*	*			trans	-80	153.2	179.9	-46.4	-89.4	0	0	0	113.5
589	T	35.3	Very low	28.7	Very low	147 Å²	147	127.7 Å²	127.7	90%	0.902	83%	0.828	S	S	*	*			trans	-172.4	141.7	137.8	9.6	0	0	0	0	112
590	D	26.1	Very low	28.7	Very low	159 Å²	159	128.5 Å²	128.5	85%	0.85	83%	0.825	S	S	*	*			trans	-79.3	149	-177.2	-60.4	-83.1	0	0	0	114.7
591	S	31.1	Very low	28.5	Very low	125 Å²	125	129.7 Å²	129.7	87%	0.874	83%	0.825	S	S	*	*			trans	-158.9	156.1	132.8	56.2	0	0	0	0	111.6
592	V	27.2	Very low	28.5	Very low	123 Å²	123	131.2 Å²	131.2	75%	0.745	82%	0.819	S	S	*	*			trans	-119.2	141.5	-165.7	172.4	0	0	0	0	111.6
593	T	27.9	Very low	28.6	Very low	140 Å²	140	131.7 Å²	131.7	86%	0.859	82%	0.817	S	S	*	*			trans	-154.8	133.1	143.6	-72.2	0	0	0	0	109.5
594	V	27.2	Very low	28.8	Very low	139 Å²	139	124 Å²	124	84%	0.842	80%	0.801	S	S	*	*			trans	-100.9	130.4	174	175.7	0	0	0	0	109
595	G	29.8	Very low	29.4	Very low	69 Å²	69	121 Å²	121	71%	0.711	78%	0.784	S	S	*	*			trans	-140.6	142.2	177.9	0	0	0	0	0	111.7
596	S	27.5	Very low	30.5	Very low	122 Å²	122	119.5 Å²	119.5	85%	0.853	77%	0.765	S	S	*	*			trans	-76.3	159.6	-170.1	-69.1	0	0	0	0	114.2
597	P	39.5	Very low	32	Very low	136 Å²	136	116.6 Å²	116.6	88%	0.883	73%	0.733	S	S	*	*			trans	-86.7	148.6	-156.3	33.3	-36.9	0	0	0	115.2
598	G	24.4	Very low	34.1	Very low	64 Å²	64	111.7 Å²	111.7	66%	0.66	70%	0.698	S	S	*	*			trans	179.5	133.7	167.1	0	0	0	0	0	114.6
599	S	24.8	Very low	37.2	Very low	106 Å²	106	104.4 Å²	104.4	74%	0.741	66%	0.659	S	S	*	*			trans	73.1	149.3	168.5	79.9	0	0	0	0	119.6
600	N	29.7	Very low	40	Very low	131 Å²	131	97.4 Å²	97.4	70%	0.701	62%	0.616	S	S	*	*			trans	69	69.5	152.3	-58.7	-9.3	0	0	0	119.7	T602	N600-T602 HydrophobicContact CB-CG2 4.27Å; N600-T602 PolarHBondContact O-N 2.94Å
601	H	24.8	Very low	43.3	Very low	197 Å²	197	89.9 Å²	89.9	91%	0.912	58%	0.575	S	S	*	*			trans	-68.2	72.2	140.9	-82.2	-64.8	0	0	0	110.4	T603	H601-T603 VanDerWaalsContact C-N 3.32Å; H601-T603 PolarHBondContact O-N 2.93Å
602	T	25.2	Very low	46.4	Very low	113 Å²	113	83.9 Å²	83.9	69%	0.693	53%	0.534	S	S	*	.			trans	-74.9	89	164.2	46	0	0	0	0	108.7	N600 S604	N600-T602 HydrophobicContact CB-CG2 4.27Å; N600-T602 PolarHBondContact O-N 2.94Å; T602-S604 PolarHBondContact O-N 3.34Å
603	T	28.6	Very low	49.7	Very low	126 Å²	126	78 Å²	78	77%	0.773	50%	0.498	S	S	*	.			trans	-59.2	105.4	164.8	48.9	0	0	0	0	108.1	H601 I605	H601-T603 VanDerWaalsContact C-N 3.32Å; H601-T603 PolarHBondContact O-N 2.93Å; T603-I605 PolarHBondContact O-N 3.4Å; T603-I605 VanDerWaalsContact O-N 3.14Å
604	S	32.9	Very low	53	Low	87 Å²	87	71.4 Å²	71.4	61%	0.608	46%	0.457	S	S	*	.			trans	-61.7	115.6	-178.4	37.4	0	0	0	0	109.8	T602	T602-S604 PolarHBondContact O-N 3.34Å
605	I	41.8	Very low	56.1	Low	101 Å²	101	68.7 Å²	68.7	52%	0.518	43%	0.432	S	S	.	.			trans	-63.8	127.2	173.4	-55	173.7	0	0	0	106.6	T603 A607	T603-I605 PolarHBondContact O-N 3.4Å; T603-I605 VanDerWaalsContact O-N 3.14Å; I605-A607 PolarHBondContact O-N 2.86Å
606	P	51.4	Low	59.1	Low	72 Å²	72	65.7 Å²	65.7	47%	0.468	40%	0.401	S	S	.	.			trans	-57.7	135.9	175.6	21	-29	0	0	0	109.6	H608	P606-H608 PolarHBondContact O-CD2 2.89Å; P606-H608 PolarHBondContact O-N 2.86Å; P606-H608 PolarHBondContact O-NE2 3.41Å
607	A	57.1	Low	62.3	Low	19 Å²	19	60.7 Å²	60.7	16%	0.157	37%	0.366	C	S	.	.			trans	-74.3	98.4	-175.6	0	0	0	0	0	109.8	C565 A574 I605 F609	C565-A607 PolarHBondContact N-O 3.26Å; A574-A607 HydrophobicContact CB-CB 4.49Å; I605-A607 PolarHBondContact O-N 2.86Å; A607-F609 HydrophobicContact CB-CE2 3.99Å; A607-F609 WeakPolarHBondContact O-CD2 3.23Å
608	H	78	Confident	64.9	Low	16 Å²	16	54.2 Å²	54.2	7%	0.074	32%	0.324	C	S	.	.			trans	-80.6	134.2	179.9	-50.9	-84.8	0	0	0	111.7	P606 L623 D961 F964	P606-H608 PolarHBondContact O-CD2 2.89Å; P606-H608 PolarHBondContact O-N 2.86Å; P606-H608 PolarHBondContact O-NE2 3.41Å; H608-L623 HydrophobicContact CB-CB 4.27Å; H608-L623 HydrophobicContact CB-CD1 3.93Å; H608-L623 HydrophobicContact CB-CG 4.45Å; H608-L623 VanDerWaalsContact O-CB 3.31Å; H608-L623 WeakPolarHBondContact O-CB 3.46Å; H608-L623 WeakPolarHBondContact O-CG 3.34Å; H608-L623 PolarHBondContact O-N 3.48Å; H608-D961 IonicContact CE1-OD1 2.9Å; H608-D961 PolarHBondContact CE1-OD1 3.4Å; H608-D961 IonicContact CE1-OD2 3.97Å; H608-D961 PolarHBondContact CE1-OD2 3.01Å; H608-D961 IonicContact NE2-OD1 3.2Å; H608-D961 IonicContact NE2-OD2 3.44Å; H608-F964 AromaticContact CD2-CD2 3.44Å; H608-F964 VanDerWaalsContact CD2-CD2 3.44Å; H608-F964 WeakPolarHBondContact CD2-CD2 3.42Å; H608-F964 AromaticContact CD2-CE2 3.29Å; H608-F964 WeakPolarHBondContact CD2-CE2 3.4Å; H608-F964 AromaticContact CE1-CD2 3.89Å; H608-F964 AromaticContact CG-CD2 3.94Å; H608-F964 AromaticContact NE2-CD2 3.42Å; H608-F964 WeakPolarHBondContact NE2-CD2 3.37Å; H608-F964 AromaticContact NE2-CE2 3.32Å; H608-F964 VanDerWaalsContact NE2-CE2 3.32Å; H608-F964 WeakPolarHBondContact NE2-CE2 3.38Å
609	F	91.1	Very high	68.3	Low	1 Å²	1	52.8 Å²	52.8	0%	0.004	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143	174	-73.5	-107.2	0	0	0	109.3	L562 G563 C565 A607 Y611 L620 W621 D622 L643	L562-F609 WeakPolarHBondContact CA-O 3.45Å; G563-F609 PolarHBondContact N-O 3.22Å; G563-F609 PolarHBondContact O-N 2.93Å; C565-F609 VanDerWaalsContact CA-CD2 3.43Å; C565-F609 HydrophobicContact CB-CD2 3.88Å; C565-F609 HydrophobicContact CB-CE2 3.43Å; C565-F609 VanDerWaalsContact CB-CE2 3.43Å; C565-F609 HydrophobicContact CB-CZ 4.07Å; C565-F609 WeakPolarHBondContact SG-CE2 3.43Å; C565-F609 WeakPolarHBondContact SG-CZ 3.47Å; A607-F609 HydrophobicContact CB-CE2 3.99Å; A607-F609 WeakPolarHBondContact O-CD2 3.23Å; F609-Y611 HydrophobicContact CB-CE2 4.27Å; F609-L620 HydrophobicContact CB-CD1 3.98Å; F609-L620 HydrophobicContact CD1-CD1 3.76Å; F609-L620 HydrophobicContact CD1-CG 4.35Å; F609-L620 HydrophobicContact CG-CD1 4.33Å; F609-W621 CarbonylContact C-O 3.59Å; F609-W621 WeakPolarHBondContact CA-O 3.47Å; F609-W621 WeakPolarHBondContact CD1-O 3.4Å; F609-D622 HydrophobicContact CD1-CB 4.12Å; F609-D622 HydrophobicContact CE1-CB 3.58Å; F609-D622 HydrophobicContact CZ-CB 3.88Å; F609-L643 HydrophobicContact CD1-CD1 4.46Å; F609-L643 HydrophobicContact CE1-CD1 3.8Å
610	A	93.7	Very high	71.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	143.3	170.4	0	0	0	0	0	110.9	L551 L562 L620 W621 L623	L551-A610 HydrophobicContact CD1-CB 4.45Å; L562-A610 HydrophobicContact CD2-CB 3.95Å; A610-L620 WeakPolarHBondContact O-CA 3.33Å; A610-W621 HydrophobicContact CB-CB 4.4Å; A610-W621 PolarHBondContact N-O 2.69Å; A610-W621 PolarHBondContact O-N 2.9Å; A610-L623 HydrophobicContact CB-CD1 4.14Å; A610-L623 HydrophobicContact CB-CD2 3.84Å; A610-L623 HydrophobicContact CB-CG 4.31Å
611	Y	95.2	Very high	74.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	121.3	168.3	-62.6	-100.4	0	0	0	107.1	V560 T561 P566 F609 V618 K619 L620 F646 L660 L667 L681	V560-Y611 CarbonylContact C-O 3.55Å; V560-Y611 WeakPolarHBondContact CA-O 3.38Å; T561-Y611 PolarHBondContact N-O 2.83Å; T561-Y611 PolarHBondContact O-N 2.86Å; P566-Y611 WeakPolarHBondContact CG-OH 3.44Å; F609-Y611 HydrophobicContact CB-CE2 4.27Å; Y611-V618 HydrophobicContact CD1-CG1 4.37Å; Y611-K619 CarbonylContact C-O 3.33Å; Y611-K619 WeakPolarHBondContact CA-O 3.42Å; Y611-L620 HydrophobicContact CD1-CD1 4.09Å; Y611-L620 HydrophobicContact CD2-CD1 4.31Å; Y611-L620 HydrophobicContact CE1-CD1 3.61Å; Y611-L620 HydrophobicContact CE1-CD2 4.49Å; Y611-L620 HydrophobicContact CE1-CG 4.42Å; Y611-L620 HydrophobicContact CE2-CD1 3.82Å; Y611-L620 HydrophobicContact CG-CD1 4.42Å; Y611-L620 VanDerWaalsContact CZ-CD1 3.45Å; Y611-F646 HydrophobicContact CD1-CE2 4.33Å; Y611-F646 HydrophobicContact CE1-CE2 4.28Å; Y611-L660 HydrophobicContact CD2-CD1 4.09Å; Y611-L660 HydrophobicContact CD2-CD2 4.07Å; Y611-L660 HydrophobicContact CD2-CG 4.39Å; Y611-L660 HydrophobicContact CE1-CD2 4.17Å; Y611-L660 HydrophobicContact CE2-CD1 3.84Å; Y611-L660 HydrophobicContact CE2-CD2 3.71Å; Y611-L660 HydrophobicContact CE2-CG 4.29Å; Y611-L660 HydrophobicContact CG-CD2 4.49Å; Y611-L667 HydrophobicContact CD1-CD2 3.44Å; Y611-L667 VanDerWaalsContact CD1-CD2 3.44Å; Y611-L667 HydrophobicContact CE1-CD2 3.61Å; Y611-L667 HydrophobicContact CG-CD2 4.43Å; Y611-L681 HydrophobicContact CE1-CD1 4.09Å; Y611-L681 HydrophobicContact CE1-CD2 4.04Å
612	T	97.3	Very high	77.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.2	-177.7	64.6	0	0	0	0	109.9	L551 H553 V560 V618 K619 W621 A974	L551-T612 HydrophobicContact CD1-CG2 4.45Å; H553-T612 PolarHBondContact CD2-O 2.99Å; H553-T612 VanDerWaalsContact CD2-O 3.29Å; H553-T612 PolarHBondContact CD2-OG1 3.34Å; H553-T612 PolarHBondContact NE2-O 3.11Å; V560-T612 HydrophobicContact CG1-CG2 4.18Å; T612-V618 CarbonylContact O-C 3.51Å; T612-V618 WeakPolarHBondContact O-CA 3.36Å; T612-K619 PolarHBondContact N-O 3.36Å; T612-K619 PolarHBondContact O-N 3.38Å; T612-W621 PolarHBondContact OG1-NE1 2.68Å; T612-A974 HydrophobicContact CG2-CB 3.64Å
613	G	96.5	Very high	80.5	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133	179.4	0	0	0	0	0	112.1	V557 C558 A559	V557-G613 CarbonylContact C-O 3.5Å; V557-G613 WeakPolarHBondContact CA-O 3.45Å; C558-G613 PolarHBondContact N-O 2.82Å; A559-G613 PolarHBondContact N-O 2.86Å; A559-G613 PolarHBondContact O-N 3.35Å
614	A	95.7	Very high	82.8	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.135	C	C	.	.			trans	-135.6	-147.8	172.5	0	0	0	0	0	108.9	H553 D555 V556 G616 S617 V655	H553-A614 HydrophobicContact CB-CB 4.47Å; H553-A614 VanDerWaalsContact CD2-CB 3.48Å; H553-A614 WeakPolarHBondContact CD2-CB 3.38Å; H553-A614 WeakPolarHBondContact NE2-CB 3.39Å; H553-A614 PolarHBondContact NE2-N 3.48Å; D555-A614 HydrophobicContact CB-CB 4.15Å; V556-A614 WeakPolarHBondContact O-CA 3.35Å; V556-A614 VanDerWaalsContact O-CB 3.25Å; V556-A614 WeakPolarHBondContact O-CB 3.49Å; A614-G616 PolarHBondContact O-N 2.83Å; A614-S617 PolarHBondContact N-O 2.87Å; A614-V655 WeakPolarHBondContact O-CB 3.42Å; A614-V655 WeakPolarHBondContact O-CG2 3.26Å; A614-V655 PolarHBondContact O-N 3.47Å
615	R	94.1	Very high	85	Confident	82 Å²	82	20.6 Å²	20.6	31%	0.309	12%	0.118	S	C	.	.	B	Isolated β-bridge	trans	-63.3	123	175.9	-165.2	-176.7	175.5	126.8	7.5	111.3	D555 S617 Y651 Y654	D555-R615 HydrophobicContact CB-CB 3.86Å; D555-R615 VanDerWaalsContact OD2-CD 3.32Å; D555-R615 WeakPolarHBondContact OD2-CD 3.44Å; R615-S617 PolarHBondContact O-N 2.87Å; R615-S617 PolarHBondContact O-OG 3.01Å; R615-Y651 WeakPolarHBondContact CD-O 3.5Å; R615-Y651 VanDerWaalsContact CG-O 3.29Å; R615-Y651 WeakPolarHBondContact CG-O 2.89Å; R615-Y651 PolarHBondContact NE-O 2.91Å; R615-Y654 HydrophobicContact CB-CD1 4.06Å; R615-Y654 HydrophobicContact CB-CE1 3.79Å; R615-Y654 HydrophobicContact CG-CE1 4.48Å
616	G	91.6	Very high	86.9	Confident	6 Å²	6	16.6 Å²	16.6	6%	0.062	10%	0.097	C	C	.	.	S	Bend	trans	62.1	-17.7	178.9	0	0	0	0	0	117.4	A614 C648 L649 C650 S653	A614-G616 PolarHBondContact O-N 2.83Å; G616-C648 PolarHBondContact O-N 3.1Å; G616-C648 PolarHBondContact O-SG 2.77Å; G616-L649 PolarHBondContact O-N 3.13Å; G616-C650 VanDerWaalsContact CA-O 3.29Å; G616-C650 WeakPolarHBondContact CA-O 3.33Å; G616-S653 PolarHBondContact N-O 2.86Å
617	S	94.5	Very high	88	Confident	18 Å²	18	14.6 Å²	14.6	13%	0.126	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	144.8	-157.3	59.2	0	0	0	0	114.9	H553 A614 R615 F646	H553-S617 PolarHBondContact CE1-OG 2.75Å; H553-S617 PolarHBondContact NE2-O 2.84Å; A614-S617 PolarHBondContact N-O 2.87Å; R615-S617 PolarHBondContact O-N 2.87Å; R615-S617 PolarHBondContact O-OG 3.01Å; S617-F646 VanDerWaalsContact CA-O 3.3Å; S617-F646 WeakPolarHBondContact CA-O 3.06Å
618	V	95.6	Very high	88.5	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.4	170.2	174.5	0	0	0	0	109.5	Y611 T612 T645 F646 V655 I658 V669	Y611-V618 HydrophobicContact CD1-CG1 4.37Å; T612-V618 CarbonylContact O-C 3.51Å; T612-V618 WeakPolarHBondContact O-CA 3.36Å; V618-T645 CarbonylContact O-C 3.48Å; V618-T645 WeakPolarHBondContact O-CA 3.45Å; V618-F646 HydrophobicContact CB-CD2 4.12Å; V618-F646 HydrophobicContact CG1-CD2 4.04Å; V618-F646 PolarHBondContact N-O 3.39Å; V618-F646 PolarHBondContact O-N 2.96Å; V618-V655 HydrophobicContact CG2-CG1 4.17Å; V618-V655 HydrophobicContact CG2-CG2 4.19Å; V618-I658 HydrophobicContact CB-CD1 4.48Å; V618-I658 HydrophobicContact CG1-CD1 3.89Å; V618-I658 HydrophobicContact CG2-CD1 3.72Å; V618-I658 HydrophobicContact CG2-CG1 4.04Å; V618-V669 HydrophobicContact CG2-CG1 4.23Å; V618-V669 HydrophobicContact CG2-CG2 4.16Å
619	K	94.7	Very high	87.5	Confident	33 Å²	33	21.1 Å²	21.1	14%	0.143	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.9	175.8	-74.8	176.5	179.5	169.2	0	111.7	H553 Y611 T612 W621 P642 A644 T645	H553-K619 WeakPolarHBondContact ND1-CD 3.17Å; H553-K619 WeakPolarHBondContact ND1-CE 3.19Å; H553-K619 PolarHBondContact ND1-NZ 3.23Å; H553-K619 PolarHBondContact O-NZ 3.19Å; Y611-K619 CarbonylContact C-O 3.33Å; Y611-K619 WeakPolarHBondContact CA-O 3.42Å; T612-K619 PolarHBondContact N-O 3.36Å; T612-K619 PolarHBondContact O-N 3.38Å; K619-W621 HydrophobicContact CB-CZ2 3.89Å; K619-W621 HydrophobicContact CD-CH2 4.35Å; K619-W621 HydrophobicContact CD-CZ2 3.83Å; K619-W621 HydrophobicContact CG-CZ2 4.5Å; K619-W621 PolarHBondContact O-NE1 2.66Å; K619-P642 HydrophobicContact CB-CB 4.01Å; K619-P642 HydrophobicContact CD-CB 4.22Å; K619-P642 HydrophobicContact CD-CG 4.04Å; K619-P642 HydrophobicContact CG-CB 4.17Å; K619-P642 HydrophobicContact CG-CG 4.32Å; K619-A644 WeakPolarHBondContact CA-O 3.38Å; K619-T645 HydrophobicContact CG-CG2 4.09Å
620	L	93.3	Very high	85.8	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.1	177.9	175.7	57.4	0	0	0	111	P566 F609 A610 Y611 P642 L643 A644 F646	P566-L620 HydrophobicContact CG-CD2 4Å; F609-L620 HydrophobicContact CB-CD1 3.98Å; F609-L620 HydrophobicContact CD1-CD1 3.76Å; F609-L620 HydrophobicContact CD1-CG 4.35Å; F609-L620 HydrophobicContact CG-CD1 4.33Å; A610-L620 WeakPolarHBondContact O-CA 3.33Å; Y611-L620 HydrophobicContact CD1-CD1 4.09Å; Y611-L620 HydrophobicContact CD2-CD1 4.31Å; Y611-L620 HydrophobicContact CE1-CD1 3.61Å; Y611-L620 HydrophobicContact CE1-CD2 4.49Å; Y611-L620 HydrophobicContact CE1-CG 4.42Å; Y611-L620 HydrophobicContact CE2-CD1 3.82Å; Y611-L620 HydrophobicContact CG-CD1 4.42Å; Y611-L620 VanDerWaalsContact CZ-CD1 3.45Å; L620-P642 CarbonylContact O-C 3.57Å; L620-P642 WeakPolarHBondContact O-CA 3.32Å; L620-P642 WeakPolarHBondContact O-CB 3.26Å; L620-L643 HydrophobicContact CG-CB 4.39Å; L620-L643 PolarHBondContact O-N 3.11Å; L620-A644 HydrophobicContact CB-CB 4.24Å; L620-A644 PolarHBondContact N-O 3.37Å; L620-F646 HydrophobicContact CB-CE2 4.07Å; L620-F646 HydrophobicContact CB-CZ 4.19Å; L620-F646 HydrophobicContact CD2-CZ 4.24Å
621	W	92.1	Very high	83.8	Confident	1 Å²	1	26.8 Å²	26.8	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	136.7	-178.5	-43.8	85.6	0	0	0	110.8	L551 P552 F609 A610 T612 K619 L623 I626 I640 P642	L551-W621 HydrophobicContact CB-CD2 4.08Å; L551-W621 HydrophobicContact CB-CE3 4.23Å; L551-W621 HydrophobicContact CB-CH2 4.08Å; L551-W621 HydrophobicContact CB-CZ2 3.92Å; L551-W621 HydrophobicContact CB-CZ3 4.24Å; L551-W621 HydrophobicContact CD1-CB 4.28Å; L551-W621 HydrophobicContact CD1-CD2 4.07Å; L551-W621 HydrophobicContact CD1-CG 3.85Å; L551-W621 HydrophobicContact CD2-CD2 4.36Å; L551-W621 HydrophobicContact CD2-CE3 4.2Å; L551-W621 HydrophobicContact CG-CD2 4.4Å; P552-W621 HydrophobicContact CG-CH2 4.36Å; P552-W621 WeakPolarHBondContact O-CH2 3.27Å; F609-W621 CarbonylContact C-O 3.59Å; F609-W621 WeakPolarHBondContact CA-O 3.47Å; F609-W621 WeakPolarHBondContact CD1-O 3.4Å; A610-W621 HydrophobicContact CB-CB 4.4Å; A610-W621 PolarHBondContact N-O 2.69Å; A610-W621 PolarHBondContact O-N 2.9Å; T612-W621 PolarHBondContact OG1-NE1 2.68Å; K619-W621 HydrophobicContact CB-CZ2 3.89Å; K619-W621 HydrophobicContact CD-CH2 4.35Å; K619-W621 HydrophobicContact CD-CZ2 3.83Å; K619-W621 HydrophobicContact CG-CZ2 4.5Å; K619-W621 PolarHBondContact O-NE1 2.66Å; W621-L623 HydrophobicContact CB-CD2 4.21Å; W621-I626 HydrophobicContact CB-CD1 4.23Å; W621-I640 HydrophobicContact CE3-CG2 4.1Å; W621-I640 HydrophobicContact CZ3-CG2 3.99Å; W621-P642 HydrophobicContact CD2-CB 4.15Å; W621-P642 HydrophobicContact CE3-CB 3.99Å; W621-P642 HydrophobicContact CH2-CB 3.99Å; W621-P642 HydrophobicContact CH2-CG 4.3Å; W621-P642 HydrophobicContact CZ2-CB 4.14Å; W621-P642 HydrophobicContact CZ3-CB 3.91Å; W621-P642 HydrophobicContact CZ3-CG 4.39Å
622	D	89.3	Confident	81.6	Confident	8 Å²	8	34.7 Å²	34.7	4%	0.043	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	109.5	170.8	174.4	-28.3	0	0	0	109	F609 A624 S625 I626 L643	F609-D622 HydrophobicContact CD1-CB 4.12Å; F609-D622 HydrophobicContact CE1-CB 3.58Å; F609-D622 HydrophobicContact CZ-CB 3.88Å; D622-A624 WeakPolarHBondContact OD1-CA 3.25Å; D622-A624 WeakPolarHBondContact OD1-CB 3.49Å; D622-A624 PolarHBondContact OD1-N 3Å; D622-S625 PolarHBondContact O-OG 2.93Å; D622-S625 PolarHBondContact OD1-N 3.46Å; D622-I626 WeakPolarHBondContact O-CD1 3.41Å; D622-I626 WeakPolarHBondContact O-CG1 3.47Å; D622-I626 PolarHBondContact O-N 3.22Å; D622-L643 HydrophobicContact CB-CD1 3.52Å; D622-L643 HydrophobicContact CB-CG 4.29Å
623	L	85.4	Confident	79.4	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-78.6	-24.2	-172.9	-50.1	-179.8	0	0	0	112.2	L551 L562 H608 A610 W621 I626 S627 L976	L551-L623 HydrophobicContact CD1-CD2 4.42Å; L562-L623 HydrophobicContact CD2-CD1 3.51Å; H608-L623 HydrophobicContact CB-CB 4.27Å; H608-L623 HydrophobicContact CB-CD1 3.93Å; H608-L623 HydrophobicContact CB-CG 4.45Å; H608-L623 VanDerWaalsContact O-CB 3.31Å; H608-L623 WeakPolarHBondContact O-CB 3.46Å; H608-L623 WeakPolarHBondContact O-CG 3.34Å; H608-L623 PolarHBondContact O-N 3.48Å; A610-L623 HydrophobicContact CB-CD1 4.14Å; A610-L623 HydrophobicContact CB-CD2 3.84Å; A610-L623 HydrophobicContact CB-CG 4.31Å; W621-L623 HydrophobicContact CB-CD2 4.21Å; L623-I626 HydrophobicContact CD2-CD1 4.49Å; L623-I626 PolarHBondContact O-N 3.34Å; L623-S627 WeakPolarHBondContact O-CB 3.21Å; L623-S627 PolarHBondContact O-N 3.16Å; L623-L976 HydrophobicContact CB-CD2 4.34Å; L623-L976 HydrophobicContact CD1-CD1 3.85Å; L623-L976 HydrophobicContact CD2-CD1 4.25Å; L623-L976 HydrophobicContact CD2-CD2 4.06Å
624	A	78.1	Confident	77.3	Confident	36 Å²	36	43.2 Å²	43.2	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-66.4	-44.1	173.7	0	0	0	0	0	110.4	D622 I626 S627 A628	D622-A624 WeakPolarHBondContact OD1-CA 3.25Å; D622-A624 WeakPolarHBondContact OD1-CB 3.49Å; D622-A624 PolarHBondContact OD1-N 3Å; A624-I626 VanDerWaalsContact C-N 3.32Å; A624-I626 PolarHBondContact O-N 3.33Å; A624-S627 PolarHBondContact O-N 2.94Å; A624-A628 WeakPolarHBondContact O-CB 3.35Å; A624-A628 PolarHBondContact O-N 2.94Å
625	S	79.1	Confident	75.3	Confident	37 Å²	37	47.2 Å²	47.2	26%	0.259	30%	0.295	S	S	.	.	H	α-helix	trans	-62.5	-37	175.6	79	0	0	0	0	112.8	D622 N629	D622-S625 PolarHBondContact O-OG 2.93Å; D622-S625 PolarHBondContact OD1-N 3.46Å; S625-N629 PolarHBondContact O-ND2 3.21Å
626	I	81	Confident	73.2	Confident	17 Å²	17	48.1 Å²	48.1	9%	0.087	32%	0.32	C	S	.	.	H	α-helix	trans	-75	-43.5	179.7	-66.8	166.8	0	0	0	110.7	A549 L551 W621 D622 L623 A624 I640	A549-I626 HydrophobicContact CB-CG2 3.51Å; L551-I626 HydrophobicContact CD2-CD1 3.74Å; W621-I626 HydrophobicContact CB-CD1 4.23Å; D622-I626 WeakPolarHBondContact O-CD1 3.41Å; D622-I626 WeakPolarHBondContact O-CG1 3.47Å; D622-I626 PolarHBondContact O-N 3.22Å; L623-I626 HydrophobicContact CD2-CD1 4.49Å; L623-I626 PolarHBondContact O-N 3.34Å; A624-I626 VanDerWaalsContact C-N 3.32Å; A624-I626 PolarHBondContact O-N 3.33Å; I626-I640 HydrophobicContact CD1-CG2 3.8Å; I626-I640 HydrophobicContact CG1-CG2 4.15Å; I626-I640 HydrophobicContact CG2-CD1 4.36Å
627	S	74.5	Confident	71.1	Confident	31 Å²	31	54.8 Å²	54.8	22%	0.217	35%	0.354	C	S	.	.	H	α-helix	trans	-73.9	-37.3	-178.9	-168.7	0	0	0	0	113.1	L623 A624 N629 S630	L623-S627 WeakPolarHBondContact O-CB 3.21Å; L623-S627 PolarHBondContact O-N 3.16Å; A624-S627 PolarHBondContact O-N 2.94Å; S627-N629 VanDerWaalsContact C-N 3.25Å; S627-N629 PolarHBondContact O-N 3.24Å; S627-S630 WeakPolarHBondContact O-CB 3.34Å; S627-S630 PolarHBondContact O-N 3.1Å
628	A	68.2	Low	69.7	Low	65 Å²	65	56.1 Å²	56.1	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-62.4	-34.4	178.6	0	0	0	0	0	112.1	L573 A624 S630	L573-A628 HydrophobicContact CD2-CB 4.31Å; A624-A628 WeakPolarHBondContact O-CB 3.35Å; A624-A628 PolarHBondContact O-N 2.94Å; A628-S630 PolarHBondContact O-N 2.66Å; A628-S630 VanDerWaalsContact O-N 3.17Å
629	N	55.8	Low	68.4	Low	107 Å²	107	63.8 Å²	63.8	57%	0.572	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-70.8	-2.3	174.8	-78.6	-58.8	0	0	0	114.1	S625 S627 G631 R638	S625-N629 PolarHBondContact O-ND2 3.21Å; S627-N629 VanDerWaalsContact C-N 3.25Å; S627-N629 PolarHBondContact O-N 3.24Å; N629-G631 VanDerWaalsContact C-N 3.28Å; N629-G631 PolarHBondContact O-N 2.84Å; N629-R638 PolarHBondContact O-NH2 2.71Å; N629-R638 VanDerWaalsContact O-NH2 3.16Å
630	S	56.6	Low	67.9	Low	49 Å²	49	63.5 Å²	63.5	34%	0.343	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-57	-35.5	-175.8	-168.4	0	0	0	0	114.2	S627 A628 N632 R638	S627-S630 WeakPolarHBondContact O-CB 3.34Å; S627-S630 PolarHBondContact O-N 3.1Å; A628-S630 PolarHBondContact O-N 2.66Å; A628-S630 VanDerWaalsContact O-N 3.17Å; S630-N632 PolarHBondContact O-N 3.03Å; S630-R638 PolarHBondContact O-NH2 2.79Å; S630-R638 VanDerWaalsContact O-NH2 3.13Å
631	G	51.8	Low	67.6	Low	71 Å²	71	68.6 Å²	68.6	73%	0.732	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-69.3	-29.9	-162	0	0	0	0	0	117.6	N629	N629-G631 VanDerWaalsContact C-N 3.28Å; N629-G631 PolarHBondContact O-N 2.84Å
632	N	49.6	Very low	67.6	Low	166 Å²	166	70.5 Å²	70.5	89%	0.888	44%	0.441	S	S	*	.	S	Bend	trans	-126.8	5.2	-162	-91.4	-9	0	0	0	116.6	S630	S630-N632 PolarHBondContact O-N 3.03Å
633	T	49.6	Very low	67.5	Low	76 Å²	76	74.2 Å²	74.2	47%	0.466	46%	0.461	S	S	.	.	S	Bend	trans	-140.2	143.6	176.3	50.6	0	0	0	0	111.8	L635 R638	T633-L635 PolarHBondContact O-N 3.46Å; T633-R638 PolarHBondContact O-NH2 2.84Å; T633-R638 PolarHBondContact OG1-NE 2.79Å; T633-R638 PolarHBondContact OG1-NH2 3.16Å
634	P	52.7	Low	67.7	Low	103 Å²	103	74.9 Å²	74.9	67%	0.669	47%	0.466	S	S	*	.			trans	-65.1	132.3	178.4	26.7	-33.9	0	0	0	111.5	A636 N637	P634-A636 PolarHBondContact O-N 2.83Å; P634-N637 PolarHBondContact O-N 3.17Å
635	L	53.7	Low	68.4	Low	83 Å²	83	76.2 Å²	76.2	44%	0.435	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-53.3	-31.7	-171.8	-71.3	166	0	0	0	114.8	L548 T633 N637	L548-L635 WeakPolarHBondContact O-CD2 3.5Å; T633-L635 PolarHBondContact O-N 3.46Å; L635-N637 PolarHBondContact O-N 3.46Å
636	A	50.2	Low	69	Low	101 Å²	101	74.7 Å²	74.7	84%	0.835	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-69.1	-10.3	-173.8	0	0	0	0	0	115.2	P634	P634-A636 PolarHBondContact O-N 2.83Å
637	N	47	Very low	69.5	Low	146 Å²	146	79.9 Å²	79.9	78%	0.781	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-134.9	34	-164.9	-143.3	71.3	0	0	0	113.8	P634 L635	P634-N637 PolarHBondContact O-N 3.17Å; L635-N637 PolarHBondContact O-N 3.46Å
638	R	64.8	Low	70.2	Confident	47 Å²	47	78.6 Å²	78.6	18%	0.177	48%	0.478	C	S	.	.			trans	-104.8	130.8	173.1	-62.3	-173.7	-168.7	145.9	16	110.9	N629 S630 T633 I640	N629-R638 PolarHBondContact O-NH2 2.71Å; N629-R638 VanDerWaalsContact O-NH2 3.16Å; S630-R638 PolarHBondContact O-NH2 2.79Å; S630-R638 VanDerWaalsContact O-NH2 3.13Å; T633-R638 PolarHBondContact O-NH2 2.84Å; T633-R638 PolarHBondContact OG1-NE 2.79Å; T633-R638 PolarHBondContact OG1-NH2 3.16Å; R638-I640 VanDerWaalsContact C-N 3.27Å; R638-I640 HydrophobicContact CB-CG1 4.02Å; R638-I640 PolarHBondContact O-N 3.31Å
639	D	68.6	Low	71.2	Confident	161 Å²	161	76.8 Å²	76.8	86%	0.861	46%	0.46	S	S	*	.			trans	-75.7	77	171.2	-68.2	-41.8	0	0	0	110.8	T641	D639-T641 PolarHBondContact O-N 2.91Å
640	I	84.9	Confident	72.6	Confident	27 Å²	27	75.4 Å²	75.4	14%	0.138	46%	0.458	C	S	.	.			trans	-75.4	106.1	178	-57.1	175.2	0	0	0	108.8	A549 L551 P552 W621 I626 R638	A549-I640 HydrophobicContact CB-CD1 3.89Å; L551-I640 HydrophobicContact CD2-CG2 3.92Å; P552-I640 WeakPolarHBondContact CG-O 3.31Å; W621-I640 HydrophobicContact CE3-CG2 4.1Å; W621-I640 HydrophobicContact CZ3-CG2 3.99Å; I626-I640 HydrophobicContact CD1-CG2 3.8Å; I626-I640 HydrophobicContact CG1-CG2 4.15Å; I626-I640 HydrophobicContact CG2-CD1 4.36Å; R638-I640 VanDerWaalsContact C-N 3.27Å; R638-I640 HydrophobicContact CB-CG1 4.02Å; R638-I640 PolarHBondContact O-N 3.31Å
641	T	87.6	Confident	73.8	Confident	106 Å²	106	82 Å²	82	65%	0.65	48%	0.477	S	S	*	.			trans	-105.5	147.5	179.9	51.4	0	0	0	0	111.7	D639	D639-T641 PolarHBondContact O-N 2.91Å
642	P	90.6	Very high	75.4	Confident	42 Å²	42	83.8 Å²	83.8	27%	0.273	47%	0.469	S	S	.	.			trans	-76.2	146.6	175.1	32.7	-36.1	0	0	0	111.2	K619 L620 W621 A644	K619-P642 HydrophobicContact CB-CB 4.01Å; K619-P642 HydrophobicContact CD-CB 4.22Å; K619-P642 HydrophobicContact CD-CG 4.04Å; K619-P642 HydrophobicContact CG-CB 4.17Å; K619-P642 HydrophobicContact CG-CG 4.32Å; L620-P642 CarbonylContact O-C 3.57Å; L620-P642 WeakPolarHBondContact O-CA 3.32Å; L620-P642 WeakPolarHBondContact O-CB 3.26Å; W621-P642 HydrophobicContact CD2-CB 4.15Å; W621-P642 HydrophobicContact CE3-CB 3.99Å; W621-P642 HydrophobicContact CH2-CB 3.99Å; W621-P642 HydrophobicContact CH2-CG 4.3Å; W621-P642 HydrophobicContact CZ2-CB 4.14Å; W621-P642 HydrophobicContact CZ3-CB 3.91Å; W621-P642 HydrophobicContact CZ3-CG 4.39Å; P642-A644 VanDerWaalsContact C-N 3.29Å; P642-A644 PolarHBondContact O-N 3.42Å
643	L	88.4	Confident	77.4	Confident	86 Å²	86	76.4 Å²	76.4	45%	0.45	43%	0.431	S	S	.	.	S	Bend	trans	-73.8	-18.7	174.5	-67.4	-172.2	0	0	0	113.8	R569 F609 L620 D622	R569-L643 PolarHBondContact NH1-O 2.76Å; F609-L643 HydrophobicContact CD1-CD1 4.46Å; F609-L643 HydrophobicContact CE1-CD1 3.8Å; L620-L643 HydrophobicContact CG-CB 4.39Å; L620-L643 PolarHBondContact O-N 3.11Å; D622-L643 HydrophobicContact CB-CD1 3.52Å; D622-L643 HydrophobicContact CB-CG 4.29Å
644	A	89.2	Confident	79.5	Confident	15 Å²	15	74.1 Å²	74.1	12%	0.124	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	155	170.6	0	0	0	0	0	110.2	K619 L620 P642 F646	K619-A644 WeakPolarHBondContact CA-O 3.38Å; L620-A644 HydrophobicContact CB-CB 4.24Å; L620-A644 PolarHBondContact N-O 3.37Å; P642-A644 VanDerWaalsContact C-N 3.29Å; P642-A644 PolarHBondContact O-N 3.42Å; A644-F646 HydrophobicContact CB-CD1 4.4Å; A644-F646 HydrophobicContact CB-CE1 3.65Å; A644-F646 HydrophobicContact CB-CZ 3.74Å
645	T	92.2	Very high	81.6	Confident	65 Å²	65	69.2 Å²	69.2	40%	0.399	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.5	162	-52.3	0	0	0	0	107.1	V618 K619	V618-T645 CarbonylContact O-C 3.48Å; V618-T645 WeakPolarHBondContact O-CA 3.45Å; K619-T645 HydrophobicContact CG-CG2 4.09Å
646	F	91.1	Very high	83.6	Confident	4 Å²	4	67 Å²	67	2%	0.018	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	112.7	175.1	-44.3	-62.9	0	0	0	107.8	Y611 S617 V618 L620 A644 C648 L667 W679 L681	Y611-F646 HydrophobicContact CD1-CE2 4.33Å; Y611-F646 HydrophobicContact CE1-CE2 4.28Å; S617-F646 VanDerWaalsContact CA-O 3.3Å; S617-F646 WeakPolarHBondContact CA-O 3.06Å; V618-F646 HydrophobicContact CB-CD2 4.12Å; V618-F646 HydrophobicContact CG1-CD2 4.04Å; V618-F646 PolarHBondContact N-O 3.39Å; V618-F646 PolarHBondContact O-N 2.96Å; L620-F646 HydrophobicContact CB-CE2 4.07Å; L620-F646 HydrophobicContact CB-CZ 4.19Å; L620-F646 HydrophobicContact CD2-CZ 4.24Å; A644-F646 HydrophobicContact CB-CD1 4.4Å; A644-F646 HydrophobicContact CB-CE1 3.65Å; A644-F646 HydrophobicContact CB-CZ 3.74Å; F646-C648 VanDerWaalsContact C-N 3.31Å; F646-C648 PolarHBondContact O-N 2.95Å; F646-L667 HydrophobicContact CD2-CD2 4.44Å; F646-L667 HydrophobicContact CE2-CD2 4.3Å; F646-W679 HydrophobicContact CB-CD2 4.31Å; F646-W679 HydrophobicContact CB-CE3 4.05Å; F646-W679 HydrophobicContact CB-CH2 4.09Å; F646-W679 HydrophobicContact CB-CZ2 4.35Å; F646-W679 HydrophobicContact CB-CZ3 3.93Å; F646-W679 HydrophobicContact CD1-CE3 4.12Å; F646-W679 HydrophobicContact CD1-CZ3 4.14Å; F646-W679 HydrophobicContact CG-CE3 4.28Å; F646-W679 HydrophobicContact CG-CZ3 4.41Å; F646-L681 HydrophobicContact CE1-CD2 4.42Å; F646-L681 HydrophobicContact CE2-CD2 4.11Å; F646-L681 HydrophobicContact CZ-CD2 3.77Å
647	D	92	Very high	85.8	Confident	127 Å²	127	63 Å²	63	68%	0.679	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	86.2	176.2	-58.9	-45	0	0	0	108.3	W679	D647-W679 WeakPolarHBondContact O-CZ2 3.38Å
648	C	89.9	Confident	88.1	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.02	30%	0.297	C	S	.	.			trans	-96.1	-26	-159.6	60.4	0	0	0	0	114.9	G616 F646 V655 V669 T677 W679	G616-C648 PolarHBondContact O-N 3.1Å; G616-C648 PolarHBondContact O-SG 2.77Å; F646-C648 VanDerWaalsContact C-N 3.31Å; F646-C648 PolarHBondContact O-N 2.95Å; C648-V655 WeakPolarHBondContact SG-CG2 3.03Å; C648-V669 HydrophobicContact CB-CB 4.47Å; C648-V669 HydrophobicContact CB-CG1 4.38Å; C648-V669 HydrophobicContact CB-CG2 4.15Å; C648-T677 WeakPolarHBondContact O-CG2 3.47Å; C648-T677 PolarHBondContact O-OG1 2.87Å; C648-W679 HydrophobicContact CB-CZ2 4.21Å
649	L	88.1	Confident	89.5	Confident	27 Å²	27	56.2 Å²	56.2	14%	0.141	30%	0.298	C	S	.	.	S	Bend	trans	-134.2	-179.7	-179.7	-57.7	-178.2	0	0	0	109.8	G616 V655 V669 S673 T677	G616-L649 PolarHBondContact O-N 3.13Å; L649-V655 HydrophobicContact CD1-CB 4.4Å; L649-V655 HydrophobicContact CD1-CG2 3.72Å; L649-V655 HydrophobicContact CG-CG2 4.18Å; L649-V669 HydrophobicContact CD1-CG1 4.48Å; L649-V669 HydrophobicContact CG-CG1 4.4Å; L649-S673 WeakPolarHBondContact CD2-OG 3.49Å; L649-T677 HydrophobicContact CD2-CG2 4.45Å
650	C	85.8	Confident	90.7	Very high	79 Å²	79	50 Å²	50	53%	0.534	27%	0.265	S	S	.	.			trans	-57	146.7	169.5	-65.3	0	0	0	0	111.3	G616 D652 S653	G616-C650 VanDerWaalsContact CA-O 3.29Å; G616-C650 WeakPolarHBondContact CA-O 3.33Å; C650-D652 WeakPolarHBondContact CB-OD1 3.41Å; C650-D652 PolarHBondContact O-N 3.05Å; C650-S653 PolarHBondContact O-N 3.5Å; C650-S653 VanDerWaalsContact O-N 3.07Å
651	Y	81.4	Confident	91	Very high	188 Å²	188	49.8 Å²	49.8	74%	0.737	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-12.7	-175	178	-99.6	0	0	0	114.2	R615	R615-Y651 WeakPolarHBondContact CD-O 3.5Å; R615-Y651 VanDerWaalsContact CG-O 3.29Å; R615-Y651 WeakPolarHBondContact CG-O 2.89Å; R615-Y651 PolarHBondContact NE-O 2.91Å
652	D	86.8	Confident	91	Very high	108 Å²	108	48.5 Å²	48.5	58%	0.578	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-16.9	174.6	51.4	-14.3	0	0	0	115.6	C650	C650-D652 WeakPolarHBondContact CB-OD1 3.41Å; C650-D652 PolarHBondContact O-N 3.05Å
653	S	91.4	Very high	90.6	Very high	11 Å²	11	51 Å²	51	8%	0.077	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-74.7	128.9	176	-58.1	0	0	0	0	112.4	G616 C650 E672	G616-S653 PolarHBondContact N-O 2.86Å; C650-S653 PolarHBondContact O-N 3.5Å; C650-S653 VanDerWaalsContact O-N 3.07Å; S653-E672 WeakPolarHBondContact CB-O 3.42Å; S653-E672 PolarHBondContact OG-O 3.29Å
654	Y	94	Very high	90.4	Very high	28 Å²	28	48.1 Å²	48.1	11%	0.11	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-77.6	132.9	164.4	-75.6	-87.9	0	0	0	112.1	V556 R615 G671 E672	V556-Y654 HydrophobicContact CB-CE1 3.95Å; R615-Y654 HydrophobicContact CB-CD1 4.06Å; R615-Y654 HydrophobicContact CB-CE1 3.79Å; R615-Y654 HydrophobicContact CG-CE1 4.48Å; Y654-G671 CarbonylContact O-C 3.59Å; Y654-G671 VanDerWaalsContact O-CA 3.24Å; Y654-G671 WeakPolarHBondContact O-CA 3.42Å; Y654-E672 WeakPolarHBondContact CB-OE2 2.99Å; Y654-E672 WeakPolarHBondContact CD2-OE2 3.31Å; Y654-E672 PolarHBondContact N-OE2 2.81Å; Y654-E672 PolarHBondContact O-N 3.33Å
655	V	96.4	Very high	90.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	126.9	166.2	175	0	0	0	0	109.3	C558 A559 A614 V618 C648 L649 I658 V669	C558-V655 WeakPolarHBondContact CB-O 3.46Å; A559-V655 HydrophobicContact CB-CG1 3.92Å; A614-V655 WeakPolarHBondContact O-CB 3.42Å; A614-V655 WeakPolarHBondContact O-CG2 3.26Å; A614-V655 PolarHBondContact O-N 3.47Å; V618-V655 HydrophobicContact CG2-CG1 4.17Å; V618-V655 HydrophobicContact CG2-CG2 4.19Å; C648-V655 WeakPolarHBondContact SG-CG2 3.03Å; L649-V655 HydrophobicContact CD1-CB 4.4Å; L649-V655 HydrophobicContact CD1-CG2 3.72Å; L649-V655 HydrophobicContact CG-CG2 4.18Å; V655-I658 HydrophobicContact CG1-CD1 4.31Å; V655-I658 HydrophobicContact CG1-CG1 3.86Å; V655-V669 HydrophobicContact CB-CG1 4.26Å; V655-V669 HydrophobicContact CG1-CG1 3.49Å; V655-V669 VanDerWaalsContact CG1-CG1 3.49Å; V655-V669 HydrophobicContact CG2-CG1 3.83Å
656	R	95.2	Very high	90.1	Very high	37 Å²	37	45.7 Å²	45.7	14%	0.14	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-28.5	-177.9	-59	-49.9	-171.1	140.6	-1.5	114	A265 G670 E672 Y699	A265-R656 PolarHBondContact O-NH1 2.82Å; A265-R656 PolarHBondContact O-NH2 3.33Å; R656-G670 PolarHBondContact N-O 2.97Å; R656-E672 HydrophobicContact CG-CG 4.49Å; R656-E672 IonicContact CZ-OE1 2.69Å; R656-E672 IonicContact NE-OE1 3.15Å; R656-E672 PolarHBondContact NE-OE1 2.99Å; R656-E672 IonicContact NH2-OE1 2.61Å; R656-E672 PolarHBondContact NH2-OE1 2.62Å; R656-Y699 WeakPolarHBondContact CB-O 3.42Å
657	S	95.9	Very high	90.3	Very high	16 Å²	16	45.5 Å²	45.5	11%	0.112	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	140.1	176	-143.2	0	0	0	0	111.6	V669 G670 L701	S657-V669 WeakPolarHBondContact O-CA 3.44Å; S657-G670 PolarHBondContact N-O 3.49Å; S657-G670 PolarHBondContact O-N 3.42Å; S657-L701 PolarHBondContact OG-N 2.77Å
658	I	96.3	Very high	90.5	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.015	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.7	170.3	-56.9	164.6	0	0	0	105.4	A559 T561 V618 V655 I668	A559-I658 HydrophobicContact CB-CD1 3.97Å; A559-I658 HydrophobicContact CB-CG1 3.98Å; T561-I658 PolarHBondContact OG1-O 2.94Å; T561-I658 VanDerWaalsContact OG1-O 3.08Å; V618-I658 HydrophobicContact CB-CD1 4.48Å; V618-I658 HydrophobicContact CG1-CD1 3.89Å; V618-I658 HydrophobicContact CG2-CD1 3.72Å; V618-I658 HydrophobicContact CG2-CG1 4.04Å; V655-I658 HydrophobicContact CG1-CD1 4.31Å; V655-I658 HydrophobicContact CG1-CG1 3.86Å; I658-I668 WeakPolarHBondContact CA-O 3.33Å
659	K	94.8	Very high	90.9	Very high	48 Å²	48	39.3 Å²	39.3	21%	0.209	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.7	163.9	-65.7	-66.3	-178.4	-178.9	0	109.6	L667 I668 L701 L703	K659-L667 CarbonylContact O-C 3.56Å; K659-L667 VanDerWaalsContact O-CA 3.32Å; K659-L667 WeakPolarHBondContact O-CA 3.26Å; K659-I668 HydrophobicContact CB-CG2 4Å; K659-I668 PolarHBondContact N-O 2.83Å; K659-I668 PolarHBondContact O-N 3.01Å; K659-L701 WeakPolarHBondContact CE-O 3.48Å; K659-L701 HydrophobicContact CG-CB 4.11Å; K659-L701 WeakPolarHBondContact CG-O 3.46Å; K659-L703 HydrophobicContact CB-CD1 3.79Å; K659-L703 HydrophobicContact CB-CG 4.09Å
660	L	92.5	Very high	91.2	Very high	30 Å²	30	38 Å²	38	16%	0.157	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	144	171.9	-70.3	172.6	0	0	0	109.9	T561 Y611 L667 L681 L703	T561-L660 HydrophobicContact CG2-CD1 4.09Å; T561-L660 HydrophobicContact CG2-CG 4.07Å; Y611-L660 HydrophobicContact CD2-CD1 4.09Å; Y611-L660 HydrophobicContact CD2-CD2 4.07Å; Y611-L660 HydrophobicContact CD2-CG 4.39Å; Y611-L660 HydrophobicContact CE1-CD2 4.17Å; Y611-L660 HydrophobicContact CE2-CD1 3.84Å; Y611-L660 HydrophobicContact CE2-CD2 3.71Å; Y611-L660 HydrophobicContact CE2-CG 4.29Å; Y611-L660 HydrophobicContact CG-CD2 4.49Å; L660-L667 HydrophobicContact CD2-CB 3.98Å; L660-L681 HydrophobicContact CD2-CD1 3.98Å; L660-L703 VanDerWaalsContact O-CD1 3.28Å; L660-L703 WeakPolarHBondContact O-CD1 3.22Å
661	F	92.2	Very high	91.6	Very high	22 Å²	22	34.3 Å²	34.3	10%	0.096	17%	0.172	C	C	.	.			trans	-70.9	147.8	171.4	-74.8	-108	0	0	0	110.4	D663 V664 G666 I668 V678 L703 G707 I724	F661-D663 VanDerWaalsContact CB-OD1 3.23Å; F661-D663 WeakPolarHBondContact CB-OD1 3.11Å; F661-D663 PolarHBondContact O-N 2.86Å; F661-D663 VanDerWaalsContact O-N 3.1Å; F661-V664 PolarHBondContact O-N 3.31Å; F661-G666 VanDerWaalsContact CD2-C 3.47Å; F661-G666 WeakPolarHBondContact CD2-O 3.23Å; F661-G666 PolarHBondContact N-O 3.14Å; F661-G666 VanDerWaalsContact N-O 3.09Å; F661-I668 HydrophobicContact CE2-CB 4.16Å; F661-V678 HydrophobicContact CE2-CG1 4.04Å; F661-V678 HydrophobicContact CZ-CG1 3.88Å; F661-L703 HydrophobicContact CD2-CD1 4.34Å; F661-L703 HydrophobicContact CG-CD1 4.36Å; F661-G707 WeakPolarHBondContact CD1-O 3.37Å; F661-G707 WeakPolarHBondContact CE1-O 3.35Å; F661-I724 HydrophobicContact CE1-CD1 3.61Å; F661-I724 HydrophobicContact CE1-CG2 3.95Å; F661-I724 HydrophobicContact CZ-CD1 3.82Å; F661-I724 HydrophobicContact CZ-CG2 3.84Å
662	P	86.4	Confident	92.2	Very high	79 Å²	79	27.7 Å²	27.7	51%	0.513	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.7	-178.6	-25.7	35.1	0	0	0	115.1
663	D	83.6	Confident	92.4	Very high	95 Å²	95	23 Å²	23	51%	0.508	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-0.6	176.3	68.1	-6.1	0	0	0	113.8	F661 S665	F661-D663 VanDerWaalsContact CB-OD1 3.23Å; F661-D663 WeakPolarHBondContact CB-OD1 3.11Å; F661-D663 PolarHBondContact O-N 2.86Å; F661-D663 VanDerWaalsContact O-N 3.1Å; D663-S665 PolarHBondContact O-N 2.86Å; D663-S665 WeakPolarHBondContact OD1-CB 3.42Å; D663-S665 PolarHBondContact OD1-N 3.41Å; D663-S665 WeakPolarHBondContact OD2-CB 3.36Å; D663-S665 PolarHBondContact OD2-OG 3.12Å
664	V	83.7	Confident	92.4	Very high	26 Å²	26	26.9 Å²	26.9	16%	0.158	14%	0.144	C	C	.	.	S	Bend	trans	57.1	14.8	-175.1	-144.7	0	0	0	0	114	P564 V567 F661 G666	P564-V664 HydrophobicContact CG-CB 4.42Å; P564-V664 HydrophobicContact CG-CG1 3.89Å; P564-V664 HydrophobicContact CG-CG2 3.56Å; V567-V664 HydrophobicContact CG2-CB 4.41Å; F661-V664 PolarHBondContact O-N 3.31Å; V664-G666 VanDerWaalsContact C-N 3.26Å; V664-G666 PolarHBondContact O-N 2.85Å
665	S	85.1	Confident	92.3	Very high	25 Å²	25	25.9 Å²	25.9	18%	0.175	14%	0.142	C	C	.	.	S	Bend	trans	-78.7	-13.2	-179.1	104.2	0	0	0	0	112.5	D663 L681	D663-S665 PolarHBondContact O-N 2.86Å; D663-S665 WeakPolarHBondContact OD1-CB 3.42Å; D663-S665 PolarHBondContact OD1-N 3.41Å; D663-S665 WeakPolarHBondContact OD2-CB 3.36Å; D663-S665 PolarHBondContact OD2-OG 3.12Å; S665-L681 PolarHBondContact O-N 3.12Å
666	G	90.6	Very high	92.3	Very high	3 Å²	3	25.9 Å²	25.9	3%	0.031	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	178.7	-171.1	0	0	0	0	0	114.5	F661 V664 W679 L681	F661-G666 VanDerWaalsContact CD2-C 3.47Å; F661-G666 WeakPolarHBondContact CD2-O 3.23Å; F661-G666 PolarHBondContact N-O 3.14Å; F661-G666 VanDerWaalsContact N-O 3.09Å; V664-G666 VanDerWaalsContact C-N 3.26Å; V664-G666 PolarHBondContact O-N 2.85Å; G666-W679 CarbonylContact C-O 3.54Å; G666-W679 WeakPolarHBondContact CA-O 3.32Å; G666-L681 VanDerWaalsContact C-CD1 3.49Å
667	L	94	Very high	92.4	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.3	170.1	63.2	77.9	0	0	0	111.3	Y611 F646 K659 L660 V669 W679 L681	Y611-L667 HydrophobicContact CD1-CD2 3.44Å; Y611-L667 VanDerWaalsContact CD1-CD2 3.44Å; Y611-L667 HydrophobicContact CE1-CD2 3.61Å; Y611-L667 HydrophobicContact CG-CD2 4.43Å; F646-L667 HydrophobicContact CD2-CD2 4.44Å; F646-L667 HydrophobicContact CE2-CD2 4.3Å; K659-L667 CarbonylContact O-C 3.56Å; K659-L667 VanDerWaalsContact O-CA 3.32Å; K659-L667 WeakPolarHBondContact O-CA 3.26Å; L660-L667 HydrophobicContact CD2-CB 3.98Å; L667-V669 HydrophobicContact CD1-CG2 3.32Å; L667-W679 HydrophobicContact CD1-CB 3.76Å; L667-W679 HydrophobicContact CD1-CG 4.02Å; L667-W679 HydrophobicContact CG-CB 4.01Å; L667-W679 PolarHBondContact N-O 3.34Å; L667-W679 PolarHBondContact O-N 2.81Å; L667-L681 HydrophobicContact CB-CD1 4.28Å; L667-L681 HydrophobicContact CD2-CD1 4.26Å; L667-L681 HydrophobicContact CD2-CD2 3.94Å; L667-L681 HydrophobicContact CD2-CG 4.47Å; L667-L681 HydrophobicContact CG-CD1 4.34Å; L667-L681 HydrophobicContact CG-CD2 4.31Å; L667-L681 HydrophobicContact CG-CG 4.42Å
668	I	96.7	Very high	92.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	139.6	169.2	-172.1	169.7	0	0	0	109.3	I658 K659 F661 L676 V678 L691 L701 L703 A710	I658-I668 WeakPolarHBondContact CA-O 3.33Å; K659-I668 HydrophobicContact CB-CG2 4Å; K659-I668 PolarHBondContact N-O 2.83Å; K659-I668 PolarHBondContact O-N 3.01Å; F661-I668 HydrophobicContact CE2-CB 4.16Å; I668-L676 HydrophobicContact CD1-CB 4.33Å; I668-L676 HydrophobicContact CD1-CD1 4Å; I668-L676 HydrophobicContact CG1-CB 4.36Å; I668-V678 HydrophobicContact CD1-CG2 4.12Å; I668-V678 HydrophobicContact CG1-CG2 4.13Å; I668-L691 HydrophobicContact CD1-CD1 4.38Å; I668-L701 HydrophobicContact CG1-CD1 4.08Å; I668-L701 HydrophobicContact CG2-CD1 4.13Å; I668-L703 HydrophobicContact CG2-CD1 4.06Å; I668-L703 HydrophobicContact CG2-CD2 4.06Å; I668-L703 HydrophobicContact CG2-CG 4.17Å; I668-A710 HydrophobicContact CD1-CB 3.75Å
669	V	97.4	Very high	92.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135	-178.5	-167.9	0	0	0	0	110.1	V618 C648 L649 V655 S657 L667 L676 T677	V618-V669 HydrophobicContact CG2-CG1 4.23Å; V618-V669 HydrophobicContact CG2-CG2 4.16Å; C648-V669 HydrophobicContact CB-CB 4.47Å; C648-V669 HydrophobicContact CB-CG1 4.38Å; C648-V669 HydrophobicContact CB-CG2 4.15Å; L649-V669 HydrophobicContact CD1-CG1 4.48Å; L649-V669 HydrophobicContact CG-CG1 4.4Å; V655-V669 HydrophobicContact CB-CG1 4.26Å; V655-V669 HydrophobicContact CG1-CG1 3.49Å; V655-V669 VanDerWaalsContact CG1-CG1 3.49Å; V655-V669 HydrophobicContact CG2-CG1 3.83Å; S657-V669 WeakPolarHBondContact O-CA 3.44Å; L667-V669 HydrophobicContact CD1-CG2 3.32Å; V669-L676 CarbonylContact O-C 3.49Å; V669-L676 VanDerWaalsContact O-CA 3.24Å; V669-L676 WeakPolarHBondContact O-CA 3.4Å; V669-T677 PolarHBondContact N-O 2.77Å; V669-T677 PolarHBondContact O-N 2.89Å
670	G	95.2	Very high	92.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	154.2	169.8	0	0	0	0	0	110.4	R656 S657	R656-G670 PolarHBondContact N-O 2.97Å; S657-G670 PolarHBondContact N-O 3.49Å; S657-G670 PolarHBondContact O-N 3.42Å
671	G	94.2	Very high	91.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174	-151.2	-178.7	0	0	0	0	0	113.1	Y654 S673 A697 C698	Y654-G671 CarbonylContact O-C 3.59Å; Y654-G671 VanDerWaalsContact O-CA 3.24Å; Y654-G671 WeakPolarHBondContact O-CA 3.42Å; G671-S673 PolarHBondContact O-N 2.86Å; G671-A697 VanDerWaalsContact O-CB 3.23Å; G671-A697 WeakPolarHBondContact O-CB 3.21Å; G671-C698 WeakPolarHBondContact CA-O 3.03Å; G671-C698 PolarHBondContact N-O 3.29Å; G671-C698 PolarHBondContact O-N 3.21Å
672	E	93.4	Very high	91.3	Very high	49 Å²	49	25.7 Å²	25.7	23%	0.229	14%	0.144	C	C	.	.	S	Bend	trans	-73.1	51.5	176.4	-66.6	174.5	167.6	0	0	113	A268 S653 Y654 R656 P696	A268-E672 WeakPolarHBondContact CB-OE1 3.35Å; S653-E672 WeakPolarHBondContact CB-O 3.42Å; S653-E672 PolarHBondContact OG-O 3.29Å; Y654-E672 WeakPolarHBondContact CB-OE2 2.99Å; Y654-E672 WeakPolarHBondContact CD2-OE2 3.31Å; Y654-E672 PolarHBondContact N-OE2 2.81Å; Y654-E672 PolarHBondContact O-N 3.33Å; R656-E672 HydrophobicContact CG-CG 4.49Å; R656-E672 IonicContact CZ-OE1 2.69Å; R656-E672 IonicContact NE-OE1 3.15Å; R656-E672 PolarHBondContact NE-OE1 2.99Å; R656-E672 IonicContact NH2-OE1 2.61Å; R656-E672 PolarHBondContact NH2-OE1 2.62Å; E672-P696 CarbonylContact C-O 3.57Å
673	S	91.8	Very high	90.7	Very high	11 Å²	11	23.4 Å²	23.4	8%	0.077	14%	0.135	C	C	.	.	S	Bend	trans	-147	144.1	-175.3	51.7	0	0	0	0	110	L649 G671 A675 F693 P696	L649-S673 WeakPolarHBondContact CD2-OG 3.49Å; G671-S673 PolarHBondContact O-N 2.86Å; S673-A675 PolarHBondContact O-N 3Å; S673-A675 PolarHBondContact OG-O 2.92Å; S673-F693 WeakPolarHBondContact O-CZ 3.5Å; S673-P696 CarbonylContact C-O 3.57Å; S673-P696 VanDerWaalsContact C-O 3.22Å; S673-P696 PolarHBondContact N-O 3.45Å; S673-P696 VanDerWaalsContact N-O 3.15Å
674	N	91.1	Very high	90.2	Very high	92 Å²	92	22.7 Å²	22.7	49%	0.492	14%	0.135	S	C	.	.	S	Bend	trans	-75.1	26	173.5	72.4	-52.3	0	0	0	113.3	T692 F693 A695	N674-T692 WeakPolarHBondContact O-CA 3.47Å; N674-F693 WeakPolarHBondContact CB-O 3.26Å; N674-F693 PolarHBondContact O-N 3.23Å; N674-A695 WeakPolarHBondContact CA-O 3.44Å; N674-A695 WeakPolarHBondContact CB-O 3.35Å
675	A	92.9	Very high	89.8	Confident	7 Å²	7	22.1 Å²	22.1	6%	0.058	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	143	-178.3	0	0	0	0	0	111.2	S673 E690 L691 T692	S673-A675 PolarHBondContact O-N 3Å; S673-A675 PolarHBondContact OG-O 2.92Å; A675-E690 HydrophobicContact CB-CG 4.05Å; A675-L691 CarbonylContact C-O 3.58Å; A675-L691 VanDerWaalsContact CA-O 3.27Å; A675-L691 WeakPolarHBondContact CA-O 3.29Å; A675-T692 HydrophobicContact CB-CG2 4.12Å
676	L	96.1	Very high	89.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	142.3	163.8	-43.4	177.9	0	0	0	108.7	I668 V669 E690 L691 F693 C698 L701	I668-L676 HydrophobicContact CD1-CB 4.33Å; I668-L676 HydrophobicContact CD1-CD1 4Å; I668-L676 HydrophobicContact CG1-CB 4.36Å; V669-L676 CarbonylContact O-C 3.49Å; V669-L676 VanDerWaalsContact O-CA 3.24Å; V669-L676 WeakPolarHBondContact O-CA 3.4Å; L676-E690 CarbonylContact O-C 3.57Å; L676-E690 WeakPolarHBondContact O-CA 3.48Å; L676-L691 HydrophobicContact CB-CB 4.15Å; L676-L691 HydrophobicContact CD1-CD1 4.35Å; L676-L691 HydrophobicContact CG-CB 4.44Å; L676-L691 PolarHBondContact N-O 3.41Å; L676-L691 PolarHBondContact O-N 2.8Å; L676-F693 HydrophobicContact CD2-CE1 3.67Å; L676-F693 HydrophobicContact CD2-CZ 4.17Å; L676-F693 HydrophobicContact CG-CD1 4.48Å; L676-F693 HydrophobicContact CG-CE1 3.82Å; L676-C698 HydrophobicContact CD2-CB 3.76Å; L676-L701 HydrophobicContact CD1-CD2 3.79Å; L676-L701 HydrophobicContact CD2-CD2 3.99Å
677	T	96.4	Very high	89.8	Confident	2 Å²	2	35 Å²	35	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129	171.6	64.5	0	0	0	0	112	C648 L649 V669 W679 E690	C648-T677 WeakPolarHBondContact O-CG2 3.47Å; C648-T677 PolarHBondContact O-OG1 2.87Å; L649-T677 HydrophobicContact CD2-CG2 4.45Å; V669-T677 PolarHBondContact N-O 2.77Å; V669-T677 PolarHBondContact O-N 2.89Å; T677-W679 PolarHBondContact OG1-NE1 3.44Å; T677-E690 HydrophobicContact CG2-CG 4.3Å
678	V	95.9	Very high	89.6	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.024	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	129.9	177.5	-175.7	0	0	0	0	107.9	F661 I668 K688 A689 L691 I724	F661-V678 HydrophobicContact CE2-CG1 4.04Å; F661-V678 HydrophobicContact CZ-CG1 3.88Å; I668-V678 HydrophobicContact CD1-CG2 4.12Å; I668-V678 HydrophobicContact CG1-CG2 4.13Å; V678-K688 PolarHBondContact O-N 2.89Å; V678-A689 HydrophobicContact CB-CB 4.05Å; V678-A689 HydrophobicContact CG2-CB 4.22Å; V678-A689 PolarHBondContact N-O 2.57Å; V678-A689 PolarHBondContact O-N 3.43Å; V678-L691 HydrophobicContact CG2-CD1 4.16Å; V678-L691 HydrophobicContact CG2-CG 4.4Å; V678-I724 HydrophobicContact CG1-CG2 4.32Å; V678-I724 HydrophobicContact CG2-CG2 4.35Å
679	W	93.8	Very high	89.5	Confident	25 Å²	25	41.9 Å²	41.9	10%	0.095	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.9	-176.2	-73.1	73.4	0	0	0	110.8	F646 D647 C648 G666 L667 T677 R686 R687	F646-W679 HydrophobicContact CB-CD2 4.31Å; F646-W679 HydrophobicContact CB-CE3 4.05Å; F646-W679 HydrophobicContact CB-CH2 4.09Å; F646-W679 HydrophobicContact CB-CZ2 4.35Å; F646-W679 HydrophobicContact CB-CZ3 3.93Å; F646-W679 HydrophobicContact CD1-CE3 4.12Å; F646-W679 HydrophobicContact CD1-CZ3 4.14Å; F646-W679 HydrophobicContact CG-CE3 4.28Å; F646-W679 HydrophobicContact CG-CZ3 4.41Å; D647-W679 WeakPolarHBondContact O-CZ2 3.38Å; C648-W679 HydrophobicContact CB-CZ2 4.21Å; G666-W679 CarbonylContact C-O 3.54Å; G666-W679 WeakPolarHBondContact CA-O 3.32Å; L667-W679 HydrophobicContact CD1-CB 3.76Å; L667-W679 HydrophobicContact CD1-CG 4.02Å; L667-W679 HydrophobicContact CG-CB 4.01Å; L667-W679 PolarHBondContact N-O 3.34Å; L667-W679 PolarHBondContact O-N 2.81Å; T677-W679 PolarHBondContact OG1-NE1 3.44Å; W679-R686 CarbonylContact C-O 3.56Å; W679-R686 WeakPolarHBondContact CA-O 3.32Å; W679-R686 VanDerWaalsContact CE3-C 3.43Å; W679-R687 HydrophobicContact CD2-CB 4.22Å; W679-R687 HydrophobicContact CE3-CB 4.5Å; W679-R687 HydrophobicContact CH2-CB 4.14Å; W679-R687 HydrophobicContact CZ2-CB 3.82Å; W679-R687 HydrophobicContact CZ2-CG 4.19Å; W679-R687 HydrophobicContact CZ3-CB 4.48Å
680	D	90.4	Very high	89.3	Confident	48 Å²	48	45.8 Å²	45.8	26%	0.257	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	126.9	165.1	-167.8	-37.9	0	0	0	108.5	N682 G685 R686 K688	D680-N682 VanDerWaalsContact OD1-CB 3.25Å; D680-N682 WeakPolarHBondContact OD1-CB 3.34Å; D680-N682 PolarHBondContact OD1-N 2.89Å; D680-N682 PolarHBondContact OD1-ND2 2.98Å; D680-G685 CarbonylContact O-C 3.57Å; D680-G685 VanDerWaalsContact O-CA 3.29Å; D680-G685 WeakPolarHBondContact O-CA 3.26Å; D680-R686 PolarHBondContact N-O 2.94Å; D680-R686 PolarHBondContact O-N 3.45Å; D680-K688 HydrophobicContact CB-CB 4.35Å; D680-K688 HydrophobicContact CB-CD 4.38Å
681	L	87.6	Confident	89.3	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.229	C	C	.	.			trans	-93	-4.5	-176.9	-72.6	169.8	0	0	0	113.4	P566 Y611 F646 L660 S665 G666 L667 G683	P566-L681 HydrophobicContact CB-CB 3.93Å; P566-L681 HydrophobicContact CB-CD1 4.21Å; Y611-L681 HydrophobicContact CE1-CD1 4.09Å; Y611-L681 HydrophobicContact CE1-CD2 4.04Å; F646-L681 HydrophobicContact CE1-CD2 4.42Å; F646-L681 HydrophobicContact CE2-CD2 4.11Å; F646-L681 HydrophobicContact CZ-CD2 3.77Å; L660-L681 HydrophobicContact CD2-CD1 3.98Å; S665-L681 PolarHBondContact O-N 3.12Å; G666-L681 VanDerWaalsContact C-CD1 3.49Å; L667-L681 HydrophobicContact CB-CD1 4.28Å; L667-L681 HydrophobicContact CD2-CD1 4.26Å; L667-L681 HydrophobicContact CD2-CD2 3.94Å; L667-L681 HydrophobicContact CD2-CG 4.47Å; L667-L681 HydrophobicContact CG-CD1 4.34Å; L667-L681 HydrophobicContact CG-CD2 4.31Å; L667-L681 HydrophobicContact CG-CG 4.42Å; L681-G683 PolarHBondContact O-N 3.49Å
682	N	81.1	Confident	89.3	Confident	71 Å²	71	50.3 Å²	50.3	38%	0.38	26%	0.256	S	S	.	.	S	Bend	trans	-62.2	109.6	178.9	-69.9	-80.5	0	0	0	110.7	V567 D680 P684	V567-N682 WeakPolarHBondContact CG1-OD1 3.41Å; D680-N682 VanDerWaalsContact OD1-CB 3.25Å; D680-N682 WeakPolarHBondContact OD1-CB 3.34Å; D680-N682 PolarHBondContact OD1-N 2.89Å; D680-N682 PolarHBondContact OD1-ND2 2.98Å; N682-P684 WeakPolarHBondContact O-CD 3.25Å
683	G	73.9	Confident	89.1	Confident	31 Å²	31	49 Å²	49	32%	0.32	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-118.8	-178.9	0	0	0	0	0	113.6	R569 L681 G685	R569-G683 PolarHBondContact NE-O 3.36Å; R569-G683 PolarHBondContact NH2-O 3.32Å; L681-G683 PolarHBondContact O-N 3.49Å; G683-G685 VanDerWaalsContact C-N 3.29Å; G683-G685 PolarHBondContact O-N 3.35Å
684	P	72.4	Confident	89.1	Confident	80 Å²	80	57.8 Å²	57.8	52%	0.519	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-18.7	-171.7	30.3	-36	0	0	0	114	R569 N682 R686	R569-P684 PolarHBondContact NH2-O 2.93Å; N682-P684 WeakPolarHBondContact O-CD 3.25Å; P684-R686 HydrophobicContact CG-CG 4.41Å
685	G	76.4	Confident	89	Confident	13 Å²	13	53.7 Å²	53.7	13%	0.134	27%	0.268	C	S	.	.			trans	90.6	126.8	-161.5	0	0	0	0	0	110.9	D680 G683	D680-G685 CarbonylContact O-C 3.57Å; D680-G685 VanDerWaalsContact O-CA 3.29Å; D680-G685 WeakPolarHBondContact O-CA 3.26Å; G683-G685 VanDerWaalsContact C-N 3.29Å; G683-G685 PolarHBondContact O-N 3.35Å
686	R	85.1	Confident	88.9	Confident	173 Å²	173	56.9 Å²	56.9	65%	0.653	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.1	133.2	178.1	-64.4	-177.7	-177.9	-90.9	2.1	110.8	W679 D680 P684 K688	W679-R686 CarbonylContact C-O 3.56Å; W679-R686 WeakPolarHBondContact CA-O 3.32Å; W679-R686 VanDerWaalsContact CE3-C 3.43Å; D680-R686 PolarHBondContact N-O 2.94Å; D680-R686 PolarHBondContact O-N 3.45Å; P684-R686 HydrophobicContact CG-CG 4.41Å; R686-K688 PolarHBondContact O-N 3.32Å
687	R	89.4	Confident	88.7	Confident	127 Å²	127	57.1 Å²	57.1	48%	0.479	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	121	170.7	-161.2	171.9	75.3	146.9	15.9	109.5	W679 E690	W679-R687 HydrophobicContact CD2-CB 4.22Å; W679-R687 HydrophobicContact CE3-CB 4.5Å; W679-R687 HydrophobicContact CH2-CB 4.14Å; W679-R687 HydrophobicContact CZ2-CB 3.82Å; W679-R687 HydrophobicContact CZ2-CG 4.19Å; W679-R687 HydrophobicContact CZ3-CB 4.48Å; R687-E690 IonicContact CZ-OE1 2.84Å; R687-E690 IonicContact CZ-OE2 2.71Å; R687-E690 IonicContact NH1-OE1 3.03Å; R687-E690 PolarHBondContact NH1-OE1 3.42Å; R687-E690 IonicContact NH1-OE2 3.63Å; R687-E690 PolarHBondContact NH1-OE2 2.7Å; R687-E690 IonicContact NH2-OE2 3.57Å; R687-E690 PolarHBondContact NH2-OE2 2.99Å
688	K	91.3	Very high	88.6	Confident	134 Å²	134	57 Å²	57	58%	0.583	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	-39.1	-173.1	177.8	178.3	175.7	178.8	0	112.3	V678 D680 R686	V678-K688 PolarHBondContact O-N 2.89Å; D680-K688 HydrophobicContact CB-CB 4.35Å; D680-K688 HydrophobicContact CB-CD 4.38Å; R686-K688 PolarHBondContact O-N 3.32Å
689	A	92.8	Very high	88.5	Confident	10 Å²	10	58 Å²	58	8%	0.083	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	164.2	178.3	0	0	0	0	0	111.1	V678 Q727	V678-A689 HydrophobicContact CB-CB 4.05Å; V678-A689 HydrophobicContact CG2-CB 4.22Å; V678-A689 PolarHBondContact N-O 2.57Å; V678-A689 PolarHBondContact O-N 3.43Å; A689-Q727 HydrophobicContact CB-CG 3.94Å; A689-Q727 VanDerWaalsContact CB-OE1 3.25Å
690	E	94	Very high	88.6	Confident	83 Å²	83	57.4 Å²	57.4	39%	0.388	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	119	177.4	-178.3	165.3	-148.4	0	0	108	A675 L676 T677 R687 T692	A675-E690 HydrophobicContact CB-CG 4.05Å; L676-E690 CarbonylContact O-C 3.57Å; L676-E690 WeakPolarHBondContact O-CA 3.48Å; T677-E690 HydrophobicContact CG2-CG 4.3Å; R687-E690 IonicContact CZ-OE1 2.84Å; R687-E690 IonicContact CZ-OE2 2.71Å; R687-E690 IonicContact NH1-OE1 3.03Å; R687-E690 PolarHBondContact NH1-OE1 3.42Å; R687-E690 IonicContact NH1-OE2 3.63Å; R687-E690 PolarHBondContact NH1-OE2 2.7Å; R687-E690 IonicContact NH2-OE2 3.57Å; R687-E690 PolarHBondContact NH2-OE2 2.99Å; E690-T692 HydrophobicContact CG-CG2 4.34Å
691	L	95.1	Very high	88.9	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	99.2	-170.5	-55.6	179.4	0	0	0	109	I668 A675 L676 V678 W722 Q727	I668-L691 HydrophobicContact CD1-CD1 4.38Å; A675-L691 CarbonylContact C-O 3.58Å; A675-L691 VanDerWaalsContact CA-O 3.27Å; A675-L691 WeakPolarHBondContact CA-O 3.29Å; L676-L691 HydrophobicContact CB-CB 4.15Å; L676-L691 HydrophobicContact CD1-CD1 4.35Å; L676-L691 HydrophobicContact CG-CB 4.44Å; L676-L691 PolarHBondContact N-O 3.41Å; L676-L691 PolarHBondContact O-N 2.8Å; V678-L691 HydrophobicContact CG2-CD1 4.16Å; V678-L691 HydrophobicContact CG2-CG 4.4Å; L691-W722 HydrophobicContact CB-CD2 4.21Å; L691-W722 HydrophobicContact CB-CE3 3.8Å; L691-W722 HydrophobicContact CB-CH2 4.19Å; L691-W722 HydrophobicContact CB-CZ3 3.78Å; L691-W722 HydrophobicContact CD1-CB 4.16Å; L691-W722 HydrophobicContact CD1-CD2 4.17Å; L691-W722 HydrophobicContact CD1-CE3 4.15Å; L691-W722 HydrophobicContact CD1-CG 4.19Å; L691-W722 HydrophobicContact CD2-CE3 4.29Å; L691-W722 HydrophobicContact CG-CE3 4.3Å; L691-Q727 HydrophobicContact CD2-CB 3.67Å; L691-Q727 HydrophobicContact CD2-CG 3.94Å
692	T	93.8	Very high	89.2	Confident	93 Å²	93	55.2 Å²	55.2	57%	0.571	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.5	-170	55.8	0	0	0	0	113.2	N674 A675 E690 W722	N674-T692 WeakPolarHBondContact O-CA 3.47Å; A675-T692 HydrophobicContact CB-CG2 4.12Å; E690-T692 HydrophobicContact CG-CG2 4.34Å; T692-W722 WeakPolarHBondContact O-CH2 3.27Å
693	F	90.5	Very high	89.9	Confident	22 Å²	22	53.1 Å²	53.1	10%	0.096	27%	0.271	C	S	.	.			trans	-134.5	174.9	179.5	50.8	-87.2	0	0	0	111.4	S673 N674 L676 A695 C698 W722	S673-F693 WeakPolarHBondContact O-CZ 3.5Å; N674-F693 WeakPolarHBondContact CB-O 3.26Å; N674-F693 PolarHBondContact O-N 3.23Å; L676-F693 HydrophobicContact CD2-CE1 3.67Å; L676-F693 HydrophobicContact CD2-CZ 4.17Å; L676-F693 HydrophobicContact CG-CD1 4.48Å; L676-F693 HydrophobicContact CG-CE1 3.82Å; F693-A695 HydrophobicContact CD2-CB 3.88Å; F693-A695 VanDerWaalsContact CD2-O 3.27Å; F693-A695 WeakPolarHBondContact CD2-O 3.28Å; F693-A695 HydrophobicContact CE2-CB 4.1Å; F693-A695 WeakPolarHBondContact CE2-O 3.34Å; F693-C698 HydrophobicContact CE1-CB 4.45Å; F693-C698 HydrophobicContact CE2-CB 4.36Å; F693-C698 HydrophobicContact CZ-CB 3.68Å; F693-W722 HydrophobicContact CB-CH2 4.04Å; F693-W722 HydrophobicContact CB-CZ2 3.93Å; F693-W722 HydrophobicContact CD1-CH2 4.19Å; F693-W722 AromaticContact CD1-CZ2 3.74Å; F693-W722 HydrophobicContact CD1-CZ2 3.74Å; F693-W722 HydrophobicContact CG-CZ2 4.2Å
694	E	90.2	Very high	90.7	Very high	195 Å²	195	52.3 Å²	52.3	91%	0.911	26%	0.26	S	S	*	.	S	Bend	trans	-86.4	-31.4	-175.1	-61.1	-166.8	158.1	0	0	113.9
695	A	90.7	Very high	91.4	Very high	5 Å²	5	53.8 Å²	53.8	4%	0.041	26%	0.263	C	S	.	.	S	Bend	trans	-62.8	142.5	177.7	0	0	0	0	0	111.8	N674 F693 A697 C714 D716	N674-A695 WeakPolarHBondContact CA-O 3.44Å; N674-A695 WeakPolarHBondContact CB-O 3.35Å; F693-A695 HydrophobicContact CD2-CB 3.88Å; F693-A695 VanDerWaalsContact CD2-O 3.27Å; F693-A695 WeakPolarHBondContact CD2-O 3.28Å; F693-A695 HydrophobicContact CE2-CB 4.1Å; F693-A695 WeakPolarHBondContact CE2-O 3.34Å; A695-A697 VanDerWaalsContact C-N 3.32Å; A695-A697 PolarHBondContact O-N 2.96Å; A695-C714 HydrophobicContact CB-CB 3.83Å; A695-D716 HydrophobicContact CB-CB 4.1Å
696	P	89.8	Confident	91.9	Very high	74 Å²	74	57.5 Å²	57.5	48%	0.481	28%	0.28	S	S	.	.	S	Bend	trans	-71.8	-28.8	178.3	28.4	-34.8	0	0	0	113.1	E672 S673 S715	E672-P696 CarbonylContact C-O 3.57Å; S673-P696 CarbonylContact C-O 3.57Å; S673-P696 VanDerWaalsContact C-O 3.22Å; S673-P696 PolarHBondContact N-O 3.45Å; S673-P696 VanDerWaalsContact N-O 3.15Å; P696-S715 WeakPolarHBondContact CD-OG 3.16Å; P696-S715 WeakPolarHBondContact CG-OG 3.32Å
697	A	92.3	Very high	92.1	Very high	6 Å²	6	49.9 Å²	49.9	5%	0.05	26%	0.255	C	S	.	.			trans	-102.7	132.7	-178.2	0	0	0	0	0	117.6	G671 A695 Y699 C714 S715	G671-A697 VanDerWaalsContact O-CB 3.23Å; G671-A697 WeakPolarHBondContact O-CB 3.21Å; A695-A697 VanDerWaalsContact C-N 3.32Å; A695-A697 PolarHBondContact O-N 2.96Å; A697-Y699 HydrophobicContact CB-CE1 4.33Å; A697-C714 VanDerWaalsContact O-CA 3.29Å; A697-C714 WeakPolarHBondContact O-CA 3.47Å; A697-S715 WeakPolarHBondContact CA-OG 3.44Å; A697-S715 PolarHBondContact N-OG 3.48Å; A697-S715 VanDerWaalsContact N-OG 3.09Å; A697-S715 PolarHBondContact O-N 3.13Å; A697-S715 VanDerWaalsContact O-N 3.11Å
698	C	94.3	Very high	92.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	111	147.1	171.4	0	0	0	0	109.8	G671 L676 F693 C713	G671-C698 WeakPolarHBondContact CA-O 3.03Å; G671-C698 PolarHBondContact N-O 3.29Å; G671-C698 PolarHBondContact O-N 3.21Å; L676-C698 HydrophobicContact CD2-CB 3.76Å; F693-C698 HydrophobicContact CE1-CB 4.45Å; F693-C698 HydrophobicContact CE2-CB 4.36Å; F693-C698 HydrophobicContact CZ-CB 3.68Å; C698-C713 CarbonylContact C-O 3.6Å; C698-C713 WeakPolarHBondContact CA-O 3.48Å
699	Y	93.6	Very high	92.4	Very high	24 Å²	24	45.5 Å²	45.5	9%	0.094	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-40.9	-175.8	-62.9	-53.7	0	0	0	113	A268 A269 R656 A697 C713 S715	A268-Y699 PolarHBondContact O-OH 2.64Å; A269-Y699 HydrophobicContact CB-CE1 4.39Å; A269-Y699 PolarHBondContact O-OH 3.45Å; R656-Y699 WeakPolarHBondContact CB-O 3.42Å; A697-Y699 HydrophobicContact CB-CE1 4.33Å; Y699-C713 PolarHBondContact N-O 2.76Å; Y699-S715 VanDerWaalsContact CE2-CB 3.47Å
700	A	95.5	Very high	92.6	Very high	12 Å²	12	45 Å²	45	10%	0.099	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147	-177.4	0	0	0	0	0	113.1	C713 S741 V743	A700-C713 HydrophobicContact CB-CB 4.24Å; A700-C713 PolarHBondContact O-N 3.17Å; A700-S741 WeakPolarHBondContact CB-O 3.33Å; A700-V743 HydrophobicContact CB-CG1 3.91Å
701	L	97	Very high	92.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	146.7	176.6	-71.1	172.9	0	0	0	111.6	S657 K659 I668 L676 Y711	S657-L701 PolarHBondContact OG-N 2.77Å; K659-L701 WeakPolarHBondContact CE-O 3.48Å; K659-L701 HydrophobicContact CG-CB 4.11Å; K659-L701 WeakPolarHBondContact CG-O 3.46Å; I668-L701 HydrophobicContact CG1-CD1 4.08Å; I668-L701 HydrophobicContact CG2-CD1 4.13Å; L676-L701 HydrophobicContact CD1-CD2 3.79Å; L676-L701 HydrophobicContact CD2-CD2 3.99Å; L701-Y711 CarbonylContact C-O 3.53Å; L701-Y711 VanDerWaalsContact CA-O 3.3Å; L701-Y711 WeakPolarHBondContact CA-O 3.47Å
702	A	95.2	Very high	92.8	Very high	3 Å²	3	41.3 Å²	41.3	3%	0.025	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	160.6	162.4	0	0	0	0	0	110.7	A710 Y711 V743 I745	A702-A710 WeakPolarHBondContact O-CA 3.32Å; A702-Y711 PolarHBondContact N-O 3.2Å; A702-Y711 PolarHBondContact O-N 2.72Å; A702-V743 HydrophobicContact CB-CG1 4.1Å; A702-V743 HydrophobicContact CB-CG2 4.13Å; A702-I745 HydrophobicContact CB-CD1 3.66Å; A702-I745 HydrophobicContact CB-CG1 4.02Å
703	L	93.8	Very high	92.9	Very high	27 Å²	27	36.9 Å²	36.9	14%	0.141	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.4	179.7	-75.3	174.2	0	0	0	110.5	K659 L660 F661 I668 L709 A710 I724 I745	K659-L703 HydrophobicContact CB-CD1 3.79Å; K659-L703 HydrophobicContact CB-CG 4.09Å; L660-L703 VanDerWaalsContact O-CD1 3.28Å; L660-L703 WeakPolarHBondContact O-CD1 3.22Å; F661-L703 HydrophobicContact CD2-CD1 4.34Å; F661-L703 HydrophobicContact CG-CD1 4.36Å; I668-L703 HydrophobicContact CG2-CD1 4.06Å; I668-L703 HydrophobicContact CG2-CD2 4.06Å; I668-L703 HydrophobicContact CG2-CG 4.17Å; L703-L709 WeakPolarHBondContact CA-O 3.37Å; L703-A710 HydrophobicContact CD2-CB 3.86Å; L703-I724 HydrophobicContact CD2-CD1 3.57Å; L703-I745 VanDerWaalsContact O-CD1 3.28Å; L703-I745 WeakPolarHBondContact O-CD1 3.33Å
704	S	91.9	Very high	93	Very high	14 Å²	14	36 Å²	36	10%	0.098	19%	0.19	C	C	.	.			trans	-65.5	153.5	170.4	60.5	0	0	0	0	112	D706 G707 K708 L709	S704-D706 VanDerWaalsContact CB-OD1 3.29Å; S704-D706 WeakPolarHBondContact CB-OD1 3.32Å; S704-D706 PolarHBondContact O-N 3.49Å; S704-D706 PolarHBondContact OG-OD1 2.78Å; S704-G707 PolarHBondContact O-N 2.97Å; S704-K708 PolarHBondContact OG-N 3.33Å; S704-L709 PolarHBondContact N-O 3.06Å; S704-L709 PolarHBondContact OG-N 2.91Å; S704-L709 PolarHBondContact OG-O 2.72Å
705	L	86.3	Confident	93.2	Very high	112 Å²	112	27.1 Å²	27.1	59%	0.586	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.2	177.8	-72.7	164	0	0	0	113.9
706	D	87	Confident	93.2	Very high	91 Å²	91	29.8 Å²	29.8	49%	0.487	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	5.1	177.6	74.9	-20.7	0	0	0	114	S704 K708	S704-D706 VanDerWaalsContact CB-OD1 3.29Å; S704-D706 WeakPolarHBondContact CB-OD1 3.32Å; S704-D706 PolarHBondContact O-N 3.49Å; S704-D706 PolarHBondContact OG-OD1 2.78Å; D706-K708 PolarHBondContact O-N 2.65Å; D706-K708 PolarHBondContact OD1-N 2.12Å; D706-K708 WeakPolarHBondContact OD2-CD 3.48Å; D706-K708 WeakPolarHBondContact OD2-CG 3.4Å; D706-K708 IonicContact OD2-NZ 2.62Å; D706-K708 PolarHBondContact OD2-NZ 3.5Å
707	G	90.2	Very high	93.3	Very high	13 Å²	13	26.3 Å²	26.3	13%	0.134	14%	0.14	C	C	.	.	S	Bend	trans	66.7	10.6	176.6	0	0	0	0	0	116.1	F661 S704	F661-G707 WeakPolarHBondContact CD1-O 3.37Å; F661-G707 WeakPolarHBondContact CE1-O 3.35Å; S704-G707 PolarHBondContact O-N 2.97Å
708	K	92.3	Very high	93.3	Very high	121 Å²	121	28 Å²	28	53%	0.526	15%	0.147	S	C	.	.	S	Bend	trans	-90	-31.6	-177.8	-61.9	-168.9	-164.7	66.5	0	114.3	S704 D706 I724	S704-K708 PolarHBondContact OG-N 3.33Å; D706-K708 PolarHBondContact O-N 2.65Å; D706-K708 PolarHBondContact OD1-N 2.12Å; D706-K708 WeakPolarHBondContact OD2-CD 3.48Å; D706-K708 WeakPolarHBondContact OD2-CG 3.4Å; D706-K708 IonicContact OD2-NZ 2.62Å; D706-K708 PolarHBondContact OD2-NZ 3.5Å; K708-I724 WeakPolarHBondContact O-CB 3.45Å; K708-I724 WeakPolarHBondContact O-CG1 3.27Å; K708-I724 PolarHBondContact O-N 2.98Å
709	L	94.8	Very high	93.3	Very high	48 Å²	48	28 Å²	28	25%	0.251	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.9	-177	-58.9	179.5	0	0	0	111.4	L703 S704 Y711 V721 W722 D723	L703-L709 WeakPolarHBondContact CA-O 3.37Å; S704-L709 PolarHBondContact N-O 3.06Å; S704-L709 PolarHBondContact OG-N 2.91Å; S704-L709 PolarHBondContact OG-O 2.72Å; L709-Y711 HydrophobicContact CB-CE2 4.24Å; L709-V721 HydrophobicContact CB-CG1 4.42Å; L709-V721 HydrophobicContact CD1-CG1 4.27Å; L709-W722 VanDerWaalsContact CA-O 3.24Å; L709-W722 WeakPolarHBondContact CA-O 3.3Å; L709-D723 HydrophobicContact CD2-CB 4.46Å
710	A	96.6	Very high	93.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.2	166.8	0	0	0	0	0	110.5	I668 A702 L703 V721 W722 I724	I668-A710 HydrophobicContact CD1-CB 3.75Å; A702-A710 WeakPolarHBondContact O-CA 3.32Å; L703-A710 HydrophobicContact CD2-CB 3.86Å; A710-V721 CarbonylContact O-C 3.58Å; A710-V721 WeakPolarHBondContact O-CA 3.48Å; A710-W722 HydrophobicContact CB-CB 4.31Å; A710-W722 PolarHBondContact N-O 3.08Å; A710-W722 PolarHBondContact O-N 2.72Å; A710-I724 HydrophobicContact CB-CD1 3.86Å; A710-I724 HydrophobicContact CB-CG1 4.02Å
711	Y	96.5	Very high	93.4	Very high	6 Å²	6	26.6 Å²	26.6	2%	0.024	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.9	175	-57.9	-99.2	0	0	0	107.6	L701 A702 L709 A720 V721 F733 I745 L752 I766	L701-Y711 CarbonylContact C-O 3.53Å; L701-Y711 VanDerWaalsContact CA-O 3.3Å; L701-Y711 WeakPolarHBondContact CA-O 3.47Å; A702-Y711 PolarHBondContact N-O 3.2Å; A702-Y711 PolarHBondContact O-N 2.72Å; L709-Y711 HydrophobicContact CB-CE2 4.24Å; Y711-A720 CarbonylContact C-O 3.58Å; Y711-A720 WeakPolarHBondContact CA-O 3.35Å; Y711-V721 HydrophobicContact CD1-CB 4.46Å; Y711-V721 HydrophobicContact CD1-CG1 4.17Å; Y711-V721 HydrophobicContact CD1-CG2 3.79Å; Y711-V721 HydrophobicContact CE1-CB 4.45Å; Y711-V721 HydrophobicContact CE1-CG1 3.82Å; Y711-V721 HydrophobicContact CE1-CG2 3.84Å; Y711-F733 HydrophobicContact CD1-CE2 4.36Å; Y711-F733 HydrophobicContact CE1-CE2 4.3Å; Y711-I745 HydrophobicContact CD2-CD1 3.66Å; Y711-I745 HydrophobicContact CE2-CD1 3.67Å; Y711-L752 HydrophobicContact CD1-CD1 3.76Å; Y711-L752 HydrophobicContact CD1-CD2 3.67Å; Y711-L752 HydrophobicContact CD1-CG 4.35Å; Y711-L752 HydrophobicContact CD2-CD1 4.47Å; Y711-L752 HydrophobicContact CE1-CD1 4.21Å; Y711-L752 HydrophobicContact CE1-CD2 4.21Å; Y711-L752 HydrophobicContact CG-CD1 3.92Å; Y711-L752 HydrophobicContact CG-CD2 4.45Å; Y711-I766 HydrophobicContact CE1-CG1 4.45Å; Y711-I766 VanDerWaalsContact OH-CG2 3.29Å; Y711-I766 WeakPolarHBondContact OH-CG2 3.44Å
712	S	96.3	Very high	93.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123.3	-178.4	63.5	0	0	0	0	111.9	V719 A720 W722	S712-V719 WeakPolarHBondContact O-CA 3.29Å; S712-A720 PolarHBondContact N-O 3.04Å; S712-A720 PolarHBondContact O-N 2.93Å; S712-W722 PolarHBondContact OG-NE1 3.1Å
713	C	95.5	Very high	93.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	112.5	177.1	-67.4	0	0	0	0	110	C698 Y699 A700 T740 V743	C698-C713 CarbonylContact C-O 3.6Å; C698-C713 WeakPolarHBondContact CA-O 3.48Å; Y699-C713 PolarHBondContact N-O 2.76Å; A700-C713 HydrophobicContact CB-CB 4.24Å; A700-C713 PolarHBondContact O-N 3.17Å; C713-T740 HydrophobicContact CB-CG2 3.67Å; C713-T740 WeakPolarHBondContact CB-O 3.47Å; C713-T740 WeakPolarHBondContact SG-CG2 3.38Å; C713-V743 WeakPolarHBondContact SG-CB 3.44Å; C713-V743 WeakPolarHBondContact SG-CG1 3.49Å
714	C	94.4	Very high	93.4	Very high	4 Å²	4	27.9 Å²	27.9	3%	0.027	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	154.7	-170.5	-68.1	0	0	0	0	112.3	A695 A697 D716 G717 Q718 T740	A695-C714 HydrophobicContact CB-CB 3.83Å; A697-C714 VanDerWaalsContact O-CA 3.29Å; A697-C714 WeakPolarHBondContact O-CA 3.47Å; C714-D716 WeakPolarHBondContact CB-OD1 3.43Å; C714-D716 PolarHBondContact O-N 3.41Å; C714-G717 PolarHBondContact O-N 2.87Å; C714-Q718 WeakPolarHBondContact CB-O 3.39Å; C714-Q718 PolarHBondContact N-O 3.18Å; C714-T740 PolarHBondContact O-N 2.93Å
715	S	93.7	Very high	93.5	Very high	8 Å²	8	34.8 Å²	34.8	6%	0.056	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-4.5	-178.2	61.8	0	0	0	0	114.8	P696 A697 Y699	P696-S715 WeakPolarHBondContact CD-OG 3.16Å; P696-S715 WeakPolarHBondContact CG-OG 3.32Å; A697-S715 WeakPolarHBondContact CA-OG 3.44Å; A697-S715 PolarHBondContact N-OG 3.48Å; A697-S715 VanDerWaalsContact N-OG 3.09Å; A697-S715 PolarHBondContact O-N 3.13Å; A697-S715 VanDerWaalsContact O-N 3.11Å; Y699-S715 VanDerWaalsContact CE2-CB 3.47Å
716	D	90.5	Very high	93.9	Very high	62 Å²	62	34.4 Å²	34.4	33%	0.332	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	2.8	174.7	63.7	-9.4	0	0	0	113	A695 C714 Q718	A695-D716 HydrophobicContact CB-CB 4.1Å; C714-D716 WeakPolarHBondContact CB-OD1 3.43Å; C714-D716 PolarHBondContact O-N 3.41Å; D716-Q718 VanDerWaalsContact C-N 3.34Å; D716-Q718 WeakPolarHBondContact OD1-CB 3.06Å; D716-Q718 PolarHBondContact OD1-N 3.02Å; D716-Q718 WeakPolarHBondContact OD2-CG 3.3Å
717	G	91.3	Very high	94.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	86.5	-2.9	-177	0	0	0	0	0	114.5	C714 D738 T740	C714-G717 PolarHBondContact O-N 2.87Å; G717-D738 WeakPolarHBondContact CA-O 3.43Å; G717-T740 PolarHBondContact O-OG1 3.48Å
718	Q	92.9	Very high	94.4	Very high	41 Å²	41	36.9 Å²	36.9	19%	0.192	19%	0.185	C	C	.	.			trans	-81.9	149.6	177.2	-56.1	-55.2	-30.3	0	0	111.9	C714 D716 F733 H734	C714-Q718 WeakPolarHBondContact CB-O 3.39Å; C714-Q718 PolarHBondContact N-O 3.18Å; D716-Q718 VanDerWaalsContact C-N 3.34Å; D716-Q718 WeakPolarHBondContact OD1-CB 3.06Å; D716-Q718 PolarHBondContact OD1-N 3.02Å; D716-Q718 WeakPolarHBondContact OD2-CG 3.3Å; Q718-F733 PolarHBondContact OE1-O 2.76Å; Q718-H734 PolarHBondContact OE1-CD2 2.85Å; Q718-H734 VanDerWaalsContact OE1-CD2 3.28Å; Q718-H734 VanDerWaalsContact OE1-CG 3.29Å
719	V	95.1	Very high	94.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	96.7	169.2	-173.2	0	0	0	0	109.1	S712 Q732 F733 T740 L752 T754	S712-V719 WeakPolarHBondContact O-CA 3.29Å; V719-Q732 WeakPolarHBondContact O-CA 3.49Å; V719-F733 HydrophobicContact CB-CB 4.25Å; V719-F733 HydrophobicContact CB-CD2 4.43Å; V719-F733 HydrophobicContact CG1-CD2 4.42Å; V719-F733 PolarHBondContact N-O 3.44Å; V719-F733 PolarHBondContact O-N 3.27Å; V719-T740 HydrophobicContact CG2-CG2 3.7Å; V719-L752 HydrophobicContact CG1-CD2 4.05Å; V719-T754 HydrophobicContact CG1-CG2 4.22Å; V719-T754 HydrophobicContact CG2-CG2 4.07Å
720	A	95.2	Very high	94.4	Very high	2 Å²	2	35.2 Å²	35.2	2%	0.017	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	139.2	-176.8	0	0	0	0	0	111.9	Y711 S712 W722 I729 Q732	Y711-A720 CarbonylContact C-O 3.58Å; Y711-A720 WeakPolarHBondContact CA-O 3.35Å; S712-A720 PolarHBondContact N-O 3.04Å; S712-A720 PolarHBondContact O-N 2.93Å; A720-W722 HydrophobicContact CB-CZ2 4.45Å; A720-I729 HydrophobicContact CB-CD1 4.33Å; A720-I729 HydrophobicContact CB-CG2 4.46Å; A720-Q732 HydrophobicContact CB-CG 3.87Å
721	V	95.4	Very high	94.1	Very high	6 Å²	6	39.8 Å²	39.8	4%	0.036	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	117.1	176.1	-169.1	0	0	0	0	108.4	L709 A710 Y711 I729 V730 H731 F733	L709-V721 HydrophobicContact CB-CG1 4.42Å; L709-V721 HydrophobicContact CD1-CG1 4.27Å; A710-V721 CarbonylContact O-C 3.58Å; A710-V721 WeakPolarHBondContact O-CA 3.48Å; Y711-V721 HydrophobicContact CD1-CB 4.46Å; Y711-V721 HydrophobicContact CD1-CG1 4.17Å; Y711-V721 HydrophobicContact CD1-CG2 3.79Å; Y711-V721 HydrophobicContact CE1-CB 4.45Å; Y711-V721 HydrophobicContact CE1-CG1 3.82Å; Y711-V721 HydrophobicContact CE1-CG2 3.84Å; V721-I729 WeakPolarHBondContact O-CA 3.18Å; V721-V730 PolarHBondContact O-N 3.3Å; V721-H731 HydrophobicContact CB-CB 4.2Å; V721-H731 HydrophobicContact CG2-CB 4.11Å; V721-H731 PolarHBondContact N-O 3.1Å; V721-F733 HydrophobicContact CG2-CD2 3.96Å; V721-F733 HydrophobicContact CG2-CE2 3.44Å; V721-F733 VanDerWaalsContact CG2-CE2 3.44Å; V721-F733 HydrophobicContact CG2-CZ 4.33Å
722	W	96.2	Very high	93.9	Very high	6 Å²	6	42.9 Å²	42.9	2%	0.023	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.8	-175	-59.4	85.2	0	0	0	111.3	L691 T692 F693 L709 A710 S712 A720 S728 I729	L691-W722 HydrophobicContact CB-CD2 4.21Å; L691-W722 HydrophobicContact CB-CE3 3.8Å; L691-W722 HydrophobicContact CB-CH2 4.19Å; L691-W722 HydrophobicContact CB-CZ3 3.78Å; L691-W722 HydrophobicContact CD1-CB 4.16Å; L691-W722 HydrophobicContact CD1-CD2 4.17Å; L691-W722 HydrophobicContact CD1-CE3 4.15Å; L691-W722 HydrophobicContact CD1-CG 4.19Å; L691-W722 HydrophobicContact CD2-CE3 4.29Å; L691-W722 HydrophobicContact CG-CE3 4.3Å; T692-W722 WeakPolarHBondContact O-CH2 3.27Å; F693-W722 HydrophobicContact CB-CH2 4.04Å; F693-W722 HydrophobicContact CB-CZ2 3.93Å; F693-W722 HydrophobicContact CD1-CH2 4.19Å; F693-W722 AromaticContact CD1-CZ2 3.74Å; F693-W722 HydrophobicContact CD1-CZ2 3.74Å; F693-W722 HydrophobicContact CG-CZ2 4.2Å; L709-W722 VanDerWaalsContact CA-O 3.24Å; L709-W722 WeakPolarHBondContact CA-O 3.3Å; A710-W722 HydrophobicContact CB-CB 4.31Å; A710-W722 PolarHBondContact N-O 3.08Å; A710-W722 PolarHBondContact O-N 2.72Å; S712-W722 PolarHBondContact OG-NE1 3.1Å; A720-W722 HydrophobicContact CB-CZ2 4.45Å; W722-S728 WeakPolarHBondContact CA-O 3.42Å; W722-I729 HydrophobicContact CD2-CG1 3.97Å; W722-I729 HydrophobicContact CE3-CG1 3.68Å; W722-I729 HydrophobicContact CH2-CD1 3.72Å; W722-I729 HydrophobicContact CH2-CG1 3.5Å; W722-I729 VanDerWaalsContact CH2-CG1 3.5Å; W722-I729 HydrophobicContact CZ2-CD1 3.91Å; W722-I729 HydrophobicContact CZ2-CG1 3.79Å; W722-I729 HydrophobicContact CZ3-CD1 4.17Å; W722-I729 HydrophobicContact CZ3-CG1 3.44Å; W722-I729 VanDerWaalsContact CZ3-CG1 3.44Å
723	D	95.4	Very high	93.8	Very high	32 Å²	32	43.1 Å²	43.1	17%	0.171	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	114.8	158	-174.9	-38.2	0	0	0	108.2	L709 H725 N726 Q727 S728 V730	L709-D723 HydrophobicContact CD2-CB 4.46Å; D723-H725 VanDerWaalsContact C-N 3.31Å; D723-H725 WeakPolarHBondContact OD1-CA 3.43Å; D723-H725 WeakPolarHBondContact OD1-CB 3.38Å; D723-H725 PolarHBondContact OD1-N 3.45Å; D723-N726 HydrophobicContact CB-CB 4.11Å; D723-N726 PolarHBondContact OD1-N 3.4Å; D723-N726 PolarHBondContact OD2-ND2 2.81Å; D723-Q727 VanDerWaalsContact O-CA 3.3Å; D723-Q727 WeakPolarHBondContact O-CA 3.35Å; D723-Q727 PolarHBondContact O-N 2.77Å; D723-S728 PolarHBondContact N-O 2.91Å; D723-S728 PolarHBondContact O-N 2.84Å; D723-V730 HydrophobicContact CB-CG2 3.64Å
724	I	94.5	Very high	93.5	Very high	19 Å²	19	47.4 Å²	47.4	10%	0.097	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-24.2	-175.4	-57.9	170.7	0	0	0	111.4	F661 V678 L703 K708 A710	F661-I724 HydrophobicContact CE1-CD1 3.61Å; F661-I724 HydrophobicContact CE1-CG2 3.95Å; F661-I724 HydrophobicContact CZ-CD1 3.82Å; F661-I724 HydrophobicContact CZ-CG2 3.84Å; V678-I724 HydrophobicContact CG1-CG2 4.32Å; V678-I724 HydrophobicContact CG2-CG2 4.35Å; L703-I724 HydrophobicContact CD2-CD1 3.57Å; K708-I724 WeakPolarHBondContact O-CB 3.45Å; K708-I724 WeakPolarHBondContact O-CG1 3.27Å; K708-I724 PolarHBondContact O-N 2.98Å; A710-I724 HydrophobicContact CB-CD1 3.86Å; A710-I724 HydrophobicContact CB-CG1 4.02Å
725	H	92.9	Very high	93	Very high	159 Å²	159	48.4 Å²	48.4	74%	0.736	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-48.4	177	-176.5	79.9	0	0	0	111.1	D723 Q727	D723-H725 VanDerWaalsContact C-N 3.31Å; D723-H725 WeakPolarHBondContact OD1-CA 3.43Å; D723-H725 WeakPolarHBondContact OD1-CB 3.38Å; D723-H725 PolarHBondContact OD1-N 3.45Å; H725-Q727 VanDerWaalsContact C-N 3.31Å
726	N	94.6	Very high	92.9	Very high	105 Å²	105	48.4 Å²	48.4	56%	0.561	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-8.2	179.6	-67.3	-53.5	0	0	0	113.5	D723 S728	D723-N726 HydrophobicContact CB-CB 4.11Å; D723-N726 PolarHBondContact OD1-N 3.4Å; D723-N726 PolarHBondContact OD2-ND2 2.81Å; N726-S728 VanDerWaalsContact C-N 3.31Å; N726-S728 PolarHBondContact O-N 3.25Å
727	Q	95.1	Very high	93	Very high	105 Å²	105	51.1 Å²	51.1	49%	0.491	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	39.1	176.6	-62.9	172.6	66.3	0	0	113.4	A689 L691 D723 H725	A689-Q727 HydrophobicContact CB-CG 3.94Å; A689-Q727 VanDerWaalsContact CB-OE1 3.25Å; L691-Q727 HydrophobicContact CD2-CB 3.67Å; L691-Q727 HydrophobicContact CD2-CG 3.94Å; D723-Q727 VanDerWaalsContact O-CA 3.3Å; D723-Q727 WeakPolarHBondContact O-CA 3.35Å; D723-Q727 PolarHBondContact O-N 2.77Å; H725-Q727 VanDerWaalsContact C-N 3.31Å
728	S	93.8	Very high	93	Very high	50 Å²	50	53.4 Å²	53.4	35%	0.35	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149.5	-170.1	58.3	0	0	0	0	112.4	W722 D723 N726 V730	W722-S728 WeakPolarHBondContact CA-O 3.42Å; D723-S728 PolarHBondContact N-O 2.91Å; D723-S728 PolarHBondContact O-N 2.84Å; N726-S728 VanDerWaalsContact C-N 3.31Å; N726-S728 PolarHBondContact O-N 3.25Å; S728-V730 PolarHBondContact O-N 3.23Å
729	I	94	Very high	92.9	Very high	65 Å²	65	51.5 Å²	51.5	33%	0.333	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127.4	168.4	-57.7	179.5	0	0	0	108.8	A720 V721 W722 H731 Q732	A720-I729 HydrophobicContact CB-CD1 4.33Å; A720-I729 HydrophobicContact CB-CG2 4.46Å; V721-I729 WeakPolarHBondContact O-CA 3.18Å; W722-I729 HydrophobicContact CD2-CG1 3.97Å; W722-I729 HydrophobicContact CE3-CG1 3.68Å; W722-I729 HydrophobicContact CH2-CD1 3.72Å; W722-I729 HydrophobicContact CH2-CG1 3.5Å; W722-I729 VanDerWaalsContact CH2-CG1 3.5Å; W722-I729 HydrophobicContact CZ2-CD1 3.91Å; W722-I729 HydrophobicContact CZ2-CG1 3.79Å; W722-I729 HydrophobicContact CZ3-CD1 4.17Å; W722-I729 HydrophobicContact CZ3-CG1 3.44Å; W722-I729 VanDerWaalsContact CZ3-CG1 3.44Å; I729-H731 WeakPolarHBondContact CG2-O 3.34Å; I729-Q732 HydrophobicContact CG2-CG 3.92Å
730	V	92.8	Very high	92.9	Very high	70 Å²	70	51.5 Å²	51.5	42%	0.424	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-46.4	175.2	-173.1	0	0	0	0	110.3	V721 D723 S728	V721-V730 PolarHBondContact O-N 3.3Å; D723-V730 HydrophobicContact CB-CG2 3.64Å; S728-V730 PolarHBondContact O-N 3.23Å
731	H	90.4	Very high	92.9	Very high	95 Å²	95	52 Å²	52	44%	0.44	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	160.6	-178.5	-67.1	-35.4	0	0	0	110.7	V721 I729	V721-H731 HydrophobicContact CB-CB 4.2Å; V721-H731 HydrophobicContact CG2-CB 4.11Å; V721-H731 PolarHBondContact N-O 3.1Å; I729-H731 WeakPolarHBondContact CG2-O 3.34Å
732	Q	92.5	Very high	92.9	Very high	72 Å²	72	52.2 Å²	52.2	34%	0.336	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	123.3	170.8	-85.4	165.7	-42.2	0	0	108.5	V719 A720 I729 H734	V719-Q732 WeakPolarHBondContact O-CA 3.49Å; A720-Q732 HydrophobicContact CB-CG 3.87Å; I729-Q732 HydrophobicContact CG2-CG 3.92Å; Q732-H734 PolarHBondContact O-N 2.75Å; Q732-H734 PolarHBondContact O-ND1 3.35Å
733	F	93.1	Very high	92.8	Very high	5 Å²	5	52.4 Å²	52.4	2%	0.022	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	120.4	170.7	-58.6	-81.6	0	0	0	109.1	Y711 Q718 V719 V721 L752 W764 P770	Y711-F733 HydrophobicContact CD1-CE2 4.36Å; Y711-F733 HydrophobicContact CE1-CE2 4.3Å; Q718-F733 PolarHBondContact OE1-O 2.76Å; V719-F733 HydrophobicContact CB-CB 4.25Å; V719-F733 HydrophobicContact CB-CD2 4.43Å; V719-F733 HydrophobicContact CG1-CD2 4.42Å; V719-F733 PolarHBondContact N-O 3.44Å; V719-F733 PolarHBondContact O-N 3.27Å; V721-F733 HydrophobicContact CG2-CD2 3.96Å; V721-F733 HydrophobicContact CG2-CE2 3.44Å; V721-F733 VanDerWaalsContact CG2-CE2 3.44Å; V721-F733 HydrophobicContact CG2-CZ 4.33Å; F733-L752 HydrophobicContact CD2-CD2 3.77Å; F733-L752 HydrophobicContact CE2-CD2 3.62Å; F733-L752 HydrophobicContact CZ-CD2 4.44Å; F733-W764 HydrophobicContact CB-CD2 3.86Å; F733-W764 HydrophobicContact CB-CE3 3.93Å; F733-W764 HydrophobicContact CB-CG 4.46Å; F733-W764 HydrophobicContact CB-CH2 4.08Å; F733-W764 HydrophobicContact CB-CZ2 4.01Å; F733-W764 HydrophobicContact CB-CZ3 4.04Å; F733-W764 HydrophobicContact CD1-CB 3.8Å; F733-W764 AromaticContact CD1-CD2 3.68Å; F733-W764 HydrophobicContact CD1-CD2 3.68Å; F733-W764 AromaticContact CD1-CE3 3.56Å; F733-W764 HydrophobicContact CD1-CE3 3.56Å; F733-W764 AromaticContact CD1-CG 3.81Å; F733-W764 HydrophobicContact CD1-CG 3.81Å; F733-W764 HydrophobicContact CD1-CZ3 4.32Å; F733-W764 HydrophobicContact CE1-CB 3.73Å; F733-W764 HydrophobicContact CE1-CE3 4.48Å; F733-W764 HydrophobicContact CE1-CG 4.24Å; F733-W764 HydrophobicContact CG-CB 4.45Å; F733-W764 AromaticContact CG-CD2 3.94Å; F733-W764 HydrophobicContact CG-CD2 3.94Å; F733-W764 HydrophobicContact CG-CE3 4.1Å; F733-W764 HydrophobicContact CG-CG 4.1Å; F733-W764 HydrophobicContact CZ-CB 4.31Å; F733-P770 WeakPolarHBondContact CA-O 3.3Å; F733-P770 HydrophobicContact CD1-CB 3.66Å; F733-P770 HydrophobicContact CE1-CB 3.81Å; F733-P770 HydrophobicContact CG-CB 4.37Å
734	H	90	Very high	92.7	Very high	89 Å²	89	52.4 Å²	52.4	41%	0.412	28%	0.279	S	S	.	.			trans	-107	121.6	-177	-68	67.8	0	0	0	108.8	Q718 Q732 W764 P770	Q718-H734 PolarHBondContact OE1-CD2 2.85Å; Q718-H734 VanDerWaalsContact OE1-CD2 3.28Å; Q718-H734 VanDerWaalsContact OE1-CG 3.29Å; Q732-H734 PolarHBondContact O-N 2.75Å; Q732-H734 PolarHBondContact O-ND1 3.35Å; H734-W764 WeakPolarHBondContact O-CH2 3.3Å; H734-P770 PolarHBondContact N-O 3.46Å
735	G	83.6	Confident	92.5	Very high	25 Å²	25	52.8 Å²	52.8	26%	0.258	28%	0.281	S	S	.	.			trans	169.9	-22.5	171.3	0	0	0	0	0	117.3	R762	G735-R762 VanDerWaalsContact O-CZ 3.24Å; G735-R762 PolarHBondContact O-NE 3.39Å; G735-R762 PolarHBondContact O-NH2 2.89Å
736	H	91	Very high	92.2	Very high	9 Å²	9	46.6 Å²	46.6	4%	0.042	25%	0.254	C	S	.	.			trans	-69.6	134.1	167.2	-68.1	-76.5	0	0	0	109.2	D738 T740 T754 G756 D758 K760	H736-D738 WeakPolarHBondContact CB-O 3.45Å; H736-T740 PolarHBondContact CD2-OG1 3.08Å; H736-T754 PolarHBondContact NE2-O 3.18Å; H736-T754 PolarHBondContact NE2-OG1 2.92Å; H736-G756 PolarHBondContact CE1-N 3.44Å; H736-D758 VanDerWaalsContact CA-OD2 3.31Å; H736-D758 WeakPolarHBondContact CA-OD2 3.31Å; H736-D758 IonicContact CE1-OD1 2.74Å; H736-D758 IonicContact CG-OD1 3.54Å; H736-D758 IonicContact CG-OD2 3.17Å; H736-D758 IonicContact ND1-OD1 2.74Å; H736-D758 PolarHBondContact ND1-OD1 3.44Å; H736-D758 IonicContact ND1-OD2 2.7Å; H736-D758 PolarHBondContact ND1-OD2 3.29Å; H736-K760 PolarHBondContact CE1-O 3.39Å
737	V	92.6	Very high	91.4	Very high	119 Å²	119	43.5 Å²	43.5	72%	0.721	25%	0.247	S	C	*	.	S	Bend	trans	-88.5	-16.2	-175.4	-174.5	0	0	0	0	112.1	D758	V737-D758 HydrophobicContact CB-CB 4.22Å; V737-D758 PolarHBondContact N-OD2 3.06Å
738	D	91.6	Very high	90.6	Very high	47 Å²	47	42.8 Å²	42.8	25%	0.251	25%	0.247	S	C	.	.	S	Bend	trans	-133.7	173.5	174.4	-165.6	-1.5	0	0	0	107.5	G717 H736 L757 D758	G717-D738 WeakPolarHBondContact CA-O 3.43Å; H736-D738 WeakPolarHBondContact CB-O 3.45Å; D738-L757 HydrophobicContact CB-CB 3.98Å; D738-D758 HydrophobicContact CB-CB 4.36Å
739	G	90.4	Very high	90.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.01	24%	0.24	C	C	.	.			trans	-47.3	138	-172.9	0	0	0	0	0	114.5	L757	G739-L757 VanDerWaalsContact O-CG 3.27Å; G739-L757 WeakPolarHBondContact O-CG 3.45Å; G739-L757 PolarHBondContact O-N 2.93Å
740	T	95	Very high	89.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	119.8	171.9	-54.9	0	0	0	0	108.4	C713 C714 G717 V719 H736 G755	C713-T740 HydrophobicContact CB-CG2 3.67Å; C713-T740 WeakPolarHBondContact CB-O 3.47Å; C713-T740 WeakPolarHBondContact SG-CG2 3.38Å; C714-T740 PolarHBondContact O-N 2.93Å; G717-T740 PolarHBondContact O-OG1 3.48Å; V719-T740 HydrophobicContact CG2-CG2 3.7Å; H736-T740 PolarHBondContact CD2-OG1 3.08Å; T740-G755 CarbonylContact C-O 3.57Å; T740-G755 VanDerWaalsContact CG2-O 3.27Å; T740-G755 WeakPolarHBondContact CG2-O 3.41Å
741	S	95.1	Very high	89.6	Confident	13 Å²	13	39.3 Å²	39.3	9%	0.091	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-37.2	-170.8	60.4	0	0	0	0	113.4	A700 G755 V783	A700-S741 WeakPolarHBondContact CB-O 3.33Å; S741-G755 PolarHBondContact N-O 3.14Å; S741-G755 PolarHBondContact OG-O 3.41Å; S741-G755 VanDerWaalsContact OG-O 3.06Å; S741-V783 WeakPolarHBondContact CB-O 3.33Å; S741-V783 PolarHBondContact OG-O 3.38Å
742	C	95.7	Very high	89.7	Confident	10 Å²	10	34.8 Å²	34.8	7%	0.068	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	154.1	-169	54.3	0	0	0	0	113.3	T754 G755 L786	C742-T754 WeakPolarHBondContact O-CA 3.35Å; C742-G755 PolarHBondContact N-O 3.26Å; C742-G755 PolarHBondContact O-N 3.24Å; C742-L786 HydrophobicContact CB-CG 4.29Å
743	V	95.5	Very high	89.7	Confident	10 Å²	10	31.6 Å²	31.6	6%	0.061	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	142.4	-177.9	54.8	0	0	0	0	112.9	A700 A702 C713 L752 W753 T754	A700-V743 HydrophobicContact CB-CG1 3.91Å; A702-V743 HydrophobicContact CB-CG1 4.1Å; A702-V743 HydrophobicContact CB-CG2 4.13Å; C713-V743 WeakPolarHBondContact SG-CB 3.44Å; C713-V743 WeakPolarHBondContact SG-CG1 3.49Å; V743-L752 HydrophobicContact CG2-CD1 3.46Å; V743-L752 VanDerWaalsContact CG2-CD1 3.46Å; V743-L752 HydrophobicContact CG2-CG 3.98Å; V743-W753 VanDerWaalsContact CA-O 3.26Å; V743-W753 WeakPolarHBondContact CA-O 3.44Å; V743-T754 HydrophobicContact CB-CG2 4.3Å; V743-T754 HydrophobicContact CG2-CG2 4.04Å
744	E	93.5	Very high	89.9	Confident	32 Å²	32	31.3 Å²	31.3	15%	0.15	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	160.9	164.8	-75.5	-73	-165.1	0	0	110.2	W753 L786 L788 R916	E744-W753 PolarHBondContact N-O 2.97Å; E744-W753 PolarHBondContact O-N 2.94Å; E744-L786 HydrophobicContact CB-CD1 3.68Å; E744-L786 HydrophobicContact CG-CD1 3.78Å; E744-L788 HydrophobicContact CB-CD1 3.68Å; E744-L788 HydrophobicContact CB-CG 3.9Å; E744-R916 IonicContact OE1-CZ 2.64Å; E744-R916 IonicContact OE1-NH1 2.77Å; E744-R916 PolarHBondContact OE1-NH1 3.48Å; E744-R916 IonicContact OE2-NH1 3.45Å
745	I	89.7	Confident	90.1	Very high	28 Å²	28	27.1 Å²	27.1	14%	0.144	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.5	178.3	-62.7	163.3	0	0	0	108.4	A702 L703 Y711 L752 I766	A702-I745 HydrophobicContact CB-CD1 3.66Å; A702-I745 HydrophobicContact CB-CG1 4.02Å; L703-I745 VanDerWaalsContact O-CD1 3.28Å; L703-I745 WeakPolarHBondContact O-CD1 3.33Å; Y711-I745 HydrophobicContact CD2-CD1 3.66Å; Y711-I745 HydrophobicContact CE2-CD1 3.67Å; I745-L752 HydrophobicContact CD1-CD1 4.34Å; I745-L752 HydrophobicContact CG1-CD1 3.54Å; I745-I766 HydrophobicContact CG2-CD1 4.07Å
746	T	85.8	Confident	90.5	Very high	28 Å²	28	25.9 Å²	25.9	17%	0.172	15%	0.154	C	C	.	.			trans	-66.6	149.5	174.9	49	0	0	0	0	111.9	D748 G749 R751 L788	T746-D748 VanDerWaalsContact CB-OD1 3.23Å; T746-D748 WeakPolarHBondContact CB-OD1 3.22Å; T746-D748 PolarHBondContact O-N 2.89Å; T746-D748 PolarHBondContact OG1-OD1 3.12Å; T746-G749 PolarHBondContact O-N 3.12Å; T746-R751 HydrophobicContact CG2-CB 3.77Å; T746-R751 HydrophobicContact CG2-CG 4.45Å; T746-R751 PolarHBondContact N-O 2.78Å; T746-R751 WeakPolarHBondContact OG1-CB 3.45Å; T746-R751 PolarHBondContact OG1-N 3.26Å; T746-R751 VanDerWaalsContact OG1-N 3.13Å; T746-R751 PolarHBondContact OG1-O 3.42Å; T746-L788 HydrophobicContact CG2-CD1 4.11Å
747	G	78.2	Confident	90.7	Very high	40 Å²	40	25.7 Å²	25.7	41%	0.412	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-10.3	-176.3	0	0	0	0	0	116
748	D	79	Confident	90.7	Very high	91 Å²	91	21.1 Å²	21.1	49%	0.487	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-10.1	172.7	76.4	-33.1	0	0	0	113.8	T746 N750	T746-D748 VanDerWaalsContact CB-OD1 3.23Å; T746-D748 WeakPolarHBondContact CB-OD1 3.22Å; T746-D748 PolarHBondContact O-N 2.89Å; T746-D748 PolarHBondContact OG1-OD1 3.12Å; D748-N750 PolarHBondContact O-N 3.05Å; D748-N750 PolarHBondContact O-ND2 3.35Å; D748-N750 PolarHBondContact OD1-N 3.25Å; D748-N750 WeakPolarHBondContact OD2-CB 3.41Å; D748-N750 PolarHBondContact OD2-ND2 3.07Å
749	G	84.1	Confident	90.8	Very high	20 Å²	20	22.1 Å²	22.1	21%	0.206	13%	0.128	C	C	.	.	S	Bend	trans	74.2	13.4	179.9	0	0	0	0	0	116	T746	T746-G749 PolarHBondContact O-N 3.12Å
750	N	85.5	Confident	91.1	Very high	43 Å²	43	23.5 Å²	23.5	23%	0.23	13%	0.134	C	C	.	.	S	Bend	trans	-107.4	-8.9	-177.1	-56.1	-62.4	0	0	0	114.9	D748 I766 R767	D748-N750 PolarHBondContact O-N 3.05Å; D748-N750 PolarHBondContact O-ND2 3.35Å; D748-N750 PolarHBondContact OD1-N 3.25Å; D748-N750 WeakPolarHBondContact OD2-CB 3.41Å; D748-N750 PolarHBondContact OD2-ND2 3.07Å; N750-I766 PolarHBondContact O-N 2.9Å; N750-R767 PolarHBondContact OD1-NE 3.39Å; N750-R767 PolarHBondContact OD1-NH2 2.91Å
751	R	88.2	Confident	91.1	Very high	49 Å²	49	23.5 Å²	23.5	19%	0.185	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	138	175.2	-56.3	-71.5	176.3	-110	13.3	111.7	T746 W764 D765	T746-R751 HydrophobicContact CG2-CB 3.77Å; T746-R751 HydrophobicContact CG2-CG 4.45Å; T746-R751 PolarHBondContact N-O 2.78Å; T746-R751 WeakPolarHBondContact OG1-CB 3.45Å; T746-R751 PolarHBondContact OG1-N 3.26Å; T746-R751 VanDerWaalsContact OG1-N 3.13Å; T746-R751 PolarHBondContact OG1-O 3.42Å; R751-W764 VanDerWaalsContact CA-O 3.31Å; R751-W764 WeakPolarHBondContact CA-O 3.46Å; R751-D765 IonicContact CZ-OD2 3.43Å; R751-D765 IonicContact NH1-OD1 3.1Å; R751-D765 IonicContact NH1-OD2 2.66Å; R751-D765 PolarHBondContact NH1-OD2 3.44Å; R751-D765 IonicContact NH2-OD2 2.76Å
752	L	92.9	Very high	91.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	133.9	169.2	-169.4	72.5	0	0	0	108.3	Y711 V719 F733 V743 I745 T754 C763 W764 I766	Y711-L752 HydrophobicContact CD1-CD1 3.76Å; Y711-L752 HydrophobicContact CD1-CD2 3.67Å; Y711-L752 HydrophobicContact CD1-CG 4.35Å; Y711-L752 HydrophobicContact CD2-CD1 4.47Å; Y711-L752 HydrophobicContact CE1-CD1 4.21Å; Y711-L752 HydrophobicContact CE1-CD2 4.21Å; Y711-L752 HydrophobicContact CG-CD1 3.92Å; Y711-L752 HydrophobicContact CG-CD2 4.45Å; V719-L752 HydrophobicContact CG1-CD2 4.05Å; F733-L752 HydrophobicContact CD2-CD2 3.77Å; F733-L752 HydrophobicContact CE2-CD2 3.62Å; F733-L752 HydrophobicContact CZ-CD2 4.44Å; V743-L752 HydrophobicContact CG2-CD1 3.46Å; V743-L752 VanDerWaalsContact CG2-CD1 3.46Å; V743-L752 HydrophobicContact CG2-CG 3.98Å; I745-L752 HydrophobicContact CD1-CD1 4.34Å; I745-L752 HydrophobicContact CG1-CD1 3.54Å; L752-T754 HydrophobicContact CD2-CG2 3.98Å; L752-T754 HydrophobicContact CG-CG2 4.01Å; L752-C763 WeakPolarHBondContact O-CA 3.45Å; L752-W764 HydrophobicContact CB-CB 4.25Å; L752-W764 PolarHBondContact N-O 3.41Å; L752-W764 PolarHBondContact O-N 3.14Å; L752-I766 HydrophobicContact CB-CD1 4.15Å; L752-I766 HydrophobicContact CB-CG1 3.9Å
753	W	93.9	Very high	90.9	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.015	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126	175.3	-77.4	92.2	0	0	0	109.6	V743 E744 V761 R762 C763 Y775 I777 L786 L788 L846 I860	V743-W753 VanDerWaalsContact CA-O 3.26Å; V743-W753 WeakPolarHBondContact CA-O 3.44Å; E744-W753 PolarHBondContact N-O 2.97Å; E744-W753 PolarHBondContact O-N 2.94Å; W753-V761 HydrophobicContact CE3-CG1 3.56Å; W753-V761 HydrophobicContact CZ3-CG1 3.86Å; W753-R762 WeakPolarHBondContact CA-O 3.16Å; W753-C763 HydrophobicContact CD2-CB 4.1Å; W753-C763 HydrophobicContact CE3-CB 3.96Å; W753-C763 HydrophobicContact CH2-CB 4.38Å; W753-C763 HydrophobicContact CZ2-CB 4.45Å; W753-C763 HydrophobicContact CZ3-CB 4.1Å; W753-Y775 AromaticContact CH2-CE2 3.53Å; W753-Y775 HydrophobicContact CH2-CE2 3.53Å; W753-Y775 AromaticContact CH2-CZ 3.75Å; W753-Y775 WeakPolarHBondContact CH2-OH 3.39Å; W753-Y775 HydrophobicContact CZ2-CE2 4.27Å; W753-Y775 WeakPolarHBondContact CZ2-OH 3.48Å; W753-Y775 AromaticContact CZ3-CE2 3.79Å; W753-Y775 HydrophobicContact CZ3-CE2 3.79Å; W753-I777 HydrophobicContact CZ3-CD1 4.44Å; W753-L786 HydrophobicContact CB-CD1 4.34Å; W753-L788 HydrophobicContact CB-CD1 4.34Å; W753-L788 HydrophobicContact CD2-CD2 4.36Å; W753-L788 HydrophobicContact CG-CD1 4.16Å; W753-L788 HydrophobicContact CG-CD2 4.02Å; W753-L846 HydrophobicContact CE3-CD1 4.45Å; W753-L846 HydrophobicContact CE3-CD2 4.09Å; W753-L846 HydrophobicContact CH2-CD2 3.97Å; W753-L846 HydrophobicContact CZ3-CD2 3.62Å; W753-I860 HydrophobicContact CH2-CB 4.48Å; W753-I860 HydrophobicContact CH2-CG2 3.57Å; W753-I860 HydrophobicContact CZ2-CB 4.01Å; W753-I860 HydrophobicContact CZ2-CD1 3.72Å; W753-I860 HydrophobicContact CZ2-CG1 4.44Å; W753-I860 HydrophobicContact CZ2-CG2 3.57Å
754	T	96.1	Very high	90.8	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.8	-175.5	62.4	0	0	0	0	110.9	V719 H736 C742 V743 L752 V761 R762 W764	V719-T754 HydrophobicContact CG1-CG2 4.22Å; V719-T754 HydrophobicContact CG2-CG2 4.07Å; H736-T754 PolarHBondContact NE2-O 3.18Å; H736-T754 PolarHBondContact NE2-OG1 2.92Å; C742-T754 WeakPolarHBondContact O-CA 3.35Å; V743-T754 HydrophobicContact CB-CG2 4.3Å; V743-T754 HydrophobicContact CG2-CG2 4.04Å; L752-T754 HydrophobicContact CD2-CG2 3.98Å; L752-T754 HydrophobicContact CG-CG2 4.01Å; T754-V761 CarbonylContact O-C 3.52Å; T754-V761 VanDerWaalsContact O-CA 3.28Å; T754-V761 WeakPolarHBondContact O-CA 3.47Å; T754-R762 PolarHBondContact N-O 2.88Å; T754-R762 PolarHBondContact O-N 3.32Å; T754-W764 PolarHBondContact OG1-NE1 2.91Å
755	G	94.5	Very high	90.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.6	176	0	0	0	0	0	110.6	T740 S741 C742 L786	T740-G755 CarbonylContact C-O 3.57Å; T740-G755 VanDerWaalsContact CG2-O 3.27Å; T740-G755 WeakPolarHBondContact CG2-O 3.41Å; S741-G755 PolarHBondContact N-O 3.14Å; S741-G755 PolarHBondContact OG-O 3.41Å; S741-G755 VanDerWaalsContact OG-O 3.06Å; C742-G755 PolarHBondContact N-O 3.26Å; C742-G755 PolarHBondContact O-N 3.24Å; G755-L786 VanDerWaalsContact N-CD2 3.32Å
756	G	93	Very high	90.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	159.4	-176.8	0	0	0	0	0	114.3	H736 D758 H759 K760 V783	H736-G756 PolarHBondContact CE1-N 3.44Å; G756-D758 WeakPolarHBondContact CA-OD1 3.38Å; G756-D758 PolarHBondContact O-N 3.32Å; G756-H759 PolarHBondContact O-N 3.14Å; G756-K760 PolarHBondContact N-O 3.35Å; G756-V783 PolarHBondContact O-N 2.94Å
757	L	94.4	Very high	90.5	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.021	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-14.8	168.7	-57.4	168.9	0	0	0	111.5	A269 D738 G739 H759 Q782 F784	A269-L757 WeakPolarHBondContact O-CD1 3.41Å; D738-L757 HydrophobicContact CB-CB 3.98Å; G739-L757 VanDerWaalsContact O-CG 3.27Å; G739-L757 WeakPolarHBondContact O-CG 3.45Å; G739-L757 PolarHBondContact O-N 2.93Å; L757-H759 PolarHBondContact O-CD2 3.44Å; L757-H759 VanDerWaalsContact O-CD2 3.26Å; L757-H759 PolarHBondContact O-N 2.95Å; L757-Q782 HydrophobicContact CD2-CB 4.22Å; L757-F784 HydrophobicContact CD2-CD1 4.06Å; L757-F784 HydrophobicContact CD2-CE1 3.78Å
758	D	92.6	Very high	90.6	Very high	23 Å²	23	31.7 Å²	31.7	12%	0.123	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	19.5	168.5	75.3	-24.9	0	0	0	114.2	H736 V737 D738 G756 K760	H736-D758 VanDerWaalsContact CA-OD2 3.31Å; H736-D758 WeakPolarHBondContact CA-OD2 3.31Å; H736-D758 IonicContact CE1-OD1 2.74Å; H736-D758 IonicContact CG-OD1 3.54Å; H736-D758 IonicContact CG-OD2 3.17Å; H736-D758 IonicContact ND1-OD1 2.74Å; H736-D758 PolarHBondContact ND1-OD1 3.44Å; H736-D758 IonicContact ND1-OD2 2.7Å; H736-D758 PolarHBondContact ND1-OD2 3.29Å; V737-D758 HydrophobicContact CB-CB 4.22Å; V737-D758 PolarHBondContact N-OD2 3.06Å; D738-D758 HydrophobicContact CB-CB 4.36Å; G756-D758 WeakPolarHBondContact CA-OD1 3.38Å; G756-D758 PolarHBondContact O-N 3.32Å; D758-K760 PolarHBondContact O-N 3.5Å; D758-K760 VanDerWaalsContact O-N 3.13Å; D758-K760 PolarHBondContact OD1-N 2.88Å
759	H	94.5	Very high	90.6	Very high	69 Å²	69	32.5 Å²	32.5	32%	0.319	16%	0.163	S	C	.	.	S	Bend	trans	61.2	10.3	-178.4	-45.7	164.3	0	0	0	115.3	G756 L757 F779 S781 Q782	G756-H759 PolarHBondContact O-N 3.14Å; L757-H759 PolarHBondContact O-CD2 3.44Å; L757-H759 VanDerWaalsContact O-CD2 3.26Å; L757-H759 PolarHBondContact O-N 2.95Å; H759-F779 WeakPolarHBondContact CB-O 3.46Å; H759-F779 PolarHBondContact O-N 3.09Å; H759-S781 VanDerWaalsContact CD2-C 3.41Å; H759-Q782 PolarHBondContact CD2-N 3Å
760	K	95.6	Very high	90.2	Very high	30 Å²	30	32.8 Å²	32.8	13%	0.13	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	144.3	-175	-70.2	165.2	-172.9	-77.4	0	112	H736 G756 D758 R762 H776 I777 E778	H736-K760 PolarHBondContact CE1-O 3.39Å; G756-K760 PolarHBondContact N-O 3.35Å; D758-K760 PolarHBondContact O-N 3.5Å; D758-K760 VanDerWaalsContact O-N 3.13Å; D758-K760 PolarHBondContact OD1-N 2.88Å; K760-R762 HydrophobicContact CB-CG 4.44Å; K760-H776 PolarHBondContact NZ-CD2 3.46Å; K760-H776 PolarHBondContact NZ-NE2 3.25Å; K760-I777 CarbonylContact C-O 3.58Å; K760-I777 WeakPolarHBondContact CA-O 3.08Å; K760-E778 WeakPolarHBondContact CE-OE2 3.35Å; K760-E778 HydrophobicContact CG-CB 4.25Å; K760-E778 HydrophobicContact CG-CG 4.12Å; K760-E778 IonicContact NZ-OE2 2.66Å; K760-E778 PolarHBondContact NZ-OE2 3.07Å
761	V	95.7	Very high	89.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.6	156.7	177.5	0	0	0	0	108	W753 T754 H776 I777 F779 V783 L786 L846 V848	W753-V761 HydrophobicContact CE3-CG1 3.56Å; W753-V761 HydrophobicContact CZ3-CG1 3.86Å; T754-V761 CarbonylContact O-C 3.52Å; T754-V761 VanDerWaalsContact O-CA 3.28Å; T754-V761 WeakPolarHBondContact O-CA 3.47Å; V761-H776 CarbonylContact O-C 3.46Å; V761-H776 WeakPolarHBondContact O-CA 3.12Å; V761-H776 WeakPolarHBondContact O-CB 3.49Å; V761-I777 PolarHBondContact N-O 3.45Å; V761-I777 PolarHBondContact O-N 3.47Å; V761-F779 HydrophobicContact CB-CE2 3.92Å; V761-F779 HydrophobicContact CG2-CD2 4.17Å; V761-F779 HydrophobicContact CG2-CE2 3.56Å; V761-F779 HydrophobicContact CG2-CZ 4.38Å; V761-V783 HydrophobicContact CG2-CG1 4.09Å; V761-V783 HydrophobicContact CG2-CG2 3.9Å; V761-L786 HydrophobicContact CG1-CD2 4.41Å; V761-L846 HydrophobicContact CG1-CD2 4.12Å; V761-V848 HydrophobicContact CG2-CG1 3.93Å; V761-V848 HydrophobicContact CG2-CG2 4.15Å
762	R	94.4	Very high	89.2	Confident	20 Å²	20	40.4 Å²	40.4	8%	0.075	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	145.7	-179.3	-61.4	-176.4	170.7	-88.2	10	110.4	G735 W753 T754 K760 W764 D773 H776	G735-R762 VanDerWaalsContact O-CZ 3.24Å; G735-R762 PolarHBondContact O-NE 3.39Å; G735-R762 PolarHBondContact O-NH2 2.89Å; W753-R762 WeakPolarHBondContact CA-O 3.16Å; T754-R762 PolarHBondContact N-O 2.88Å; T754-R762 PolarHBondContact O-N 3.32Å; K760-R762 HydrophobicContact CB-CG 4.44Å; R762-W764 HydrophobicContact CB-CZ2 3.9Å; R762-W764 VanDerWaalsContact CD-CZ2 3.46Å; R762-W764 HydrophobicContact CG-CZ2 4.31Å; R762-D773 HydrophobicContact CB-CB 4.37Å; R762-D773 IonicContact NH1-OD1 2.66Å; R762-D773 PolarHBondContact NH1-OD1 3.36Å; R762-D773 VanDerWaalsContact NH1-OD1 3.1Å; R762-D773 IonicContact NH1-OD2 3.86Å; R762-D773 PolarHBondContact NH1-OD2 2.95Å; R762-H776 HydrophobicContact CB-CB 4.43Å; R762-H776 HydrophobicContact CG-CB 3.86Å
763	C	92.8	Very high	88.7	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.4	171.1	-172.4	0	0	0	0	110.2	L752 W753 V774 Y775	L752-C763 WeakPolarHBondContact O-CA 3.45Å; W753-C763 HydrophobicContact CD2-CB 4.1Å; W753-C763 HydrophobicContact CE3-CB 3.96Å; W753-C763 HydrophobicContact CH2-CB 4.38Å; W753-C763 HydrophobicContact CZ2-CB 4.45Å; W753-C763 HydrophobicContact CZ3-CB 4.1Å; C763-V774 PolarHBondContact O-N 2.73Å; C763-Y775 HydrophobicContact CB-CD1 4.35Å; C763-Y775 HydrophobicContact CB-CD2 4.13Å; C763-Y775 HydrophobicContact CB-CE1 3.7Å; C763-Y775 HydrophobicContact CB-CE2 3.45Å; C763-Y775 VanDerWaalsContact CB-CE2 3.45Å; C763-Y775 VanDerWaalsContact CB-OH 3.31Å; C763-Y775 WeakPolarHBondContact CB-OH 3.39Å; C763-Y775 PolarHBondContact N-O 3.2Å; C763-Y775 PolarHBondContact SG-OH 3.48Å
764	W	92	Very high	88.2	Confident	1 Å²	1	45 Å²	45	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	143.9	-177.3	-44.1	88.4	0	0	0	110.6	F733 H734 R751 L752 T754 R762 D773	F733-W764 HydrophobicContact CB-CD2 3.86Å; F733-W764 HydrophobicContact CB-CE3 3.93Å; F733-W764 HydrophobicContact CB-CG 4.46Å; F733-W764 HydrophobicContact CB-CH2 4.08Å; F733-W764 HydrophobicContact CB-CZ2 4.01Å; F733-W764 HydrophobicContact CB-CZ3 4.04Å; F733-W764 HydrophobicContact CD1-CB 3.8Å; F733-W764 AromaticContact CD1-CD2 3.68Å; F733-W764 HydrophobicContact CD1-CD2 3.68Å; F733-W764 AromaticContact CD1-CE3 3.56Å; F733-W764 HydrophobicContact CD1-CE3 3.56Å; F733-W764 AromaticContact CD1-CG 3.81Å; F733-W764 HydrophobicContact CD1-CG 3.81Å; F733-W764 HydrophobicContact CD1-CZ3 4.32Å; F733-W764 HydrophobicContact CE1-CB 3.73Å; F733-W764 HydrophobicContact CE1-CE3 4.48Å; F733-W764 HydrophobicContact CE1-CG 4.24Å; F733-W764 HydrophobicContact CG-CB 4.45Å; F733-W764 AromaticContact CG-CD2 3.94Å; F733-W764 HydrophobicContact CG-CD2 3.94Å; F733-W764 HydrophobicContact CG-CE3 4.1Å; F733-W764 HydrophobicContact CG-CG 4.1Å; F733-W764 HydrophobicContact CZ-CB 4.31Å; H734-W764 WeakPolarHBondContact O-CH2 3.3Å; R751-W764 VanDerWaalsContact CA-O 3.31Å; R751-W764 WeakPolarHBondContact CA-O 3.46Å; L752-W764 HydrophobicContact CB-CB 4.25Å; L752-W764 PolarHBondContact N-O 3.41Å; L752-W764 PolarHBondContact O-N 3.14Å; T754-W764 PolarHBondContact OG1-NE1 2.91Å; R762-W764 HydrophobicContact CB-CZ2 3.9Å; R762-W764 VanDerWaalsContact CD-CZ2 3.46Å; R762-W764 HydrophobicContact CG-CZ2 4.31Å; W764-D773 HydrophobicContact CD2-CB 4.33Å; W764-D773 HydrophobicContact CE3-CB 3.95Å; W764-D773 HydrophobicContact CH2-CB 4.23Å; W764-D773 HydrophobicContact CZ3-CB 3.9Å
765	D	89.5	Confident	87.7	Confident	46 Å²	46	47 Å²	47	25%	0.246	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119	165.1	-170.2	-39.7	0	0	0	108.4	R751 R767 G768 V774	R751-D765 IonicContact CZ-OD2 3.43Å; R751-D765 IonicContact NH1-OD1 3.1Å; R751-D765 IonicContact NH1-OD2 2.66Å; R751-D765 PolarHBondContact NH1-OD2 3.44Å; R751-D765 IonicContact NH2-OD2 2.76Å; D765-R767 PolarHBondContact O-N 3.45Å; D765-R767 WeakPolarHBondContact OD1-CA 3.32Å; D765-R767 PolarHBondContact OD1-N 3.3Å; D765-G768 PolarHBondContact O-N 3.16Å; D765-G768 PolarHBondContact OD1-N 3.06Å; D765-V774 HydrophobicContact CB-CG2 4.01Å
766	I	88.2	Confident	87.6	Confident	31 Å²	31	49.8 Å²	49.8	16%	0.159	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.6	-177.7	-72.5	170.8	0	0	0	112.1	Y711 I745 N750 L752	Y711-I766 HydrophobicContact CE1-CG1 4.45Å; Y711-I766 VanDerWaalsContact OH-CG2 3.29Å; Y711-I766 WeakPolarHBondContact OH-CG2 3.44Å; I745-I766 HydrophobicContact CG2-CD1 4.07Å; N750-I766 PolarHBondContact O-N 2.9Å; L752-I766 HydrophobicContact CB-CD1 4.15Å; L752-I766 HydrophobicContact CB-CG1 3.9Å
767	R	85.3	Confident	87.5	Confident	198 Å²	198	50.3 Å²	50.3	75%	0.747	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-0.5	177.4	-52.7	177.2	-168.1	-99.2	0.3	112.7	N750 D765	N750-R767 PolarHBondContact OD1-NE 3.39Å; N750-R767 PolarHBondContact OD1-NH2 2.91Å; D765-R767 PolarHBondContact O-N 3.45Å; D765-R767 WeakPolarHBondContact OD1-CA 3.32Å; D765-R767 PolarHBondContact OD1-N 3.3Å
768	G	81.4	Confident	87.5	Confident	37 Å²	37	54.4 Å²	54.4	38%	0.381	27%	0.269	S	S	.	.	S	Bend	trans	-88	-160.3	-175.9	0	0	0	0	0	113.6	D765 P770	D765-G768 PolarHBondContact O-N 3.16Å; D765-G768 PolarHBondContact OD1-N 3.06Å; G768-P770 WeakPolarHBondContact O-CD 3.2Å
769	N	77.5	Confident	87.5	Confident	107 Å²	107	54 Å²	54	57%	0.572	27%	0.267	S	S	*	.			trans	-80.1	116.2	174	-179.4	-11.7	0	0	0	109.8	S771 R772	N769-S771 PolarHBondContact O-N 2.94Å; N769-S771 WeakPolarHBondContact OD1-CB 3.19Å; N769-S771 PolarHBondContact OD1-N 2.93Å; N769-R772 PolarHBondContact O-N 3.37Å
770	P	75.3	Confident	87.2	Confident	27 Å²	27	56.5 Å²	56.5	18%	0.175	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.2	-176.5	30.5	-36.7	0	0	0	114	F733 H734 G768 R772	F733-P770 WeakPolarHBondContact CA-O 3.3Å; F733-P770 HydrophobicContact CD1-CB 3.66Å; F733-P770 HydrophobicContact CE1-CB 3.81Å; F733-P770 HydrophobicContact CG-CB 4.37Å; H734-P770 PolarHBondContact N-O 3.46Å; G768-P770 WeakPolarHBondContact O-CD 3.2Å; P770-R772 VanDerWaalsContact C-N 3.28Å; P770-R772 PolarHBondContact O-N 2.9Å
771	S	76.2	Confident	87.1	Confident	84 Å²	84	56.2 Å²	56.2	59%	0.587	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	7	176.3	-51.5	0	0	0	0	114	N769	N769-S771 PolarHBondContact O-N 2.94Å; N769-S771 WeakPolarHBondContact OD1-CB 3.19Å; N769-S771 PolarHBondContact OD1-N 2.93Å
772	R	78.6	Confident	87	Confident	167 Å²	167	57.8 Å²	57.8	63%	0.63	29%	0.285	S	S	*	.	S	Bend	trans	-146.7	123.3	178.2	179.9	170.4	177.5	176.5	0.4	111.5	N769 P770	N769-R772 PolarHBondContact O-N 3.37Å; P770-R772 VanDerWaalsContact C-N 3.28Å; P770-R772 PolarHBondContact O-N 2.9Å
773	D	81.4	Confident	87.1	Confident	30 Å²	30	56.8 Å²	56.8	16%	0.16	28%	0.282	C	S	.	.			trans	-66.8	144.5	167.7	54.8	-51.4	0	0	0	111.1	R762 W764 Y775 H776	R762-D773 HydrophobicContact CB-CB 4.37Å; R762-D773 IonicContact NH1-OD1 2.66Å; R762-D773 PolarHBondContact NH1-OD1 3.36Å; R762-D773 VanDerWaalsContact NH1-OD1 3.1Å; R762-D773 IonicContact NH1-OD2 3.86Å; R762-D773 PolarHBondContact NH1-OD2 2.95Å; W764-D773 HydrophobicContact CD2-CB 4.33Å; W764-D773 HydrophobicContact CE3-CB 3.95Å; W764-D773 HydrophobicContact CH2-CB 4.23Å; W764-D773 HydrophobicContact CZ3-CB 3.9Å; D773-Y775 VanDerWaalsContact C-N 3.26Å; D773-H776 WeakPolarHBondContact OD2-CB 3.19Å; D773-H776 IonicContact OD2-CE1 3.48Å; D773-H776 IonicContact OD2-CG 2.7Å; D773-H776 IonicContact OD2-ND1 3.56Å; D773-H776 PolarHBondContact OD2-ND1 2.76Å
774	V	83.6	Confident	87.1	Confident	70 Å²	70	58.8 Å²	58.8	42%	0.424	29%	0.29	S	S	.	.	S	Bend	trans	-65.3	-39.5	174.8	-170	0	0	0	0	109.1	C763 D765	C763-V774 PolarHBondContact O-N 2.73Å; D765-V774 HydrophobicContact CB-CG2 4.01Å
775	Y	86.1	Confident	87.3	Confident	44 Å²	44	59.1 Å²	59.1	17%	0.173	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	171.3	168.7	55.9	-89.6	0	0	0	109.2	W753 C763 D773 G864 P865	W753-Y775 AromaticContact CH2-CE2 3.53Å; W753-Y775 HydrophobicContact CH2-CE2 3.53Å; W753-Y775 AromaticContact CH2-CZ 3.75Å; W753-Y775 WeakPolarHBondContact CH2-OH 3.39Å; W753-Y775 HydrophobicContact CZ2-CE2 4.27Å; W753-Y775 WeakPolarHBondContact CZ2-OH 3.48Å; W753-Y775 AromaticContact CZ3-CE2 3.79Å; W753-Y775 HydrophobicContact CZ3-CE2 3.79Å; C763-Y775 HydrophobicContact CB-CD1 4.35Å; C763-Y775 HydrophobicContact CB-CD2 4.13Å; C763-Y775 HydrophobicContact CB-CE1 3.7Å; C763-Y775 HydrophobicContact CB-CE2 3.45Å; C763-Y775 VanDerWaalsContact CB-CE2 3.45Å; C763-Y775 VanDerWaalsContact CB-OH 3.31Å; C763-Y775 WeakPolarHBondContact CB-OH 3.39Å; C763-Y775 PolarHBondContact N-O 3.2Å; C763-Y775 PolarHBondContact SG-OH 3.48Å; D773-Y775 VanDerWaalsContact C-N 3.26Å; Y775-G864 WeakPolarHBondContact OH-CA 3.43Å; Y775-P865 HydrophobicContact CD2-CG 4.09Å; Y775-P865 VanDerWaalsContact CE2-CD 3.42Å; Y775-P865 HydrophobicContact CE2-CG 3.74Å; Y775-P865 VanDerWaalsContact CZ-CD 3.4Å
776	H	91.3	Very high	87.6	Confident	57 Å²	57	57.3 Å²	57.3	26%	0.264	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	162.8	167	60.2	-93.9	0	0	0	112.1	K760 V761 R762 D773	K760-H776 PolarHBondContact NZ-CD2 3.46Å; K760-H776 PolarHBondContact NZ-NE2 3.25Å; V761-H776 CarbonylContact O-C 3.46Å; V761-H776 WeakPolarHBondContact O-CA 3.12Å; V761-H776 WeakPolarHBondContact O-CB 3.49Å; R762-H776 HydrophobicContact CB-CB 4.43Å; R762-H776 HydrophobicContact CG-CB 3.86Å; D773-H776 WeakPolarHBondContact OD2-CB 3.19Å; D773-H776 IonicContact OD2-CE1 3.48Å; D773-H776 IonicContact OD2-CG 2.7Å; D773-H776 IonicContact OD2-ND1 3.56Å; D773-H776 PolarHBondContact OD2-ND1 2.76Å
777	I	91.5	Very high	87.8	Confident	12 Å²	12	55.9 Å²	55.9	6%	0.062	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.2	174.7	-52.3	172	0	0	0	106.3	W753 K760 V761 F779 L846 L858 P865 F870	W753-I777 HydrophobicContact CZ3-CD1 4.44Å; K760-I777 CarbonylContact C-O 3.58Å; K760-I777 WeakPolarHBondContact CA-O 3.08Å; V761-I777 PolarHBondContact N-O 3.45Å; V761-I777 PolarHBondContact O-N 3.47Å; I777-F779 HydrophobicContact CB-CE2 3.91Å; I777-F779 HydrophobicContact CB-CZ 4.2Å; I777-F779 HydrophobicContact CG2-CD2 4.46Å; I777-F779 HydrophobicContact CG2-CE1 4.34Å; I777-F779 HydrophobicContact CG2-CE2 3.67Å; I777-F779 HydrophobicContact CG2-CZ 3.61Å; I777-L846 HydrophobicContact CD1-CD2 4.4Å; I777-L858 HydrophobicContact CD1-CD2 4.32Å; I777-L858 HydrophobicContact CG2-CD2 4.44Å; I777-P865 HydrophobicContact CD1-CG 4.18Å; I777-F870 HydrophobicContact CD1-CE2 4.17Å; I777-F870 HydrophobicContact CD1-CZ 3.91Å; I777-F870 HydrophobicContact CG1-CE2 4.26Å; I777-F870 HydrophobicContact CG1-CZ 4.21Å; I777-F870 HydrophobicContact CG2-CE1 4.2Å; I777-F870 HydrophobicContact CG2-CZ 4.07Å
778	E	93.4	Very high	88.1	Confident	89 Å²	89	47.4 Å²	47.4	42%	0.416	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.7	-179.8	-167.8	175	132.6	0	0	110	K760 Y874	K760-E778 WeakPolarHBondContact CE-OE2 3.35Å; K760-E778 HydrophobicContact CG-CB 4.25Å; K760-E778 HydrophobicContact CG-CG 4.12Å; K760-E778 IonicContact NZ-OE2 2.66Å; K760-E778 PolarHBondContact NZ-OE2 3.07Å; E778-Y874 VanDerWaalsContact CB-OH 3.25Å; E778-Y874 WeakPolarHBondContact CB-OH 3.46Å; E778-Y874 PolarHBondContact OE2-OH 3.48Å; E778-Y874 VanDerWaalsContact OE2-OH 3.06Å
779	F	92.3	Very high	88.4	Confident	16 Å²	16	46.1 Å²	46.1	7%	0.07	23%	0.23	C	C	.	.			trans	-110	171.9	-177.9	-63.6	-90.5	0	0	0	110.8	H759 V761 I777 S781 V783 V848 L850 E856 L858	H759-F779 WeakPolarHBondContact CB-O 3.46Å; H759-F779 PolarHBondContact O-N 3.09Å; V761-F779 HydrophobicContact CB-CE2 3.92Å; V761-F779 HydrophobicContact CG2-CD2 4.17Å; V761-F779 HydrophobicContact CG2-CE2 3.56Å; V761-F779 HydrophobicContact CG2-CZ 4.38Å; I777-F779 HydrophobicContact CB-CE2 3.91Å; I777-F779 HydrophobicContact CB-CZ 4.2Å; I777-F779 HydrophobicContact CG2-CD2 4.46Å; I777-F779 HydrophobicContact CG2-CE1 4.34Å; I777-F779 HydrophobicContact CG2-CE2 3.67Å; I777-F779 HydrophobicContact CG2-CZ 3.61Å; F779-S781 VanDerWaalsContact C-N 3.29Å; F779-S781 PolarHBondContact O-N 3.15Å; F779-V783 HydrophobicContact CD2-CG2 4.14Å; F779-V848 HydrophobicContact CE1-CB 4.47Å; F779-V848 HydrophobicContact CE1-CG2 4.46Å; F779-V848 HydrophobicContact CE2-CG1 4.38Å; F779-V848 HydrophobicContact CE2-CG2 4.47Å; F779-V848 HydrophobicContact CZ-CB 4.31Å; F779-V848 HydrophobicContact CZ-CG1 4.29Å; F779-V848 HydrophobicContact CZ-CG2 3.9Å; F779-L850 HydrophobicContact CB-CD1 4.17Å; F779-L850 HydrophobicContact CB-CD2 3.95Å; F779-L850 HydrophobicContact CD1-CD1 4.08Å; F779-L850 HydrophobicContact CD1-CD2 4.25Å; F779-L850 HydrophobicContact CG-CD1 4.43Å; F779-L850 HydrophobicContact CG-CD2 4.04Å; F779-E856 HydrophobicContact CD1-CG 4.47Å; F779-E856 HydrophobicContact CE1-CB 4Å; F779-E856 HydrophobicContact CE1-CG 4.36Å; F779-E856 WeakPolarHBondContact CE1-OE2 3.33Å; F779-L858 HydrophobicContact CE1-CD1 4.31Å; F779-L858 HydrophobicContact CZ-CD1 4.15Å; F779-L858 HydrophobicContact CZ-CD2 4.44Å
780	K	89.3	Confident	88.1	Confident	120 Å²	120	43.2 Å²	43.2	52%	0.522	22%	0.219	S	C	.	.	S	Bend	trans	-76.8	-12.4	-176.7	-56.2	178.9	-157.4	139	0	114.5	E854	K780-E854 IonicContact NZ-OE1 3.51Å; K780-E854 PolarHBondContact NZ-OE1 3.49Å; K780-E854 IonicContact NZ-OE2 3.31Å; K780-E854 PolarHBondContact NZ-OE2 3.01Å
781	S	92.6	Very high	87.1	Confident	24 Å²	24	48.1 Å²	48.1	17%	0.168	24%	0.239	C	C	.	.	S	Bend	trans	-158	174.1	-168.6	-49.9	0	0	0	0	109.8	H759 F779	H759-S781 VanDerWaalsContact CD2-C 3.41Å; F779-S781 VanDerWaalsContact C-N 3.29Å; F779-S781 PolarHBondContact O-N 3.15Å
782	Q	95.2	Very high	85.6	Confident	33 Å²	33	50.2 Å²	50.2	15%	0.154	24%	0.241	C	C	.	.			trans	-61.1	141.1	-177.2	-56.5	-167.8	-30.8	0	0	112.2	L757 H759 F784 L850 E851	L757-Q782 HydrophobicContact CD2-CB 4.22Å; H759-Q782 PolarHBondContact CD2-N 3Å; Q782-F784 HydrophobicContact CB-CD1 4.24Å; Q782-F784 HydrophobicContact CB-CE1 3.67Å; Q782-F784 HydrophobicContact CB-CZ 4.22Å; Q782-L850 WeakPolarHBondContact O-CA 3.21Å; Q782-E851 HydrophobicContact CB-CB 4.13Å; Q782-E851 WeakPolarHBondContact CG-OE2 3.32Å; Q782-E851 PolarHBondContact N-OE2 2.79Å; Q782-E851 PolarHBondContact O-N 3.36Å
783	V	94.9	Very high	83.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.6	172.2	-178	0	0	0	0	108	S741 G756 V761 F779 V848 L850	S741-V783 WeakPolarHBondContact CB-O 3.33Å; S741-V783 PolarHBondContact OG-O 3.38Å; G756-V783 PolarHBondContact O-N 2.94Å; V761-V783 HydrophobicContact CG2-CG1 4.09Å; V761-V783 HydrophobicContact CG2-CG2 3.9Å; F779-V783 HydrophobicContact CD2-CG2 4.14Å; V783-V848 HydrophobicContact CB-CG1 4.45Å; V783-V848 HydrophobicContact CG1-CG1 3.6Å; V783-V848 HydrophobicContact CG2-CG1 4.11Å; V783-L850 HydrophobicContact CB-CD2 4.47Å; V783-L850 HydrophobicContact CG2-CD2 3.89Å
784	F	94.5	Very high	80.6	Confident	42 Å²	42	51 Å²	51	18%	0.184	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-29.3	177.9	-67.9	-21.6	0	0	0	113	L757 Q782 G849 E851 C911 L913	L757-F784 HydrophobicContact CD2-CD1 4.06Å; L757-F784 HydrophobicContact CD2-CE1 3.78Å; Q782-F784 HydrophobicContact CB-CD1 4.24Å; Q782-F784 HydrophobicContact CB-CE1 3.67Å; Q782-F784 HydrophobicContact CB-CZ 4.22Å; F784-G849 PolarHBondContact N-O 3.35Å; F784-E851 HydrophobicContact CD2-CB 4.27Å; F784-E851 HydrophobicContact CE1-CB 4.46Å; F784-E851 HydrophobicContact CE2-CB 3.63Å; F784-E851 HydrophobicContact CE2-CG 3.82Å; F784-E851 HydrophobicContact CZ-CB 3.73Å; F784-E851 HydrophobicContact CZ-CG 3.8Å; F784-C911 HydrophobicContact CD2-CB 3.95Å; F784-C911 HydrophobicContact CE2-CB 3.77Å; F784-L913 HydrophobicContact CD2-CD2 4.25Å
785	S	95.8	Very high	77.7	Confident	7 Å²	7	54.4 Å²	54.4	5%	0.049	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	151.1	177.5	53.1	0	0	0	0	111.9	G849 V912	S785-G849 PolarHBondContact N-O 2.86Å; S785-G849 PolarHBondContact O-N 2.98Å; S785-V912 PolarHBondContact OG-O 2.7Å
786	L	95.4	Very high	74.7	Confident	8 Å²	8	61.6 Å²	61.6	4%	0.042	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	156.2	171.5	71	83.8	0	0	0	110.3	C742 E744 W753 G755 V761 L846 A847	C742-L786 HydrophobicContact CB-CG 4.29Å; E744-L786 HydrophobicContact CB-CD1 3.68Å; E744-L786 HydrophobicContact CG-CD1 3.78Å; W753-L786 HydrophobicContact CB-CD1 4.34Å; G755-L786 VanDerWaalsContact N-CD2 3.32Å; V761-L786 HydrophobicContact CG1-CD2 4.41Å; L786-L846 HydrophobicContact CB-CD1 4.31Å; L786-L846 HydrophobicContact CD1-CD1 4.44Å; L786-A847 CarbonylContact C-O 3.56Å; L786-A847 VanDerWaalsContact CA-O 3.24Å; L786-A847 WeakPolarHBondContact CA-O 3.2Å
787	G	93.4	Very high	71.5	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.01	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	152.4	176.2	0	0	0	0	0	111.7	L846 A847 F917	G787-L846 WeakPolarHBondContact O-CA 3.32Å; G787-A847 PolarHBondContact N-O 2.9Å; G787-A847 PolarHBondContact O-N 3.36Å; G787-F917 WeakPolarHBondContact O-CE2 3.46Å
788	L	91.3	Very high	68.3	Low	21 Å²	21	77 Å²	77	11%	0.11	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.6	179.8	-60.3	173.2	0	0	0	110.5	E744 T746 W753 S790 W845 L846 I860	E744-L788 HydrophobicContact CB-CD1 3.68Å; E744-L788 HydrophobicContact CB-CG 3.9Å; T746-L788 HydrophobicContact CG2-CD1 4.11Å; W753-L788 HydrophobicContact CB-CD1 4.34Å; W753-L788 HydrophobicContact CD2-CD2 4.36Å; W753-L788 HydrophobicContact CG-CD1 4.16Å; W753-L788 HydrophobicContact CG-CD2 4.02Å; L788-S790 PolarHBondContact O-N 2.96Å; L788-W845 WeakPolarHBondContact CA-O 3.29Å; L788-L846 HydrophobicContact CD2-CB 4.28Å; L788-L846 HydrophobicContact CD2-CD1 3.72Å; L788-I860 HydrophobicContact CD2-CD1 3.71Å
789	S	87.6	Confident	65.1	Low	9 Å²	9	76.4 Å²	76.4	6%	0.063	39%	0.387	C	S	.	.			trans	-73.5	94.8	170.9	72.1	0	0	0	0	110.6	H791 W845	S789-H791 PolarHBondContact O-N 3Å; S789-H791 VanDerWaalsContact O-N 3.14Å; S789-W845 PolarHBondContact N-O 3Å; S789-W845 PolarHBondContact OG-N 3.26Å
790	S	70.5	Confident	61.8	Low	47 Å²	47	83.8 Å²	83.8	33%	0.329	42%	0.421	S	S	.	.			trans	-81.1	94	179.8	-167.8	0	0	0	0	111.4	L788 M792	L788-S790 PolarHBondContact O-N 2.96Å; S790-M792 PolarHBondContact O-N 3.46Å
791	H	54.7	Low	58.7	Low	129 Å²	129	83.9 Å²	83.9	60%	0.597	44%	0.437	S	S	*	.			trans	-77.3	63.4	175.9	-162.7	-54.1	0	0	0	111.6	S789 V793	S789-H791 PolarHBondContact O-N 3Å; S789-H791 VanDerWaalsContact O-N 3.14Å; H791-V793 PolarHBondContact O-N 2.77Å; H791-V793 VanDerWaalsContact O-N 3.07Å
792	M	43.6	Very low	55.6	Low	128 Å²	128	88.6 Å²	88.6	63%	0.631	47%	0.465	S	S	*	.			trans	-59.5	113.7	171.6	-64.8	-162.9	76.9	0	0	109.3	S790 P794	S790-M792 PolarHBondContact O-N 3.46Å; M792-P794 WeakPolarHBondContact O-CD 3.47Å; M792-P794 VanDerWaalsContact O-N 3.12Å
793	V	29.6	Very low	52.2	Low	115 Å²	115	91.3 Å²	91.3	70%	0.697	49%	0.488	S	S	*	.			trans	-59.3	115.2	-177.3	177.8	0	0	0	0	109.3	H791 T795	H791-V793 PolarHBondContact O-N 2.77Å; H791-V793 VanDerWaalsContact O-N 3.07Å; V793-T795 PolarHBondContact O-N 3.36Å; V793-T795 VanDerWaalsContact O-N 3.08Å
794	P	27	Very low	49.1	Very low	100 Å²	100	96.8 Å²	96.8	65%	0.649	52%	0.523	S	S	*	.			trans	-69.6	112.3	-177.7	-19.8	33.7	0	0	0	109.9	M792 R796	M792-P794 WeakPolarHBondContact O-CD 3.47Å; M792-P794 VanDerWaalsContact O-N 3.12Å; P794-R796 VanDerWaalsContact C-N 3.31Å; P794-R796 PolarHBondContact O-N 3.1Å
795	T	22.8	Very low	45.9	Very low	141 Å²	141	100.9 Å²	100.9	87%	0.865	55%	0.551	S	S	*	*			trans	-67.5	88.4	-179	-52.7	0	0	0	0	111.2	V793	V793-T795 PolarHBondContact O-N 3.36Å; V793-T795 VanDerWaalsContact O-N 3.08Å
796	R	22.5	Very low	42.8	Very low	195 Å²	195	106 Å²	106	74%	0.736	59%	0.587	S	S	*	*			trans	58.1	78.8	160.8	-162	-175.8	-173.9	-147.1	0.9	116.1	P794 Q798	P794-R796 VanDerWaalsContact C-N 3.31Å; P794-R796 PolarHBondContact O-N 3.1Å; R796-Q798 HydrophobicContact CG-CG 4.48Å; R796-Q798 VanDerWaalsContact CZ-OE1 3.32Å
797	R	24.5	Very low	39.9	Very low	237 Å²	237	111.2 Å²	111.2	89%	0.894	62%	0.619	S	S	*	*			trans	-94.5	85.3	141.6	-79.7	-165.5	177.2	-171.5	1.8	110.4	A799	R797-A799 HydrophobicContact CB-CB 4.29Å; R797-A799 PolarHBondContact O-N 2.95Å; R797-A799 VanDerWaalsContact O-N 3.07Å
798	Q	22.8	Very low	36.8	Very low	155 Å²	155	118.6 Å²	118.6	72%	0.724	66%	0.658	S	S	*	*			trans	-72.3	87.2	148.4	-78.5	-177.7	-74.1	0	0	106.6	R796	R796-Q798 HydrophobicContact CG-CG 4.48Å; R796-Q798 VanDerWaalsContact CZ-OE1 3.32Å
799	A	26	Very low	34.1	Very low	76 Å²	76	121.2 Å²	121.2	63%	0.628	69%	0.69	S	S	*	*			trans	-116.1	89.9	176.8	0	0	0	0	0	108.4	R797	R797-A799 HydrophobicContact CB-CB 4.29Å; R797-A799 PolarHBondContact O-N 2.95Å; R797-A799 VanDerWaalsContact O-N 3.07Å
800	E	24.8	Very low	31.2	Very low	171 Å²	171	130 Å²	130	80%	0.799	73%	0.731	S	S	*	*			trans	16.9	110.1	161.2	-59.4	-178.9	152.1	0	0	117.9	V802	E800-V802 HydrophobicContact CB-CG2 4.25Å; E800-V802 PolarHBondContact O-N 3.01Å
801	S	24.3	Very low	29.4	Very low	122 Å²	122	133.8 Å²	133.8	85%	0.853	76%	0.757	S	S	*	*			trans	-69.6	81.5	162.1	57.1	0	0	0	0	110.2	S803	S801-S803 VanDerWaalsContact C-N 3.29Å; S801-S803 PolarHBondContact O-N 3.12Å
802	V	26.6	Very low	28	Very low	124 Å²	124	134.7 Å²	134.7	75%	0.752	77%	0.771	S	S	*	*			trans	-69.2	90.1	170.3	-176.9	0	0	0	0	108.4	E800	E800-V802 HydrophobicContact CB-CG2 4.25Å; E800-V802 PolarHBondContact O-N 3.01Å
803	S	24.8	Very low	27.4	Very low	90 Å²	90	134.5 Å²	134.5	63%	0.629	78%	0.783	S	S	*	*			trans	-58	132.4	168.3	52	0	0	0	0	109.4	S801 V805	S801-S803 VanDerWaalsContact C-N 3.29Å; S801-S803 PolarHBondContact O-N 3.12Å; S803-V805 PolarHBondContact O-N 2.74Å; S803-V805 VanDerWaalsContact O-N 3.15Å
804	P	29.5	Very low	27.3	Very low	115 Å²	115	135.3 Å²	135.3	75%	0.747	79%	0.793	S	S	*	*			trans	-62.2	121.1	178.2	25.8	-33.5	0	0	0	109.9	S806	P804-S806 PolarHBondContact O-N 2.74Å
805	V	26.7	Very low	27.6	Very low	127 Å²	127	134.4 Å²	134.4	77%	0.77	80%	0.803	S	S	*	*			trans	-61.9	108	174.3	177.1	0	0	0	0	108.1	S803 V807	S803-V805 PolarHBondContact O-N 2.74Å; S803-V805 VanDerWaalsContact O-N 3.15Å; V805-V807 HydrophobicContact CG1-CG2 4.37Å; V805-V807 PolarHBondContact O-N 3.39Å
806	S	31	Very low	28.1	Very low	114 Å²	114	131.4 Å²	131.4	80%	0.797	80%	0.8	S	S	*	*			trans	-77.6	109.3	171.7	-61.9	0	0	0	0	107.8	P804 D808	P804-S806 PolarHBondContact O-N 2.74Å; S806-D808 PolarHBondContact O-N 3.02Å
807	V	34.5	Very low	28.4	Very low	118 Å²	118	127.7 Å²	127.7	72%	0.715	81%	0.81	S	S	*	*			trans	-80.9	108.7	-179.3	-175.5	0	0	0	0	109.3	V805	V805-V807 HydrophobicContact CG1-CG2 4.37Å; V805-V807 PolarHBondContact O-N 3.39Å
808	D	28.7	Very low	28.8	Very low	156 Å²	156	120.1 Å²	120.1	83%	0.834	81%	0.807	S	S	*	*			trans	44.8	116.5	155.4	-55.2	-47.5	0	0	0	119.8	S806	S806-D808 PolarHBondContact O-N 3.02Å
809	G	33.4	Very low	29.2	Very low	76 Å²	76	118.1 Å²	118.1	78%	0.784	82%	0.817	S	S	*	*			trans	-165.7	73.2	176.3	0	0	0	0	0	113.1
810	E	26.7	Very low	29.6	Very low	195 Å²	195	118.5 Å²	118.5	91%	0.911	83%	0.828	S	S	*	*			trans	22.2	112	164.6	-63.4	-176.9	94.8	0	0	120
811	S	33.2	Very low	29.6	Very low	126 Å²	126	114.5 Å²	114.5	88%	0.881	83%	0.833	S	S	*	*				-169.8	146.5	124.1	32.3	0	0	0	0	112.1
812	T	25.4	Very low	29.9	Very low	147 Å²	147	112.6 Å²	112.6	90%	0.902	83%	0.832	S	S	*	*			trans	-105.9	132.1	-174	45.3	0	0	0	0	112.5
813	S	31.8	Very low	30	Very low	125 Å²	125	113 Å²	113	87%	0.874	84%	0.835	S	S	*	*			trans	-154.3	143	149.9	57.8	0	0	0	0	109.5
814	S	26.7	Very low	30.1	Very low	131 Å²	131	119.4 Å²	119.4	92%	0.916	85%	0.845	S	S	*	*			trans	-145.8	146.1	-172.5	56.1	0	0	0	0	112.1
815	G	33.3	Very low	29.8	Very low	82 Å²	82	120 Å²	120	85%	0.845	84%	0.842	S	S	*	*			trans	138.9	141	-178.7	0	0	0	0	0	111.5
816	G	32.2	Very low	29.7	Very low	78 Å²	78	120.7 Å²	120.7	80%	0.804	85%	0.847	S	S	*	*			cis	-171.8	141	-4.2	0	0	0	0	0	110.8
817	A	29.5	Very low	29.5	Very low	116 Å²	116	120.2 Å²	120.2	96%	0.959	85%	0.85	S	S	*	*			trans	-57.2	151.1	-166.6	0	0	0	0	0	117.2
818	G	33.3	Very low	28.9	Very low	79 Å²	79	119.6 Å²	119.6	81%	0.814	85%	0.851	S	S	*	*			trans	-159.8	139.8	162.5	0	0	0	0	0	109.4
819	A	31.4	Very low	28.9	Very low	113 Å²	113	118.2 Å²	118.2	93%	0.934	85%	0.85	S	S	*	*			trans	-138.5	157	-162.6	0	0	0	0	0	115.3
820	G	33.3	Very low	28.5	Very low	84 Å²	84	123.6 Å²	123.6	87%	0.866	86%	0.855	S	S	*	*			trans	114.9	140.6	179.2	0	0	0	0	0	112.3
821	G	25.8	Very low	28.5	Very low	87 Å²	87	119.2 Å²	119.2	90%	0.897	85%	0.846	S	S	*	*			cis	147.4	83.9	-2.6	0	0	0	0	0	111.9
822	G	30.3	Very low	28	Very low	81 Å²	81	123.3 Å²	123.3	84%	0.835	85%	0.848	S	S	*	*			trans	-167.4	142.5	-177.8	0	0	0	0	0	113.2
823	T	28.8	Very low	27.9	Very low	134 Å²	134	123.2 Å²	123.2	82%	0.822	85%	0.847	S	S	*	*			trans	-89.6	149.4	-168.6	50	0	0	0	0	114.6
824	R	25.8	Very low	27.5	Very low	223 Å²	223	122.8 Å²	122.8	84%	0.842	84%	0.844	S	S	*	*			trans	39	121.7	141.8	-79.5	-167.7	173.3	146.3	-3	117.9
825	D	24.9	Very low	27.3	Very low	129 Å²	129	119.7 Å²	119.7	69%	0.69	83%	0.833	S	S	*	*			cis	-172.6	167.8	41.1	-89.6	-35.4	0	0	0	110.8
826	T	24.8	Very low	27	Very low	141 Å²	141	121.1 Å²	121.1	87%	0.865	83%	0.83	S	S	*	*			trans	45	87.9	159.2	56.6	0	0	0	0	120.1
827	A	25.3	Very low	26.6	Very low	103 Å²	103	125.5 Å²	125.5	85%	0.851	84%	0.835	S	S	*	*			trans	-159.8	153.8	147.3	0	0	0	0	0	112.8
828	S	23.1	Very low	26.5	Very low	105 Å²	105	127.2 Å²	127.2	73%	0.734	82%	0.82	S	S	*	*			trans	-62.8	146.9	-177.9	-44.3	0	0	0	0	114.6	Q830	S828-Q830 PolarHBondContact O-N 3.4Å
829	P	28.7	Very low	26.2	Very low	127 Å²	127	128.6 Å²	128.6	83%	0.825	82%	0.818	S	S	*	*			trans	-71.6	112.4	160.7	30.4	-31.3	0	0	0	109.4	S831	P829-S831 PolarHBondContact O-N 2.98Å
830	Q	24.1	Very low	26	Very low	190 Å²	190	130.6 Å²	130.6	89%	0.888	81%	0.812	S	S	*	*			trans	-73.2	104.6	169	-72.7	-171.8	-7	0	0	109.7	S828	S828-Q830 PolarHBondContact O-N 3.4Å
831	S	27	Very low	26.4	Very low	102 Å²	102	131 Å²	131	71%	0.713	80%	0.801	S	S	*	*			trans	-75.3	158.8	158.6	52.1	0	0	0	0	110.3	P829 V833	P829-S831 PolarHBondContact O-N 2.98Å; S831-V833 PolarHBondContact O-N 3.34Å
832	F	23.3	Very low	27.5	Very low	213 Å²	213	131.7 Å²	131.7	93%	0.934	78%	0.783	S	S	*	*			trans	-55.3	118.8	-173.2	-93.4	-116.9	0	0	0	113	S834	F832-S834 PolarHBondContact O-N 3.23Å
833	V	22.7	Very low	29.2	Very low	144 Å²	144	131.2 Å²	131.2	87%	0.873	76%	0.759	S	S	*	*			trans	-87.1	103.9	172.1	-179.6	0	0	0	0	109.7	S831	S831-V833 PolarHBondContact O-N 3.34Å
834	S	23.4	Very low	31.9	Very low	116 Å²	116	126.5 Å²	126.5	81%	0.811	73%	0.732	S	S	*	*			trans	-153.5	99.2	165	175.8	0	0	0	0	111.5	F832	F832-S834 PolarHBondContact O-N 3.23Å
835	G	22.8	Very low	34.9	Very low	66 Å²	66	117 Å²	117	68%	0.68	70%	0.696	S	S	*	*	S	Bend	trans	111.3	103	162.9	0	0	0	0	0	116.3
836	S	26.1	Very low	38.1	Very low	112 Å²	112	110.9 Å²	110.9	78%	0.783	66%	0.664	S	S	*	*			trans	50	99	155.1	57.5	0	0	0	0	119.3	K838	S836-K838 PolarHBondContact O-N 2.87Å
837	N	24	Very low	41.5	Very low	171 Å²	171	104.2 Å²	104.2	91%	0.914	62%	0.622	S	S	*	*			trans	-60	127	142.2	-71.5	-28.5	0	0	0	109.1
838	K	28.5	Very low	44.9	Very low	151 Å²	151	99.3 Å²	99.3	66%	0.657	58%	0.582	S	S	*	*			trans	-129.4	135	154.2	-93.1	-162.5	170.1	-166.3	0	109.4	S836 T895	S836-K838 PolarHBondContact O-N 2.87Å; K838-T895 PolarHBondContact NZ-O 3.46Å
839	S	26.2	Very low	48.4	Very low	109 Å²	109	94.3 Å²	94.3	76%	0.762	55%	0.547	S	S	*	.			trans	-70.8	159.3	-173.5	-166.4	0	0	0	0	112.3	S841	S839-S841 PolarHBondContact O-N 3.06Å
840	L	27.7	Very low	51.6	Low	154 Å²	154	88.2 Å²	88.2	81%	0.806	51%	0.508	S	S	*	.			trans	-44	117.1	171.6	-65.5	129.4	0	0	0	112.3	I842	L840-I842 HydrophobicContact CD2-CD1 4.47Å
841	S	40.5	Very low	55	Low	92 Å²	92	83 Å²	83	64%	0.643	48%	0.483	S	S	*	.			trans	-123	91.7	156	58.5	0	0	0	0	107.3	S839 E843	S839-S841 PolarHBondContact O-N 3.06Å; S841-E843 VanDerWaalsContact C-N 3.29Å; S841-E843 PolarHBondContact O-N 2.92Å
842	I	50.7	Low	58.1	Low	102 Å²	102	80.1 Å²	80.1	52%	0.523	46%	0.463	S	S	.	.			trans	-75.4	89.4	173.7	-57.6	177.2	0	0	0	106.5	L840 S844	L840-I842 HydrophobicContact CD2-CD1 4.47Å; I842-S844 PolarHBondContact O-N 3.48Å
843	E	66.2	Low	61.4	Low	71 Å²	71	71.2 Å²	71.2	33%	0.332	43%	0.427	S	S	.	.			trans	-72.4	101.2	170	-69.1	-173.2	136	0	0	108.1	S841 W845 Q901	S841-E843 VanDerWaalsContact C-N 3.29Å; S841-E843 PolarHBondContact O-N 2.92Å; E843-W845 HydrophobicContact CB-CZ2 4.2Å; E843-W845 PolarHBondContact O-NE1 3.24Å; E843-Q901 PolarHBondContact OE1-NE2 3.43Å
844	S	83.5	Confident	64.9	Low	35 Å²	35	66 Å²	66	25%	0.245	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	163.2	164	-69.3	0	0	0	0	109.4	I842 I860	I842-S844 PolarHBondContact O-N 3.48Å; S844-I860 WeakPolarHBondContact CB-O 3.1Å; S844-I860 PolarHBondContact N-O 2.94Å; S844-I860 WeakPolarHBondContact O-CG1 3.26Å; S844-I860 PolarHBondContact O-N 2.99Å; S844-I860 VanDerWaalsContact O-O 3.13Å
845	W	89.7	Confident	68.3	Low	25 Å²	25	60.5 Å²	60.5	10%	0.095	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.4	-176.7	-60.3	86.2	0	0	0	110.1	L788 S789 E843 V857 L858 A859 F903 F917 T938 P939	L788-W845 WeakPolarHBondContact CA-O 3.29Å; S789-W845 PolarHBondContact N-O 3Å; S789-W845 PolarHBondContact OG-N 3.26Å; E843-W845 HydrophobicContact CB-CZ2 4.2Å; E843-W845 PolarHBondContact O-NE1 3.24Å; W845-V857 HydrophobicContact CB-CG1 4.45Å; W845-V857 HydrophobicContact CE3-CG1 4.15Å; W845-L858 WeakPolarHBondContact CA-O 3.26Å; W845-A859 HydrophobicContact CE3-CB 4.09Å; W845-A859 HydrophobicContact CH2-CB 3.72Å; W845-A859 HydrophobicContact CZ2-CB 4.29Å; W845-A859 HydrophobicContact CZ3-CB 3.6Å; W845-F903 HydrophobicContact CH2-CE2 4.11Å; W845-F903 HydrophobicContact CZ3-CD2 4.28Å; W845-F903 AromaticContact CZ3-CE2 3.78Å; W845-F903 HydrophobicContact CZ3-CE2 3.78Å; W845-F917 HydrophobicContact CB-CZ 4.25Å; W845-T938 HydrophobicContact CB-CG2 4.38Å; W845-T938 HydrophobicContact CG-CG2 4.1Å; W845-P939 HydrophobicContact CD2-CB 3.39Å; W845-P939 HydrophobicContact CD2-CG 4.43Å; W845-P939 VanDerWaalsContact CE2-CB 3.44Å; W845-P939 HydrophobicContact CE3-CB 3.47Å; W845-P939 VanDerWaalsContact CE3-CB 3.47Å; W845-P939 HydrophobicContact CG-CB 4.09Å; W845-P939 HydrophobicContact CH2-CB 3.66Å; W845-P939 HydrophobicContact CH2-CG 3.92Å; W845-P939 HydrophobicContact CZ2-CB 3.6Å; W845-P939 HydrophobicContact CZ2-CG 3.76Å; W845-P939 HydrophobicContact CZ3-CB 3.6Å; W845-P939 HydrophobicContact CZ3-CG 4.33Å
846	L	93.2	Very high	71.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	132	164.9	171.2	71.4	0	0	0	107.1	W753 V761 I777 L786 G787 L788 V848 V857 L858 I860	W753-L846 HydrophobicContact CE3-CD1 4.45Å; W753-L846 HydrophobicContact CE3-CD2 4.09Å; W753-L846 HydrophobicContact CH2-CD2 3.97Å; W753-L846 HydrophobicContact CZ3-CD2 3.62Å; V761-L846 HydrophobicContact CG1-CD2 4.12Å; I777-L846 HydrophobicContact CD1-CD2 4.4Å; L786-L846 HydrophobicContact CB-CD1 4.31Å; L786-L846 HydrophobicContact CD1-CD1 4.44Å; G787-L846 WeakPolarHBondContact O-CA 3.32Å; L788-L846 HydrophobicContact CD2-CB 4.28Å; L788-L846 HydrophobicContact CD2-CD1 3.72Å; L846-V848 HydrophobicContact CD1-CG2 4.19Å; L846-V848 HydrophobicContact CD2-CG2 3.8Å; L846-V848 HydrophobicContact CG-CG2 3.73Å; L846-V857 CarbonylContact O-C 3.59Å; L846-V857 WeakPolarHBondContact O-CA 3.46Å; L846-L858 HydrophobicContact CD2-CD1 4.24Å; L846-L858 HydrophobicContact CG-CD1 4.47Å; L846-L858 PolarHBondContact N-O 3.47Å; L846-L858 PolarHBondContact O-N 3.01Å; L846-I860 HydrophobicContact CB-CD1 4.11Å; L846-I860 HydrophobicContact CB-CG1 4.36Å; L846-I860 HydrophobicContact CB-CG2 4.03Å
847	A	95.6	Very high	75	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.1	164.8	0	0	0	0	0	109.8	L786 G787 E856 V857 L915 F917 F924	L786-A847 CarbonylContact C-O 3.56Å; L786-A847 VanDerWaalsContact CA-O 3.24Å; L786-A847 WeakPolarHBondContact CA-O 3.2Å; G787-A847 PolarHBondContact N-O 2.9Å; G787-A847 PolarHBondContact O-N 3.36Å; A847-E856 CarbonylContact C-O 3.58Å; A847-E856 VanDerWaalsContact CA-O 3.31Å; A847-E856 WeakPolarHBondContact CA-O 3.21Å; A847-V857 HydrophobicContact CB-CG1 4.39Å; A847-V857 HydrophobicContact CB-CG2 4.02Å; A847-L915 HydrophobicContact CB-CD1 3.63Å; A847-L915 HydrophobicContact CB-CD2 3.88Å; A847-L915 HydrophobicContact CB-CG 4.42Å; A847-F917 HydrophobicContact CB-CE2 3.64Å; A847-F917 HydrophobicContact CB-CZ 3.86Å; A847-F924 HydrophobicContact CB-CE2 4.36Å; A847-F924 HydrophobicContact CB-CZ 4.46Å
848	V	96.9	Very high	78.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	120.9	-170.5	-170.5	0	0	0	0	108.9	V761 F779 V783 L846 L850 V855 E856 L858	V761-V848 HydrophobicContact CG2-CG1 3.93Å; V761-V848 HydrophobicContact CG2-CG2 4.15Å; F779-V848 HydrophobicContact CE1-CB 4.47Å; F779-V848 HydrophobicContact CE1-CG2 4.46Å; F779-V848 HydrophobicContact CE2-CG1 4.38Å; F779-V848 HydrophobicContact CE2-CG2 4.47Å; F779-V848 HydrophobicContact CZ-CB 4.31Å; F779-V848 HydrophobicContact CZ-CG1 4.29Å; F779-V848 HydrophobicContact CZ-CG2 3.9Å; V783-V848 HydrophobicContact CB-CG1 4.45Å; V783-V848 HydrophobicContact CG1-CG1 3.6Å; V783-V848 HydrophobicContact CG2-CG1 4.11Å; L846-V848 HydrophobicContact CD1-CG2 4.19Å; L846-V848 HydrophobicContact CD2-CG2 3.8Å; L846-V848 HydrophobicContact CG-CG2 3.73Å; V848-L850 HydrophobicContact CG1-CD2 3.82Å; V848-V855 CarbonylContact O-C 3.39Å; V848-V855 WeakPolarHBondContact O-CA 3.41Å; V848-E856 PolarHBondContact N-O 2.87Å; V848-E856 PolarHBondContact O-N 3.43Å; V848-L858 HydrophobicContact CG2-CD1 3.95Å
849	G	95.6	Very high	81	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.9	174.1	0	0	0	0	0	111.2	F784 S785	F784-G849 PolarHBondContact N-O 3.35Å; S785-G849 PolarHBondContact N-O 2.86Å; S785-G849 PolarHBondContact O-N 2.98Å
850	L	96.8	Very high	83.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	158.9	-174.8	-56.3	178.3	0	0	0	112.8	F779 Q782 V783 V848 S852 S853 E854 E856 V912	F779-L850 HydrophobicContact CB-CD1 4.17Å; F779-L850 HydrophobicContact CB-CD2 3.95Å; F779-L850 HydrophobicContact CD1-CD1 4.08Å; F779-L850 HydrophobicContact CD1-CD2 4.25Å; F779-L850 HydrophobicContact CG-CD1 4.43Å; F779-L850 HydrophobicContact CG-CD2 4.04Å; Q782-L850 WeakPolarHBondContact O-CA 3.21Å; V783-L850 HydrophobicContact CB-CD2 4.47Å; V783-L850 HydrophobicContact CG2-CD2 3.89Å; V848-L850 HydrophobicContact CG1-CD2 3.82Å; L850-S852 WeakPolarHBondContact CB-OG 3.25Å; L850-S852 PolarHBondContact O-N 3.48Å; L850-S853 PolarHBondContact O-N 3.49Å; L850-E854 WeakPolarHBondContact CB-O 3.46Å; L850-E854 HydrophobicContact CD1-CB 4.32Å; L850-E854 PolarHBondContact N-O 2.98Å; L850-E854 VanDerWaalsContact N-O 3.13Å; L850-E856 HydrophobicContact CD1-CG 4.42Å; L850-V912 PolarHBondContact O-N 2.71Å
851	E	95.4	Very high	85.6	Confident	81 Å²	81	26.6 Å²	26.6	38%	0.379	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-36.1	167.1	-177.8	-170.3	-167.9	0	0	112.4	Q782 F784 S853 C911	Q782-E851 HydrophobicContact CB-CB 4.13Å; Q782-E851 WeakPolarHBondContact CG-OE2 3.32Å; Q782-E851 PolarHBondContact N-OE2 2.79Å; Q782-E851 PolarHBondContact O-N 3.36Å; F784-E851 HydrophobicContact CD2-CB 4.27Å; F784-E851 HydrophobicContact CE1-CB 4.46Å; F784-E851 HydrophobicContact CE2-CB 3.63Å; F784-E851 HydrophobicContact CE2-CG 3.82Å; F784-E851 HydrophobicContact CZ-CB 3.73Å; F784-E851 HydrophobicContact CZ-CG 3.8Å; E851-S853 PolarHBondContact O-N 3.08Å; E851-C911 WeakPolarHBondContact O-CA 3.28Å; E851-C911 PolarHBondContact O-SG 2.91Å
852	S	92.4	Very high	86.4	Confident	40 Å²	40	27.2 Å²	27.2	28%	0.28	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	6.5	-174.9	59.7	0	0	0	0	116	L850 E854	L850-S852 WeakPolarHBondContact CB-OG 3.25Å; L850-S852 PolarHBondContact O-N 3.48Å; S852-E854 PolarHBondContact O-N 3.46Å; S852-E854 VanDerWaalsContact O-N 3.16Å
853	S	92.6	Very high	86.7	Confident	26 Å²	26	28.7 Å²	28.7	18%	0.182	17%	0.166	C	C	.	.	S	Bend	trans	63	-1.6	-167	93.2	0	0	0	0	116.2	L850 E851 H908 S910	L850-S853 PolarHBondContact O-N 3.49Å; E851-S853 PolarHBondContact O-N 3.08Å; S853-H908 WeakPolarHBondContact CB-O 3.39Å; S853-H908 PolarHBondContact OG-O 2.83Å; S853-S910 WeakPolarHBondContact CA-O 3.42Å; S853-S910 VanDerWaalsContact CB-C 3.48Å; S853-S910 WeakPolarHBondContact CB-O 3.38Å
854	E	94.8	Very high	86.4	Confident	35 Å²	35	25.8 Å²	25.8	16%	0.164	16%	0.155	C	C	.	.			trans	-74.6	137.4	170.3	-58.5	-176.7	141.9	0	0	110.2	K780 L850 S852 R904 T906	K780-E854 IonicContact NZ-OE1 3.51Å; K780-E854 PolarHBondContact NZ-OE1 3.49Å; K780-E854 IonicContact NZ-OE2 3.31Å; K780-E854 PolarHBondContact NZ-OE2 3.01Å; L850-E854 WeakPolarHBondContact CB-O 3.46Å; L850-E854 HydrophobicContact CD1-CB 4.32Å; L850-E854 PolarHBondContact N-O 2.98Å; L850-E854 VanDerWaalsContact N-O 3.13Å; S852-E854 PolarHBondContact O-N 3.46Å; S852-E854 VanDerWaalsContact O-N 3.16Å; E854-R904 HydrophobicContact CB-CG 4.28Å; E854-R904 HydrophobicContact CG-CG 4.45Å; E854-R904 VanDerWaalsContact OE1-CD 3.27Å; E854-R904 WeakPolarHBondContact OE1-CD 3.43Å; E854-R904 IonicContact OE1-NE 3.92Å; E854-R904 IonicContact OE2-NE 2.75Å; E854-T906 HydrophobicContact CG-CG2 4.37Å
855	V	95.9	Very high	85.3	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.1	162.6	-175.7	0	0	0	0	107.7	V848 V857 R904 L905 V912 L915 F924 T926	V848-V855 CarbonylContact O-C 3.39Å; V848-V855 WeakPolarHBondContact O-CA 3.41Å; V855-V857 HydrophobicContact CG1-CG2 4.47Å; V855-R904 CarbonylContact O-C 3.58Å; V855-R904 WeakPolarHBondContact O-CA 3.28Å; V855-L905 HydrophobicContact CB-CB 4.17Å; V855-L905 HydrophobicContact CB-CD1 4.44Å; V855-L905 HydrophobicContact CB-CG 4.47Å; V855-L905 HydrophobicContact CG1-CD1 4.41Å; V855-L905 PolarHBondContact N-O 3.38Å; V855-L905 PolarHBondContact O-N 2.86Å; V855-V912 HydrophobicContact CG2-CG1 4.16Å; V855-V912 HydrophobicContact CG2-CG2 3.81Å; V855-L915 HydrophobicContact CG1-CD1 3.99Å; V855-F924 HydrophobicContact CG1-CE2 4.32Å; V855-T926 HydrophobicContact CG1-CG2 4.41Å; V855-T926 HydrophobicContact CG2-CG2 4.1Å
856	E	94.6	Very high	83.6	Confident	9 Å²	9	26 Å²	26	4%	0.042	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.1	173.8	-60.6	-152.3	161.2	0	0	111.5	F779 A847 V848 L850 L858 H902 F903 R904	F779-E856 HydrophobicContact CD1-CG 4.47Å; F779-E856 HydrophobicContact CE1-CB 4Å; F779-E856 HydrophobicContact CE1-CG 4.36Å; F779-E856 WeakPolarHBondContact CE1-OE2 3.33Å; A847-E856 CarbonylContact C-O 3.58Å; A847-E856 VanDerWaalsContact CA-O 3.31Å; A847-E856 WeakPolarHBondContact CA-O 3.21Å; V848-E856 PolarHBondContact N-O 2.87Å; V848-E856 PolarHBondContact O-N 3.43Å; L850-E856 HydrophobicContact CD1-CG 4.42Å; E856-L858 HydrophobicContact CB-CD1 4.11Å; E856-H902 IonicContact OE2-CD2 2.77Å; E856-H902 IonicContact OE2-CE1 3.89Å; E856-H902 PolarHBondContact OE2-CE1 2.9Å; E856-H902 VanDerWaalsContact OE2-CE1 3.26Å; E856-H902 IonicContact OE2-NE2 2.99Å; E856-H902 PolarHBondContact OE2-NE2 3.49Å; E856-F903 CarbonylContact C-O 3.22Å; E856-F903 WeakPolarHBondContact CA-O 3.49Å; E856-R904 HydrophobicContact CG-CB 4.38Å; E856-R904 HydrophobicContact CG-CG 4.29Å; E856-R904 IonicContact OE1-CZ 2.92Å; E856-R904 IonicContact OE1-NE 3.94Å; E856-R904 PolarHBondContact OE1-NE 2.94Å; E856-R904 IonicContact OE1-NH2 3.78Å; E856-R904 PolarHBondContact OE1-NH2 3.45Å
857	V	93.6	Very high	81.4	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.4	-179.1	-170.4	0	0	0	0	108.7	W845 L846 A847 V855 H902 F903 L905 F924 P939	W845-V857 HydrophobicContact CB-CG1 4.45Å; W845-V857 HydrophobicContact CE3-CG1 4.15Å; L846-V857 CarbonylContact O-C 3.59Å; L846-V857 WeakPolarHBondContact O-CA 3.46Å; A847-V857 HydrophobicContact CB-CG1 4.39Å; A847-V857 HydrophobicContact CB-CG2 4.02Å; V855-V857 HydrophobicContact CG1-CG2 4.47Å; V857-H902 CarbonylContact O-C 3.56Å; V857-H902 WeakPolarHBondContact O-CA 3.43Å; V857-F903 HydrophobicContact CB-CB 4.38Å; V857-F903 HydrophobicContact CB-CD2 4.49Å; V857-F903 PolarHBondContact N-O 3.25Å; V857-F903 PolarHBondContact O-N 3.22Å; V857-L905 HydrophobicContact CG2-CD1 3.98Å; V857-L905 HydrophobicContact CG2-CG 4.45Å; V857-F924 HydrophobicContact CG2-CE1 4.14Å; V857-F924 HydrophobicContact CG2-CZ 3.68Å; V857-P939 WeakPolarHBondContact CG1-O 3.41Å
858	L	91.6	Very high	79	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.5	-167	-49.4	98	0	0	0	110.5	I777 F779 W845 L846 V848 E856 F870	I777-L858 HydrophobicContact CD1-CD2 4.32Å; I777-L858 HydrophobicContact CG2-CD2 4.44Å; F779-L858 HydrophobicContact CE1-CD1 4.31Å; F779-L858 HydrophobicContact CZ-CD1 4.15Å; F779-L858 HydrophobicContact CZ-CD2 4.44Å; W845-L858 WeakPolarHBondContact CA-O 3.26Å; L846-L858 HydrophobicContact CD2-CD1 4.24Å; L846-L858 HydrophobicContact CG-CD1 4.47Å; L846-L858 PolarHBondContact N-O 3.47Å; L846-L858 PolarHBondContact O-N 3.01Å; V848-L858 HydrophobicContact CG2-CD1 3.95Å; E856-L858 HydrophobicContact CB-CD1 4.11Å; L858-F870 HydrophobicContact CD2-CE1 3.89Å; L858-F870 HydrophobicContact CD2-CZ 3.68Å
859	A	87.2	Confident	76.6	Confident	3 Å²	3	35.5 Å²	35.5	3%	0.025	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	133	173	0	0	0	0	0	110	W845 P866 Q901	W845-A859 HydrophobicContact CE3-CB 4.09Å; W845-A859 HydrophobicContact CH2-CB 3.72Å; W845-A859 HydrophobicContact CZ2-CB 4.29Å; W845-A859 HydrophobicContact CZ3-CB 3.6Å; A859-P866 HydrophobicContact CB-CG 4.24Å; A859-P866 WeakPolarHBondContact O-CD 3.45Å; A859-Q901 HydrophobicContact CB-CB 3.79Å; A859-Q901 HydrophobicContact CB-CG 3.91Å; A859-Q901 PolarHBondContact N-O 2.92Å
860	I	82	Confident	74	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.041	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	120.1	176.4	52.8	161.2	0	0	0	109	W753 L788 S844 L846	W753-I860 HydrophobicContact CH2-CB 4.48Å; W753-I860 HydrophobicContact CH2-CG2 3.57Å; W753-I860 HydrophobicContact CZ2-CB 4.01Å; W753-I860 HydrophobicContact CZ2-CD1 3.72Å; W753-I860 HydrophobicContact CZ2-CG1 4.44Å; W753-I860 HydrophobicContact CZ2-CG2 3.57Å; L788-I860 HydrophobicContact CD2-CD1 3.71Å; S844-I860 WeakPolarHBondContact CB-O 3.1Å; S844-I860 PolarHBondContact N-O 2.94Å; S844-I860 WeakPolarHBondContact O-CG1 3.26Å; S844-I860 PolarHBondContact O-N 2.99Å; S844-I860 VanDerWaalsContact O-O 3.13Å; L846-I860 HydrophobicContact CB-CD1 4.11Å; L846-I860 HydrophobicContact CB-CG1 4.36Å; L846-I860 HydrophobicContact CB-CG2 4.03Å
861	G	68	Low	71	Confident	28 Å²	28	42.7 Å²	42.7	29%	0.289	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-82.2	176.9	171.5	0	0	0	0	0	111.9	D863 G864	G861-D863 PolarHBondContact O-N 3.04Å; G861-G864 CarbonylContact C-O 3.45Å; G861-G864 VanDerWaalsContact CA-O 3.29Å; G861-G864 WeakPolarHBondContact CA-O 3.47Å; G861-G864 PolarHBondContact N-O 3.02Å; G861-G864 PolarHBondContact O-N 3.32Å; G861-G864 VanDerWaalsContact O-N 3.12Å
862	P	57.8	Low	68	Low	105 Å²	105	44.8 Å²	44.8	68%	0.682	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.8	179.2	24.9	-34.3	0	0	0	112.9
863	D	58.2	Low	64.8	Low	134 Å²	134	50 Å²	50	72%	0.717	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-4.5	179.4	-56	-62.5	0	0	0	113.6	G861	G861-D863 PolarHBondContact O-N 3.04Å
864	G	59.7	Low	62	Low	10 Å²	10	54.3 Å²	54.3	10%	0.103	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	123.1	-167.4	-170.9	0	0	0	0	0	113.4	Y775 G861	Y775-G864 WeakPolarHBondContact OH-CA 3.43Å; G861-G864 CarbonylContact C-O 3.45Å; G861-G864 VanDerWaalsContact CA-O 3.29Å; G861-G864 WeakPolarHBondContact CA-O 3.47Å; G861-G864 PolarHBondContact N-O 3.02Å; G861-G864 PolarHBondContact O-N 3.32Å; G861-G864 VanDerWaalsContact O-N 3.12Å
865	P	59.3	Low	58.6	Low	31 Å²	31	60.9 Å²	60.9	20%	0.201	37%	0.365	C	S	.	.	S	Bend	trans	-64.5	142.7	-176.3	-16.7	30.5	0	0	0	110.2	Y775 I777 A867 F870	Y775-P865 HydrophobicContact CD2-CG 4.09Å; Y775-P865 VanDerWaalsContact CE2-CD 3.42Å; Y775-P865 HydrophobicContact CE2-CG 3.74Å; Y775-P865 VanDerWaalsContact CZ-CD 3.4Å; I777-P865 HydrophobicContact CD1-CG 4.18Å; P865-A867 PolarHBondContact O-N 2.69Å; P865-F870 HydrophobicContact CB-CD2 4.49Å; P865-F870 HydrophobicContact CB-CE2 3.73Å; P865-F870 HydrophobicContact CG-CE2 4.08Å
866	P	55.1	Low	55.6	Low	33 Å²	33	65.7 Å²	65.7	21%	0.214	39%	0.394	C	S	.	.			trans	-59	132	176	23.9	-30.4	0	0	0	109.6	A859 S868 A869 Q901	A859-P866 HydrophobicContact CB-CG 4.24Å; A859-P866 WeakPolarHBondContact O-CD 3.45Å; P866-S868 PolarHBondContact O-N 2.61Å; P866-A869 HydrophobicContact CG-CB 4.37Å; P866-A869 VanDerWaalsContact O-CB 3.27Å; P866-A869 WeakPolarHBondContact O-CB 3.24Å; P866-A869 PolarHBondContact O-N 3.32Å; P866-Q901 VanDerWaalsContact CG-CD 3.43Å; P866-Q901 HydrophobicContact CG-CG 4.36Å; P866-Q901 VanDerWaalsContact CG-OE1 3.28Å
867	A	45.7	Very low	52.3	Low	107 Å²	107	70.7 Å²	70.7	88%	0.884	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-8.3	-169.1	0	0	0	0	0	115.4	P865	P865-A867 PolarHBondContact O-N 2.69Å
868	S	45.9	Very low	49.3	Very low	79 Å²	79	81.2 Å²	81.2	55%	0.552	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-9.5	172.6	43.7	0	0	0	0	115.1	P866 Q901	P866-S868 PolarHBondContact O-N 2.61Å; S868-Q901 PolarHBondContact OG-OE1 3.12Å
869	A	45.9	Very low	46.1	Very low	14 Å²	14	90 Å²	90	12%	0.116	51%	0.508	C	S	.	.	S	Bend	trans	-73.5	-28.3	-167.7	0	0	0	0	0	114.9	P866	P866-A869 HydrophobicContact CG-CB 4.37Å; P866-A869 VanDerWaalsContact O-CB 3.27Å; P866-A869 WeakPolarHBondContact O-CB 3.24Å; P866-A869 PolarHBondContact O-N 3.32Å
870	F	42.5	Very low	43.2	Very low	67 Å²	67	98.6 Å²	98.6	29%	0.294	55%	0.548	S	S	.	.	S	Bend	trans	-132	144.9	-169.5	-55.6	-66.5	0	0	0	113.4	I777 L858 P865 V872	I777-F870 HydrophobicContact CD1-CE2 4.17Å; I777-F870 HydrophobicContact CD1-CZ 3.91Å; I777-F870 HydrophobicContact CG1-CE2 4.26Å; I777-F870 HydrophobicContact CG1-CZ 4.21Å; I777-F870 HydrophobicContact CG2-CE1 4.2Å; I777-F870 HydrophobicContact CG2-CZ 4.07Å; L858-F870 HydrophobicContact CD2-CE1 3.89Å; L858-F870 HydrophobicContact CD2-CZ 3.68Å; P865-F870 HydrophobicContact CB-CD2 4.49Å; P865-F870 HydrophobicContact CB-CE2 3.73Å; P865-F870 HydrophobicContact CG-CE2 4.08Å; F870-V872 PolarHBondContact O-N 3.49Å
871	P	32.5	Very low	40.7	Very low	83 Å²	83	104 Å²	104	54%	0.539	59%	0.586	S	S	.	*			trans	-68.4	111.8	162.7	29.6	-30.8	0	0	0	108.5	P520 N873	P520-P871 WeakPolarHBondContact O-CB 3.34Å; P520-P871 WeakPolarHBondContact O-CD 3.36Å; P520-P871 VanDerWaalsContact O-CG 3.26Å; P520-P871 WeakPolarHBondContact O-CG 3.38Å; P871-N873 PolarHBondContact O-N 2.67Å
872	V	32	Very low	38.7	Very low	126 Å²	126	106 Å²	106	76%	0.764	61%	0.607	S	S	*	*			trans	-68.9	97.3	-179.5	-178	0	0	0	0	109.6	F870	F870-V872 PolarHBondContact O-N 3.49Å
873	N	25.3	Very low	37.3	Very low	149 Å²	149	107.1 Å²	107.1	80%	0.797	62%	0.617	S	S	*	*			trans	-119.5	34.8	174.2	-147.4	32	0	0	0	111.3	P871	P871-N873 PolarHBondContact O-N 2.67Å
874	Y	33.5	Very low	35.9	Very low	116 Å²	116	104.6 Å²	104.6	46%	0.455	62%	0.622	S	S	.	*	S	Bend	trans	-125.1	129.3	177.9	-72.3	-79.9	0	0	0	110.6	E778 V876	E778-Y874 VanDerWaalsContact CB-OH 3.25Å; E778-Y874 WeakPolarHBondContact CB-OH 3.46Å; E778-Y874 PolarHBondContact OE2-OH 3.48Å; E778-Y874 VanDerWaalsContact OE2-OH 3.06Å; Y874-V876 PolarHBondContact O-N 2.71Å
875	N	25.1	Very low	34.3	Very low	173 Å²	173	110.4 Å²	110.4	93%	0.925	66%	0.662	S	S	*	*			trans	-69.6	94.5	175.2	-86	-25.3	0	0	0	110.7
876	V	32.2	Very low	32.8	Very low	102 Å²	102	112.2 Å²	112.2	62%	0.618	69%	0.686	S	S	*	*			trans	-86	120.1	154.5	-178.4	0	0	0	0	107.2	Y874 R878	Y874-V876 PolarHBondContact O-N 2.71Å; V876-R878 PolarHBondContact O-N 3.38Å
877	P	25.4	Very low	31.4	Very low	114 Å²	114	118.5 Å²	118.5	74%	0.74	72%	0.718	S	S	*	*			trans	-67	99.7	171.6	27.7	-32.5	0	0	0	108.5
878	R	29.9	Very low	30.6	Very low	222 Å²	222	119.3 Å²	119.3	84%	0.838	71%	0.714	S	S	*	*			trans	-82.5	113.5	175.8	-171.8	179.9	-170	174	2.9	108.1	V876 E880	V876-R878 PolarHBondContact O-N 3.38Å; R878-E880 PolarHBondContact O-N 2.77Å; R878-E880 VanDerWaalsContact O-N 3.12Å
879	E	25.7	Very low	29.5	Very low	185 Å²	185	119.9 Å²	119.9	86%	0.864	72%	0.718	S	S	*	*			trans	-65.2	111.6	171	-67	-171.1	144.3	0	0	109.4	S881	E879-S881 PolarHBondContact O-N 3.1Å
880	E	25.8	Very low	28.6	Very low	185 Å²	185	125.8 Å²	125.8	86%	0.864	76%	0.755	S	S	*	*			trans	-78	83.5	176.4	-69.2	-161.9	130.3	0	0	111	R878 G882	R878-E880 PolarHBondContact O-N 2.77Å; R878-E880 VanDerWaalsContact O-N 3.12Å; E880-G882 VanDerWaalsContact C-N 3.32Å; E880-G882 PolarHBondContact O-N 3.49Å; E880-G882 VanDerWaalsContact O-N 3.1Å
881	S	28.8	Very low	27.8	Very low	120 Å²	120	128.7 Å²	128.7	84%	0.839	77%	0.773	S	S	*	*			trans	-74.4	87.6	157.2	44.7	0	0	0	0	109.3	E879	E879-S881 PolarHBondContact O-N 3.1Å
882	G	26.8	Very low	27.3	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	78%	0.779	S	S	*	*			trans	-77	134.5	-171.6	0	0	0	0	0	115.1	E880	E880-G882 VanDerWaalsContact C-N 3.32Å; E880-G882 PolarHBondContact O-N 3.49Å; E880-G882 VanDerWaalsContact O-N 3.1Å
883	S	27.3	Very low	26.9	Very low	128 Å²	128	130.8 Å²	130.8	90%	0.895	78%	0.777	S	S	*	*			trans	-173.3	157.5	146	51.7	0	0	0	0	111.2
884	G	29.7	Very low	26.8	Very low	80 Å²	80	132.1 Å²	132.1	83%	0.825	78%	0.778	S	S	*	*			trans	100.9	84.9	167.8	0	0	0	0	0	116
885	S	26.3	Very low	26.3	Very low	133 Å²	133	131.7 Å²	131.7	93%	0.93	79%	0.788	S	S	*	*			trans	-77.4	130.2	167.7	48.5	0	0	0	0	111.6
886	G	27	Very low	26.5	Very low	69 Å²	69	126.5 Å²	126.5	71%	0.711	78%	0.775	S	S	*	*			trans	-165.3	128.3	174.5	0	0	0	0	0	112.5	P888	G886-P888 WeakPolarHBondContact O-CD 3.33Å
887	N	26.1	Very low	26.6	Very low	164 Å²	164	126.2 Å²	126.2	88%	0.877	78%	0.778	S	S	*	*			trans	-69.5	124.1	179.4	-85.3	-20.6	0	0	0	111.8	S889	N887-S889 PolarHBondContact O-N 3.08Å
888	P	28.7	Very low	27.6	Very low	125 Å²	125	128.8 Å²	128.8	81%	0.812	79%	0.785	S	S	*	*			trans	-82	104.6	166.6	32	-30.4	0	0	0	110.1	G886	G886-P888 WeakPolarHBondContact O-CD 3.33Å
889	S	23.7	Very low	29	Very low	91 Å²	91	123.9 Å²	123.9	64%	0.636	77%	0.772	S	S	*	*			trans	-69.4	146.8	163.5	-61.9	0	0	0	0	109.9	N887 I891	N887-S889 PolarHBondContact O-N 3.08Å; S889-I891 PolarHBondContact O-N 3.33Å
890	P	26.8	Very low	30.6	Very low	137 Å²	137	115.9 Å²	115.9	89%	0.89	74%	0.736	S	S	*	*			trans	-74.2	89.6	-176.3	29.9	-35.1	0	0	0	111.8
891	I	24.9	Very low	33.2	Very low	129 Å²	129	109.1 Å²	109.1	66%	0.662	70%	0.704	S	S	*	*			trans	-85.3	124.6	175.3	-63.7	178.1	0	0	0	110.2	S889 H893	S889-I891 PolarHBondContact O-N 3.33Å; I891-H893 PolarHBondContact O-CD2 2.95Å; I891-H893 PolarHBondContact O-N 3.36Å
892	S	22.4	Very low	36	Very low	97 Å²	97	104.3 Å²	104.3	68%	0.678	67%	0.669	S	S	*	*			trans	-78.4	95.1	-174.6	55.4	0	0	0	0	113.2	H894	S892-H894 PolarHBondContact O-N 3.49Å; S892-H894 VanDerWaalsContact O-N 3.14Å
893	H	24.3	Very low	39.1	Very low	155 Å²	155	101 Å²	101	72%	0.718	63%	0.634	S	S	*	*			trans	-85	74.6	178.4	-78.2	-81.5	0	0	0	114.1	I891 T895	I891-H893 PolarHBondContact O-CD2 2.95Å; I891-H893 PolarHBondContact O-N 3.36Å; H893-T895 VanDerWaalsContact C-N 3.31Å; H893-T895 PolarHBondContact O-N 2.98Å
894	H	23.4	Very low	42.1	Very low	177 Å²	177	96.2 Å²	96.2	82%	0.819	60%	0.596	S	S	*	*			trans	-77.4	63.1	170.4	-80.5	-77	0	0	0	113.6	S892	S892-H894 PolarHBondContact O-N 3.49Å; S892-H894 VanDerWaalsContact O-N 3.14Å
895	T	22.9	Very low	45.2	Very low	108 Å²	108	92.4 Å²	92.4	66%	0.663	56%	0.557	S	S	*	*			trans	-152.4	31.4	168.5	43.1	0	0	0	0	115.1	K838 H893	K838-T895 PolarHBondContact NZ-O 3.46Å; H893-T895 VanDerWaalsContact C-N 3.31Å; H893-T895 PolarHBondContact O-N 2.98Å
896	G	27.7	Very low	48.3	Very low	64 Å²	64	88.5 Å²	88.5	66%	0.66	53%	0.528	S	S	*	.	S	Bend	trans	-103.2	143.3	172.4	0	0	0	0	0	113.2	N898	G896-N898 PolarHBondContact O-N 2.95Å
897	S	34.3	Very low	51.3	Low	96 Å²	96	86.4 Å²	86.4	67%	0.671	50%	0.499	S	S	*	.			trans	-74.6	106.7	175.8	36.7	0	0	0	0	110.6	Q899	S897-Q899 PolarHBondContact O-N 3.31Å
898	N	47.6	Very low	54.5	Low	168 Å²	168	79 Å²	79	90%	0.898	46%	0.459	S	S	*	.			trans	-78.2	42.2	-175.3	-154.8	13.8	0	0	0	112.9	G896	G896-N898 PolarHBondContact O-N 2.95Å
899	Q	58.1	Low	57.5	Low	118 Å²	118	80.1 Å²	80.1	55%	0.551	45%	0.454	S	S	*	.			trans	-76.8	140	179.2	-72.4	-81.3	27.5	0	0	110.2	S897 Q901	S897-Q899 PolarHBondContact O-N 3.31Å; Q899-Q901 PolarHBondContact O-N 3.34Å
900	P	60.4	Low	60.9	Low	18 Å²	18	77.6 Å²	77.6	12%	0.117	44%	0.436	C	S	.	.			trans	-69.4	128.2	170.3	27.6	-31.5	0	0	0	111.1	I517 L529 F903	I517-P900 HydrophobicContact CB-CB 4.26Å; I517-P900 HydrophobicContact CD1-CB 3.87Å; I517-P900 HydrophobicContact CD1-CG 3.76Å; I517-P900 HydrophobicContact CG1-CB 3.76Å; I517-P900 HydrophobicContact CG1-CG 4.01Å; I517-P900 HydrophobicContact CG2-CB 3.53Å; L529-P900 HydrophobicContact CD1-CG 4.44Å; P900-F903 HydrophobicContact CB-CE1 3.94Å; P900-F903 HydrophobicContact CB-CZ 4.03Å; P900-F903 HydrophobicContact CG-CE1 3.65Å; P900-F903 HydrophobicContact CG-CZ 3.68Å; P900-F903 WeakPolarHBondContact O-CE2 3.25Å; P900-F903 VanDerWaalsContact O-CZ 3.25Å; P900-F903 WeakPolarHBondContact O-CZ 3.41Å
901	Q	79.2	Confident	64	Low	42 Å²	42	72 Å²	72	20%	0.196	40%	0.4	C	S	.	.			trans	-105.4	-0.9	-175.7	-75	177.2	-33.3	0	0	114	E843 A859 P866 S868 Q899	E843-Q901 PolarHBondContact OE1-NE2 3.43Å; A859-Q901 HydrophobicContact CB-CB 3.79Å; A859-Q901 HydrophobicContact CB-CG 3.91Å; A859-Q901 PolarHBondContact N-O 2.92Å; P866-Q901 VanDerWaalsContact CG-CD 3.43Å; P866-Q901 HydrophobicContact CG-CG 4.36Å; P866-Q901 VanDerWaalsContact CG-OE1 3.28Å; S868-Q901 PolarHBondContact OG-OE1 3.12Å; Q899-Q901 PolarHBondContact O-N 3.34Å
902	H	88.7	Confident	67.3	Low	20 Å²	20	65.9 Å²	65.9	9%	0.093	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	124.9	178.1	-173.7	-172.3	0	0	0	109.8	V518 E856 V857	V518-H902 HydrophobicContact CB-CB 4.11Å; V518-H902 WeakPolarHBondContact CB-ND1 3.46Å; V518-H902 PolarHBondContact N-O 2.85Å; E856-H902 IonicContact OE2-CD2 2.77Å; E856-H902 IonicContact OE2-CE1 3.89Å; E856-H902 PolarHBondContact OE2-CE1 2.9Å; E856-H902 VanDerWaalsContact OE2-CE1 3.26Å; E856-H902 IonicContact OE2-NE2 2.99Å; E856-H902 PolarHBondContact OE2-NE2 3.49Å; V857-H902 CarbonylContact O-C 3.56Å; V857-H902 WeakPolarHBondContact O-CA 3.43Å
903	F	91.1	Very high	70.8	Confident	3 Å²	3	62.5 Å²	62.5	1%	0.013	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	151.2	177.5	-50.6	-89.2	0	0	0	110.5	F516 I517 W845 E856 V857 P900 L905 P939 Y940	F516-F903 CarbonylContact O-C 3.56Å; F516-F903 WeakPolarHBondContact O-CA 3.4Å; I517-F903 HydrophobicContact CG1-CD1 3.87Å; I517-F903 HydrophobicContact CG1-CE1 3.83Å; W845-F903 HydrophobicContact CH2-CE2 4.11Å; W845-F903 HydrophobicContact CZ3-CD2 4.28Å; W845-F903 AromaticContact CZ3-CE2 3.78Å; W845-F903 HydrophobicContact CZ3-CE2 3.78Å; E856-F903 CarbonylContact C-O 3.22Å; E856-F903 WeakPolarHBondContact CA-O 3.49Å; V857-F903 HydrophobicContact CB-CB 4.38Å; V857-F903 HydrophobicContact CB-CD2 4.49Å; V857-F903 PolarHBondContact N-O 3.25Å; V857-F903 PolarHBondContact O-N 3.22Å; P900-F903 HydrophobicContact CB-CE1 3.94Å; P900-F903 HydrophobicContact CB-CZ 4.03Å; P900-F903 HydrophobicContact CG-CE1 3.65Å; P900-F903 HydrophobicContact CG-CZ 3.68Å; P900-F903 WeakPolarHBondContact O-CE2 3.25Å; P900-F903 VanDerWaalsContact O-CZ 3.25Å; P900-F903 WeakPolarHBondContact O-CZ 3.41Å; F903-L905 HydrophobicContact CB-CD2 4.46Å; F903-P939 WeakPolarHBondContact CD2-O 3.27Å; F903-P939 HydrophobicContact CE2-CB 3.92Å; F903-P939 HydrophobicContact CE2-CG 4.06Å; F903-P939 HydrophobicContact CZ-CG 4.36Å; F903-Y940 VanDerWaalsContact CE1-CB 3.45Å
904	R	91.6	Very high	74.2	Confident	26 Å²	26	55.7 Å²	55.7	10%	0.098	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	132	171.7	178.7	-175.5	-67.1	137	14.2	109	F516 V518 T524 E854 V855 E856 T906	F516-R904 PolarHBondContact N-O 3.26Å; F516-R904 PolarHBondContact O-N 3.41Å; V518-R904 HydrophobicContact CG2-CB 3.87Å; T524-R904 VanDerWaalsContact CG2-NH1 3.35Å; E854-R904 HydrophobicContact CB-CG 4.28Å; E854-R904 HydrophobicContact CG-CG 4.45Å; E854-R904 VanDerWaalsContact OE1-CD 3.27Å; E854-R904 WeakPolarHBondContact OE1-CD 3.43Å; E854-R904 IonicContact OE1-NE 3.92Å; E854-R904 IonicContact OE2-NE 2.75Å; V855-R904 CarbonylContact O-C 3.58Å; V855-R904 WeakPolarHBondContact O-CA 3.28Å; E856-R904 HydrophobicContact CG-CB 4.38Å; E856-R904 HydrophobicContact CG-CG 4.29Å; E856-R904 IonicContact OE1-CZ 2.92Å; E856-R904 IonicContact OE1-NE 3.94Å; E856-R904 PolarHBondContact OE1-NE 2.94Å; E856-R904 IonicContact OE1-NH2 3.78Å; E856-R904 PolarHBondContact OE1-NH2 3.45Å; R904-T906 HydrophobicContact CG-CG2 4.06Å
905	L	93.5	Very high	77.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.6	-175.9	-38.2	176.6	0	0	0	109.1	Y514 S515 V855 V857 F903 F924 W936	Y514-L905 CarbonylContact O-C 3.59Å; Y514-L905 VanDerWaalsContact O-CA 3.3Å; Y514-L905 WeakPolarHBondContact O-CA 3.5Å; S515-L905 WeakPolarHBondContact OG-CD2 3.21Å; V855-L905 HydrophobicContact CB-CB 4.17Å; V855-L905 HydrophobicContact CB-CD1 4.44Å; V855-L905 HydrophobicContact CB-CG 4.47Å; V855-L905 HydrophobicContact CG1-CD1 4.41Å; V855-L905 PolarHBondContact N-O 3.38Å; V855-L905 PolarHBondContact O-N 2.86Å; V857-L905 HydrophobicContact CG2-CD1 3.98Å; V857-L905 HydrophobicContact CG2-CG 4.45Å; F903-L905 HydrophobicContact CB-CD2 4.46Å; L905-F924 HydrophobicContact CD1-CE2 4.46Å; L905-F924 HydrophobicContact CD1-CZ 3.77Å; L905-W936 HydrophobicContact CB-CE3 4.42Å; L905-W936 HydrophobicContact CB-CH2 3.78Å; L905-W936 HydrophobicContact CB-CZ2 4.29Å; L905-W936 HydrophobicContact CB-CZ3 3.88Å; L905-W936 HydrophobicContact CD1-CD2 3.86Å; L905-W936 HydrophobicContact CD1-CE3 3.75Å; L905-W936 HydrophobicContact CD1-CG 4.25Å; L905-W936 HydrophobicContact CD1-CH2 4.47Å; L905-W936 HydrophobicContact CD1-CZ3 4.07Å; L905-W936 HydrophobicContact CG-CZ3 4.41Å
906	T	91.5	Very high	81.1	Confident	52 Å²	52	45.1 Å²	45.1	32%	0.319	26%	0.255	S	S	.	.			trans	-135.5	58.1	-168.9	69.3	0	0	0	0	112	Y514 F516 E854 R904	Y514-T906 WeakPolarHBondContact CD1-O 3.39Å; Y514-T906 PolarHBondContact O-N 2.86Å; F516-T906 HydrophobicContact CD2-CG2 4.42Å; F516-T906 HydrophobicContact CE2-CG2 4.44Å; F516-T906 WeakPolarHBondContact CE2-OG1 3.25Å; E854-T906 HydrophobicContact CG-CG2 4.37Å; R904-T906 HydrophobicContact CG-CG2 4.06Å
907	H	91.5	Very high	84.3	Confident	25 Å²	25	42.7 Å²	42.7	12%	0.116	23%	0.226	C	C	.	.			trans	-102.8	-28.2	175.6	-168.2	74.2	0	0	0	113.5	Y514 Q932 W936 E946	Y514-H907 HydrophobicContact CD1-CB 4.07Å; Y514-H907 AromaticContact CD1-ND1 3.47Å; Y514-H907 WeakPolarHBondContact CD1-ND1 3.48Å; Y514-H907 HydrophobicContact CD2-CB 4.44Å; Y514-H907 AromaticContact CD2-ND1 3.46Å; Y514-H907 WeakPolarHBondContact CD2-ND1 3.5Å; Y514-H907 AromaticContact CE1-ND1 3.29Å; Y514-H907 VanDerWaalsContact CE1-ND1 3.29Å; Y514-H907 WeakPolarHBondContact CE1-ND1 3.41Å; Y514-H907 AromaticContact CE2-CE1 3.81Å; Y514-H907 AromaticContact CE2-ND1 3.32Å; Y514-H907 VanDerWaalsContact CE2-ND1 3.32Å; Y514-H907 WeakPolarHBondContact CE2-ND1 3.42Å; Y514-H907 HydrophobicContact CG-CB 3.92Å; Y514-H907 AromaticContact CG-ND1 3.55Å; Y514-H907 AromaticContact CZ-CE1 3.68Å; Y514-H907 AromaticContact CZ-ND1 3.21Å; H907-Q932 PolarHBondContact CD2-OE1 2.97Å; H907-Q932 PolarHBondContact NE2-NE2 2.9Å; H907-W936 HydrophobicContact CB-CH2 3.47Å; H907-W936 VanDerWaalsContact CB-CH2 3.47Å; H907-W936 HydrophobicContact CB-CZ2 3.9Å; H907-E946 IonicContact CD2-OE2 3.48Å; H907-E946 IonicContact CE1-OE2 3.93Å; H907-E946 IonicContact NE2-OE2 3.64Å; H907-E946 PolarHBondContact NE2-OE2 3.47Å
908	H	92.4	Very high	87.1	Confident	7 Å²	7	38.2 Å²	38.2	3%	0.032	20%	0.195	C	C	.	.			trans	-67.5	139.7	174.6	-81.7	-70.6	0	0	0	110.9	S853 V912 T926 D930 N934	S853-H908 WeakPolarHBondContact CB-O 3.39Å; S853-H908 PolarHBondContact OG-O 2.83Å; H908-V912 HydrophobicContact CB-CG2 4.2Å; H908-T926 PolarHBondContact NE2-OG1 3.17Å; H908-D930 WeakPolarHBondContact CA-OD2 3.46Å; H908-D930 VanDerWaalsContact CB-OD2 3.32Å; H908-D930 WeakPolarHBondContact CB-OD2 3.24Å; H908-D930 IonicContact CE1-OD1 3.33Å; H908-D930 IonicContact CG-OD2 2.78Å; H908-D930 IonicContact ND1-OD1 3.2Å; H908-D930 PolarHBondContact ND1-OD1 3.47Å; H908-D930 IonicContact ND1-OD2 3.55Å; H908-D930 PolarHBondContact ND1-OD2 2.76Å; H908-N934 PolarHBondContact CE1-ND2 2.94Å; H908-N934 PolarHBondContact NE2-ND2 3.47Å; H908-N934 VanDerWaalsContact NE2-ND2 3.12Å
909	E	92.3	Very high	88.9	Confident	150 Å²	150	33.9 Å²	33.9	70%	0.701	17%	0.169	S	C	*	.	S	Bend	trans	-92.1	-8.3	178.1	-60.5	-177.3	136	0	0	112	D930 K948	E909-D930 HydrophobicContact CB-CB 4.06Å; E909-D930 PolarHBondContact N-OD2 3.15Å; E909-K948 IonicContact OE2-NZ 3.52Å
910	S	93.4	Very high	90.2	Very high	37 Å²	37	34.6 Å²	34.6	26%	0.259	17%	0.172	S	C	.	.	S	Bend	trans	-154.2	-179.3	179.4	-158.3	0	0	0	0	111.4	S853 V912	S853-S910 WeakPolarHBondContact CA-O 3.42Å; S853-S910 VanDerWaalsContact CB-C 3.48Å; S853-S910 WeakPolarHBondContact CB-O 3.38Å; S910-V912 PolarHBondContact O-N 3.42Å
911	C	92.4	Very high	91.4	Very high	20 Å²	20	34.3 Å²	34.3	14%	0.135	17%	0.172	C	C	.	.			trans	-48	136.1	-171.6	-45.1	0	0	0	0	113.8	F784 E851 L913 G928 K929	F784-C911 HydrophobicContact CD2-CB 3.95Å; F784-C911 HydrophobicContact CE2-CB 3.77Å; E851-C911 WeakPolarHBondContact O-CA 3.28Å; E851-C911 PolarHBondContact O-SG 2.91Å; C911-L913 HydrophobicContact CB-CD2 3.97Å; C911-L913 PolarHBondContact O-N 3.28Å; C911-G928 WeakPolarHBondContact O-CA 3.39Å; C911-K929 HydrophobicContact CB-CB 4.4Å; C911-K929 PolarHBondContact O-N 2.75Å
912	V	95	Very high	91.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	104.8	177.6	-173	0	0	0	0	109.3	S785 L850 V855 H908 S910 T926 T927	S785-V912 PolarHBondContact OG-O 2.7Å; L850-V912 PolarHBondContact O-N 2.71Å; V855-V912 HydrophobicContact CG2-CG1 4.16Å; V855-V912 HydrophobicContact CG2-CG2 3.81Å; H908-V912 HydrophobicContact CB-CG2 4.2Å; S910-V912 PolarHBondContact O-N 3.42Å; V912-T926 HydrophobicContact CG1-CG2 4.29Å; V912-T927 CarbonylContact C-O 3.59Å
913	L	95.3	Very high	92	Very high	26 Å²	26	35.4 Å²	35.4	14%	0.136	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-33.3	-166.3	-58	-177.5	0	0	0	113.2	A266 F784 C911 T927 K929 L954	A266-L913 HydrophobicContact CB-CD1 4.36Å; A266-L913 HydrophobicContact CB-CD2 4.38Å; F784-L913 HydrophobicContact CD2-CD2 4.25Å; C911-L913 HydrophobicContact CB-CD2 3.97Å; C911-L913 PolarHBondContact O-N 3.28Å; L913-T927 PolarHBondContact N-O 3.44Å; L913-K929 HydrophobicContact CD1-CB 4.02Å; L913-K929 HydrophobicContact CD2-CB 4.5Å; L913-K929 HydrophobicContact CG-CB 4.33Å; L913-L954 HydrophobicContact CD1-CD2 3.54Å
914	A	95.6	Very high	92.3	Very high	12 Å²	12	35.2 Å²	35.2	10%	0.099	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	154.1	175.2	0	0	0	0	0	112.4	T926 T927	A914-T926 CarbonylContact O-C 3.59Å; A914-T926 WeakPolarHBondContact O-CA 3.44Å; A914-T927 PolarHBondContact N-O 3.1Å; A914-T927 PolarHBondContact O-N 3.03Å
915	L	95.6	Very high	92.5	Very high	11 Å²	11	34 Å²	34	6%	0.058	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	136	179.8	-167.8	153.9	0	0	0	108.8	A847 V855 F917 F924 L925 T926	A847-L915 HydrophobicContact CB-CD1 3.63Å; A847-L915 HydrophobicContact CB-CD2 3.88Å; A847-L915 HydrophobicContact CB-CG 4.42Å; V855-L915 HydrophobicContact CG1-CD1 3.99Å; L915-F917 HydrophobicContact CD2-CD2 4.13Å; L915-F917 HydrophobicContact CD2-CE2 4.17Å; L915-F924 HydrophobicContact CD1-CD2 4.36Å; L915-F924 HydrophobicContact CD1-CE2 4.35Å; L915-F924 HydrophobicContact CD2-CD2 4.26Å; L915-F924 HydrophobicContact CG-CD2 4.21Å; L915-L925 VanDerWaalsContact CA-O 3.32Å; L915-L925 WeakPolarHBondContact CA-O 3.24Å; L915-T926 HydrophobicContact CB-CG2 4.43Å; L915-T926 HydrophobicContact CD1-CG2 3.8Å; L915-T926 HydrophobicContact CG-CG2 3.88Å
916	R	95.2	Very high	92.7	Very high	52 Å²	52	34 Å²	34	20%	0.196	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	126.5	175.7	-159.9	69.1	165	125.1	19.2	111	E744 F924 L925 D957 I958	E744-R916 IonicContact OE1-CZ 2.64Å; E744-R916 IonicContact OE1-NH1 2.77Å; E744-R916 PolarHBondContact OE1-NH1 3.48Å; E744-R916 IonicContact OE2-NH1 3.45Å; R916-F924 CarbonylContact O-C 3.51Å; R916-F924 WeakPolarHBondContact O-CA 3.43Å; R916-F924 WeakPolarHBondContact O-CB 3.33Å; R916-L925 PolarHBondContact N-O 2.78Å; R916-L925 PolarHBondContact O-N 2.66Å; R916-D957 IonicContact CZ-OD1 3.52Å; R916-D957 IonicContact NE-OD1 2.84Å; R916-D957 PolarHBondContact NE-OD1 3.27Å; R916-D957 IonicContact NH2-OD1 3.91Å; R916-D957 PolarHBondContact NH2-OD1 3.03Å; R916-I958 HydrophobicContact CB-CD1 4.09Å; R916-I958 HydrophobicContact CB-CG1 4.21Å; R916-I958 HydrophobicContact CG-CD1 4.18Å; R916-I958 HydrophobicContact CG-CG1 4.04Å
917	F	94.7	Very high	93	Very high	13 Å²	13	31.5 Å²	31.5	6%	0.057	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	143.6	169.3	-86.5	-92.3	0	0	0	110.7	G787 W845 A847 L915 F924 T938	G787-F917 WeakPolarHBondContact O-CE2 3.46Å; W845-F917 HydrophobicContact CB-CZ 4.25Å; A847-F917 HydrophobicContact CB-CE2 3.64Å; A847-F917 HydrophobicContact CB-CZ 3.86Å; L915-F917 HydrophobicContact CD2-CD2 4.13Å; L915-F917 HydrophobicContact CD2-CE2 4.17Å; F917-F924 HydrophobicContact CB-CB 4.39Å; F917-F924 HydrophobicContact CD1-CB 3.77Å; F917-F924 HydrophobicContact CD1-CD1 4.37Å; F917-F924 HydrophobicContact CD1-CG 4.44Å; F917-F924 HydrophobicContact CD2-CB 4.27Å; F917-F924 HydrophobicContact CE1-CB 4.05Å; F917-F924 AromaticContact CE1-CD1 3.83Å; F917-F924 HydrophobicContact CE1-CD1 3.83Å; F917-F924 HydrophobicContact CE1-CG 4.22Å; F917-F924 HydrophobicContact CG-CB 3.89Å; F917-F924 HydrophobicContact CZ-CB 4.42Å; F917-F924 HydrophobicContact CZ-CD1 4.08Å; F917-F924 HydrophobicContact CZ-CG 4.35Å; F917-T938 HydrophobicContact CE1-CG2 4.01Å
918	A	93.3	Very high	93.1	Very high	3 Å²	3	30.3 Å²	30.3	3%	0.025	15%	0.153	C	C	.	.			trans	-65.5	151.7	165.7	0	0	0	0	0	110.2	H920 A921 W923 D962	A918-H920 VanDerWaalsContact C-N 3.27Å; A918-H920 PolarHBondContact O-N 3.34Å; A918-A921 WeakPolarHBondContact O-CA 3.46Å; A918-A921 PolarHBondContact O-N 3.2Å; A918-W923 HydrophobicContact CB-CD2 3.66Å; A918-W923 VanDerWaalsContact CB-CE2 3.41Å; A918-W923 HydrophobicContact CB-CE3 4.29Å; A918-W923 HydrophobicContact CB-CG 3.91Å; A918-W923 HydrophobicContact CB-CH2 4.5Å; A918-W923 HydrophobicContact CB-CZ2 3.89Å; A918-W923 WeakPolarHBondContact CB-O 3.32Å; A918-W923 PolarHBondContact N-O 3.43Å; A918-D962 WeakPolarHBondContact CA-OD1 3.42Å; A918-D962 WeakPolarHBondContact CB-OD1 3.45Å
919	H	87.1	Confident	93.1	Very high	77 Å²	77	33.8 Å²	33.8	36%	0.356	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.4	-179.8	-79.7	-87	0	0	0	113.1	A921 S959 L960 D962	H919-A921 VanDerWaalsContact C-N 3.27Å; H919-S959 PolarHBondContact CD2-O 3.31Å; H919-L960 VanDerWaalsContact CE1-CD2 3.47Å; H919-L960 WeakPolarHBondContact CE1-CD2 3.44Å; H919-D962 IonicContact CD2-OD1 3.25Å; H919-D962 PolarHBondContact N-OD1 2.92Å; H919-D962 PolarHBondContact N-OD2 2.89Å
920	H	84.2	Confident	93.2	Very high	132 Å²	132	27.3 Å²	27.3	61%	0.611	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-2.3	168.5	-73.1	-62	0	0	0	114.4	A918 D922 D962	A918-H920 VanDerWaalsContact C-N 3.27Å; A918-H920 PolarHBondContact O-N 3.34Å; H920-D922 PolarHBondContact O-N 3.38Å; H920-D962 WeakPolarHBondContact CB-OD2 3.46Å; H920-D962 IonicContact CD2-OD2 3.1Å; H920-D962 PolarHBondContact CD2-OD2 2.87Å; H920-D962 VanDerWaalsContact CD2-OD2 3.27Å; H920-D962 IonicContact CG-OD2 3.05Å; H920-D962 PolarHBondContact N-OD2 3.34Å
921	A	85.3	Confident	93.3	Very high	13 Å²	13	27.4 Å²	27.4	11%	0.107	14%	0.135	C	C	.	.	S	Bend	trans	59.1	-12.1	177	0	0	0	0	0	117.8	A918 H919 W923 T938	A918-A921 WeakPolarHBondContact O-CA 3.46Å; A918-A921 PolarHBondContact O-N 3.2Å; H919-A921 VanDerWaalsContact C-N 3.27Å; A921-W923 PolarHBondContact O-N 3.38Å; A921-W923 VanDerWaalsContact O-N 3.09Å; A921-T938 WeakPolarHBondContact O-CB 3.37Å; A921-T938 WeakPolarHBondContact O-CG2 3.37Å; A921-T938 PolarHBondContact O-OG1 3.49Å
922	D	89	Confident	93.4	Very high	82 Å²	82	26.9 Å²	26.9	44%	0.439	13%	0.13	S	C	.	.	S	Bend	trans	-57.4	-21.7	175.7	-85.2	-48.5	0	0	0	113.9	L541 H920 T938	L541-D922 HydrophobicContact CD2-CB 4.36Å; H920-D922 PolarHBondContact O-N 3.38Å; D922-T938 PolarHBondContact O-N 3.18Å
923	W	92.9	Very high	93.5	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.008	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	166.4	178.4	65.2	-80.2	0	0	0	112.3	P542 A918 A921 L925 A935 W936 T938 L944 I958 D962 V965 V979	P542-W923 HydrophobicContact CG-CB 4.5Å; P542-W923 HydrophobicContact CG-CD2 3.61Å; P542-W923 HydrophobicContact CG-CE3 3.88Å; P542-W923 HydrophobicContact CG-CG 3.91Å; P542-W923 HydrophobicContact CG-CZ2 4.34Å; P542-W923 HydrophobicContact CG-CZ3 4.35Å; A918-W923 HydrophobicContact CB-CD2 3.66Å; A918-W923 VanDerWaalsContact CB-CE2 3.41Å; A918-W923 HydrophobicContact CB-CE3 4.29Å; A918-W923 HydrophobicContact CB-CG 3.91Å; A918-W923 HydrophobicContact CB-CH2 4.5Å; A918-W923 HydrophobicContact CB-CZ2 3.89Å; A918-W923 WeakPolarHBondContact CB-O 3.32Å; A918-W923 PolarHBondContact N-O 3.43Å; A921-W923 PolarHBondContact O-N 3.38Å; A921-W923 VanDerWaalsContact O-N 3.09Å; W923-L925 HydrophobicContact CZ3-CB 4.36Å; W923-L925 HydrophobicContact CZ3-CD1 4.3Å; W923-A935 HydrophobicContact CE3-CB 4.02Å; W923-A935 HydrophobicContact CZ3-CB 4.23Å; W923-W936 CarbonylContact C-O 3.55Å; W923-W936 WeakPolarHBondContact CA-O 3.35Å; W923-W936 VanDerWaalsContact CB-O 3.23Å; W923-W936 WeakPolarHBondContact CB-O 3.28Å; W923-T938 PolarHBondContact N-OG1 2.96Å; W923-L944 HydrophobicContact CB-CD1 3.8Å; W923-I958 HydrophobicContact CH2-CD1 4.07Å; W923-I958 HydrophobicContact CH2-CG2 4.39Å; W923-I958 HydrophobicContact CZ3-CD1 4.05Å; W923-D962 HydrophobicContact CZ2-CB 4.18Å; W923-V965 HydrophobicContact CH2-CG2 4.34Å; W923-V979 HydrophobicContact CH2-CG1 4.42Å; W923-V979 HydrophobicContact CH2-CG2 4.34Å; W923-V979 HydrophobicContact CZ2-CG1 4.19Å
924	F	95.9	Very high	93.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	158.4	173.2	64.4	-88.3	0	0	0	111.2	A847 V855 V857 L905 L915 R916 F917 T926 A935 W936	A847-F924 HydrophobicContact CB-CE2 4.36Å; A847-F924 HydrophobicContact CB-CZ 4.46Å; V855-F924 HydrophobicContact CG1-CE2 4.32Å; V857-F924 HydrophobicContact CG2-CE1 4.14Å; V857-F924 HydrophobicContact CG2-CZ 3.68Å; L905-F924 HydrophobicContact CD1-CE2 4.46Å; L905-F924 HydrophobicContact CD1-CZ 3.77Å; L915-F924 HydrophobicContact CD1-CD2 4.36Å; L915-F924 HydrophobicContact CD1-CE2 4.35Å; L915-F924 HydrophobicContact CD2-CD2 4.26Å; L915-F924 HydrophobicContact CG-CD2 4.21Å; R916-F924 CarbonylContact O-C 3.51Å; R916-F924 WeakPolarHBondContact O-CA 3.43Å; R916-F924 WeakPolarHBondContact O-CB 3.33Å; F917-F924 HydrophobicContact CB-CB 4.39Å; F917-F924 HydrophobicContact CD1-CB 3.77Å; F917-F924 HydrophobicContact CD1-CD1 4.37Å; F917-F924 HydrophobicContact CD1-CG 4.44Å; F917-F924 HydrophobicContact CD2-CB 4.27Å; F917-F924 HydrophobicContact CE1-CB 4.05Å; F917-F924 AromaticContact CE1-CD1 3.83Å; F917-F924 HydrophobicContact CE1-CD1 3.83Å; F917-F924 HydrophobicContact CE1-CG 4.22Å; F917-F924 HydrophobicContact CG-CB 3.89Å; F917-F924 HydrophobicContact CZ-CB 4.42Å; F917-F924 HydrophobicContact CZ-CD1 4.08Å; F917-F924 HydrophobicContact CZ-CG 4.35Å; F924-T926 HydrophobicContact CD2-CG2 4.04Å; F924-T926 HydrophobicContact CE2-CG2 3.89Å; F924-A935 CarbonylContact O-C 3.56Å; F924-A935 WeakPolarHBondContact O-CA 3.48Å; F924-W936 HydrophobicContact CD1-CB 4.09Å; F924-W936 HydrophobicContact CD2-CB 4.14Å; F924-W936 AromaticContact CD2-CD1 3.98Å; F924-W936 HydrophobicContact CD2-CG 4.39Å; F924-W936 HydrophobicContact CE1-CB 3.69Å; F924-W936 HydrophobicContact CE2-CB 3.73Å; F924-W936 AromaticContact CE2-CD1 3.59Å; F924-W936 AromaticContact CE2-CG 3.81Å; F924-W936 HydrophobicContact CE2-CG 3.81Å; F924-W936 HydrophobicContact CG-CB 4.31Å; F924-W936 HydrophobicContact CZ-CB 3.49Å; F924-W936 VanDerWaalsContact CZ-CB 3.49Å; F924-W936 AromaticContact CZ-CG 3.92Å; F924-W936 HydrophobicContact CZ-CG 3.92Å; F924-W936 PolarHBondContact N-O 2.94Å; F924-W936 PolarHBondContact O-N 3.35Å
925	L	97	Very high	93.5	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	142.8	178.7	-160.9	77.8	0	0	0	110.2	L545 L915 R916 W923 V933 N934 A935 C956 I958 V965	L545-L925 HydrophobicContact CD1-CD1 4.31Å; L915-L925 VanDerWaalsContact CA-O 3.32Å; L915-L925 WeakPolarHBondContact CA-O 3.24Å; R916-L925 PolarHBondContact N-O 2.78Å; R916-L925 PolarHBondContact O-N 2.66Å; W923-L925 HydrophobicContact CZ3-CB 4.36Å; W923-L925 HydrophobicContact CZ3-CD1 4.3Å; L925-V933 HydrophobicContact CD1-CG1 3.93Å; L925-V933 HydrophobicContact CD2-CG1 4.01Å; L925-V933 HydrophobicContact CG-CG1 4.16Å; L925-N934 CarbonylContact C-O 3.59Å; L925-N934 WeakPolarHBondContact CA-O 3.43Å; L925-N934 WeakPolarHBondContact CD1-O 3.44Å; L925-A935 HydrophobicContact CD1-CB 3.97Å; L925-C956 HydrophobicContact CD2-CB 3.95Å; L925-I958 HydrophobicContact CB-CD1 4.14Å; L925-V965 HydrophobicContact CD2-CG1 3.56Å; L925-V965 HydrophobicContact CD2-CG2 4.39Å
926	T	97.6	Very high	93.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147.5	166.4	62.8	0	0	0	0	110.8	V855 H908 V912 A914 L915 F924 N934 W936	V855-T926 HydrophobicContact CG1-CG2 4.41Å; V855-T926 HydrophobicContact CG2-CG2 4.1Å; H908-T926 PolarHBondContact NE2-OG1 3.17Å; V912-T926 HydrophobicContact CG1-CG2 4.29Å; A914-T926 CarbonylContact O-C 3.59Å; A914-T926 WeakPolarHBondContact O-CA 3.44Å; L915-T926 HydrophobicContact CB-CG2 4.43Å; L915-T926 HydrophobicContact CD1-CG2 3.8Å; L915-T926 HydrophobicContact CG-CG2 3.88Å; F924-T926 HydrophobicContact CD2-CG2 4.04Å; F924-T926 HydrophobicContact CE2-CG2 3.89Å; T926-N934 PolarHBondContact N-O 3.28Å; T926-N934 PolarHBondContact O-N 3.37Å; T926-W936 PolarHBondContact OG1-NE1 3.27Å
927	T	97	Very high	93.3	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	145.9	174.2	74.4	0	0	0	0	111.6	V912 L913 A914 Q932 V933 V953 C956 T967	V912-T927 CarbonylContact C-O 3.59Å; L913-T927 PolarHBondContact N-O 3.44Å; A914-T927 PolarHBondContact N-O 3.1Å; A914-T927 PolarHBondContact O-N 3.03Å; T927-Q932 WeakPolarHBondContact CA-O 3.16Å; T927-V933 HydrophobicContact CG2-CG1 4.31Å; T927-V933 HydrophobicContact CG2-CG2 4.12Å; T927-V953 WeakPolarHBondContact CB-O 3.23Å; T927-V953 HydrophobicContact CG2-CB 4.45Å; T927-V953 HydrophobicContact CG2-CG1 3.77Å; T927-V953 PolarHBondContact OG1-O 3.37Å; T927-C956 HydrophobicContact CG2-CB 3.75Å; T927-T967 HydrophobicContact CG2-CG2 4.48Å
928	G	93.2	Very high	93	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	160.7	-169.2	0	0	0	0	0	115.5	C911 D930 H931 Q932 V953	C911-G928 WeakPolarHBondContact O-CA 3.39Å; G928-D930 WeakPolarHBondContact CA-OD1 3.45Å; G928-D930 PolarHBondContact O-N 2.95Å; G928-H931 PolarHBondContact O-N 3.21Å; G928-Q932 PolarHBondContact N-O 3.4Å; G928-V953 PolarHBondContact O-N 3.18Å; G928-V953 VanDerWaalsContact O-N 3.1Å
929	K	93	Very high	92.6	Very high	80 Å²	80	25.7 Å²	25.7	35%	0.348	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.3	170.5	-175.4	176.3	176	-177.2	0	112.5	C911 L913 H931 S952	C911-K929 HydrophobicContact CB-CB 4.4Å; C911-K929 PolarHBondContact O-N 2.75Å; L913-K929 HydrophobicContact CD1-CB 4.02Å; L913-K929 HydrophobicContact CD2-CB 4.5Å; L913-K929 HydrophobicContact CG-CB 4.33Å; K929-H931 PolarHBondContact O-CD2 3.18Å; K929-H931 PolarHBondContact O-N 3.39Å; K929-S952 WeakPolarHBondContact O-CB 3.32Å; K929-S952 PolarHBondContact O-OG 3.46Å
930	D	93.6	Very high	92.5	Very high	14 Å²	14	23.7 Å²	23.7	8%	0.075	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	4.7	174.2	57.3	14	0	0	0	115.5	H908 E909 G928 Q932 K948	H908-D930 WeakPolarHBondContact CA-OD2 3.46Å; H908-D930 VanDerWaalsContact CB-OD2 3.32Å; H908-D930 WeakPolarHBondContact CB-OD2 3.24Å; H908-D930 IonicContact CE1-OD1 3.33Å; H908-D930 IonicContact CG-OD2 2.78Å; H908-D930 IonicContact ND1-OD1 3.2Å; H908-D930 PolarHBondContact ND1-OD1 3.47Å; H908-D930 IonicContact ND1-OD2 3.55Å; H908-D930 PolarHBondContact ND1-OD2 2.76Å; E909-D930 HydrophobicContact CB-CB 4.06Å; E909-D930 PolarHBondContact N-OD2 3.15Å; G928-D930 WeakPolarHBondContact CA-OD1 3.45Å; G928-D930 PolarHBondContact O-N 2.95Å; D930-Q932 VanDerWaalsContact C-N 3.26Å; D930-Q932 PolarHBondContact O-N 3.18Å; D930-Q932 WeakPolarHBondContact OD1-CB 3.36Å; D930-Q932 PolarHBondContact OD1-N 3.08Å; D930-K948 WeakPolarHBondContact O-CE 3.33Å; D930-K948 PolarHBondContact O-NZ 3.25Å
931	H	95.8	Very high	92.5	Very high	39 Å²	39	17.4 Å²	17.4	18%	0.181	9%	0.086	C	C	.	.	S	Bend	trans	71.2	7.9	-176.2	-36.4	172.6	0	0	0	114.7	Q259 G928 K929 K948 E949 A951 S952	Q259-H931 PolarHBondContact NE2-CE1 2.83Å; G928-H931 PolarHBondContact O-N 3.21Å; K929-H931 PolarHBondContact O-CD2 3.18Å; K929-H931 PolarHBondContact O-N 3.39Å; H931-K948 HydrophobicContact CB-CG 4.11Å; H931-K948 WeakPolarHBondContact O-CA 3.35Å; H931-E949 WeakPolarHBondContact CB-O 3.43Å; H931-E949 PolarHBondContact O-N 3.44Å; H931-A951 VanDerWaalsContact CB-O 3.26Å; H931-A951 WeakPolarHBondContact CB-O 3.49Å; H931-S952 PolarHBondContact CD2-N 2.95Å
932	Q	95.4	Very high	92.5	Very high	8 Å²	8	16.8 Å²	16.8	4%	0.037	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	148.8	177.2	-74.9	-176.9	-16	0	0	112.7	H907 T927 G928 D930 N934 E946 T947	H907-Q932 PolarHBondContact CD2-OE1 2.97Å; H907-Q932 PolarHBondContact NE2-NE2 2.9Å; T927-Q932 WeakPolarHBondContact CA-O 3.16Å; G928-Q932 PolarHBondContact N-O 3.4Å; D930-Q932 VanDerWaalsContact C-N 3.26Å; D930-Q932 PolarHBondContact O-N 3.18Å; D930-Q932 WeakPolarHBondContact OD1-CB 3.36Å; D930-Q932 PolarHBondContact OD1-N 3.08Å; Q932-N934 PolarHBondContact OE1-ND2 3.16Å; Q932-E946 HydrophobicContact CG-CG 4.43Å; Q932-E946 PolarHBondContact NE2-OE1 3.03Å; Q932-T947 CarbonylContact C-O 3.57Å
933	V	97.2	Very high	92.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	104.6	169.7	179	0	0	0	0	106.1	L545 L925 T927 T947 E949 V953 T967	L545-V933 HydrophobicContact CD1-CG1 3.7Å; L925-V933 HydrophobicContact CD1-CG1 3.93Å; L925-V933 HydrophobicContact CD2-CG1 4.01Å; L925-V933 HydrophobicContact CG-CG1 4.16Å; T927-V933 HydrophobicContact CG2-CG1 4.31Å; T927-V933 HydrophobicContact CG2-CG2 4.12Å; V933-T947 PolarHBondContact N-O 2.97Å; V933-T947 PolarHBondContact O-N 3.43Å; V933-E949 HydrophobicContact CG2-CG 4.33Å; V933-V953 HydrophobicContact CG2-CB 4.22Å; V933-V953 HydrophobicContact CG2-CG1 3.98Å; V933-V953 HydrophobicContact CG2-CG2 3.94Å; V933-T967 HydrophobicContact CG1-CG2 4.3Å; V933-T967 HydrophobicContact CG2-CG2 4.15Å
934	N	95.7	Very high	92.4	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.2	-170.8	-65.8	-43.3	0	0	0	110.1	H908 L925 T926 Q932 W936	H908-N934 PolarHBondContact CE1-ND2 2.94Å; H908-N934 PolarHBondContact NE2-ND2 3.47Å; H908-N934 VanDerWaalsContact NE2-ND2 3.12Å; L925-N934 CarbonylContact C-O 3.59Å; L925-N934 WeakPolarHBondContact CA-O 3.43Å; L925-N934 WeakPolarHBondContact CD1-O 3.44Å; T926-N934 PolarHBondContact N-O 3.28Å; T926-N934 PolarHBondContact O-N 3.37Å; Q932-N934 PolarHBondContact OE1-ND2 3.16Å; N934-W936 HydrophobicContact CB-CZ2 4.3Å
935	A	95.2	Very high	92.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.1	170.6	0	0	0	0	0	111.1	P542 W923 F924 L925 L944 L945	P542-A935 HydrophobicContact CG-CB 4.24Å; W923-A935 HydrophobicContact CE3-CB 4.02Å; W923-A935 HydrophobicContact CZ3-CB 4.23Å; F924-A935 CarbonylContact O-C 3.56Å; F924-A935 WeakPolarHBondContact O-CA 3.48Å; L925-A935 HydrophobicContact CD1-CB 3.97Å; A935-L944 HydrophobicContact CB-CB 4.45Å; A935-L944 WeakPolarHBondContact O-CB 3.43Å; A935-L944 PolarHBondContact O-N 3.12Å; A935-L945 HydrophobicContact CB-CD1 4.16Å; A935-L945 HydrophobicContact CB-CD2 4.07Å; A935-L945 HydrophobicContact CB-CG 3.74Å; A935-L945 PolarHBondContact N-O 3.37Å
936	W	94.1	Very high	91.9	Very high	1 Å²	1	19.5 Å²	19.5	0%	0.004	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.2	-169.9	-57.8	95.7	0	0	0	110.8	L905 H907 W923 F924 T926 N934 A942 C943	L905-W936 HydrophobicContact CB-CE3 4.42Å; L905-W936 HydrophobicContact CB-CH2 3.78Å; L905-W936 HydrophobicContact CB-CZ2 4.29Å; L905-W936 HydrophobicContact CB-CZ3 3.88Å; L905-W936 HydrophobicContact CD1-CD2 3.86Å; L905-W936 HydrophobicContact CD1-CE3 3.75Å; L905-W936 HydrophobicContact CD1-CG 4.25Å; L905-W936 HydrophobicContact CD1-CH2 4.47Å; L905-W936 HydrophobicContact CD1-CZ3 4.07Å; L905-W936 HydrophobicContact CG-CZ3 4.41Å; H907-W936 HydrophobicContact CB-CH2 3.47Å; H907-W936 VanDerWaalsContact CB-CH2 3.47Å; H907-W936 HydrophobicContact CB-CZ2 3.9Å; W923-W936 CarbonylContact C-O 3.55Å; W923-W936 WeakPolarHBondContact CA-O 3.35Å; W923-W936 VanDerWaalsContact CB-O 3.23Å; W923-W936 WeakPolarHBondContact CB-O 3.28Å; F924-W936 HydrophobicContact CD1-CB 4.09Å; F924-W936 HydrophobicContact CD2-CB 4.14Å; F924-W936 AromaticContact CD2-CD1 3.98Å; F924-W936 HydrophobicContact CD2-CG 4.39Å; F924-W936 HydrophobicContact CE1-CB 3.69Å; F924-W936 HydrophobicContact CE2-CB 3.73Å; F924-W936 AromaticContact CE2-CD1 3.59Å; F924-W936 AromaticContact CE2-CG 3.81Å; F924-W936 HydrophobicContact CE2-CG 3.81Å; F924-W936 HydrophobicContact CG-CB 4.31Å; F924-W936 HydrophobicContact CZ-CB 3.49Å; F924-W936 VanDerWaalsContact CZ-CB 3.49Å; F924-W936 AromaticContact CZ-CG 3.92Å; F924-W936 HydrophobicContact CZ-CG 3.92Å; F924-W936 PolarHBondContact N-O 2.94Å; F924-W936 PolarHBondContact O-N 3.35Å; T926-W936 PolarHBondContact OG1-NE1 3.27Å; N934-W936 HydrophobicContact CB-CZ2 4.3Å; W936-A942 CarbonylContact C-O 3.54Å; W936-A942 WeakPolarHBondContact CA-O 3.5Å; W936-C943 HydrophobicContact CE3-CB 4.01Å; W936-C943 HydrophobicContact CZ3-CB 3.94Å
937	R	91.2	Very high	91.8	Very high	46 Å²	46	20.7 Å²	20.7	17%	0.174	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	132.2	173.1	-177.5	161.5	-174.6	-178.7	1.3	112.4	G534 A535 L541 Y940 G941 A942 L944	G534-R937 PolarHBondContact O-NH1 3.48Å; A535-R937 WeakPolarHBondContact O-CD 3.5Å; A535-R937 PolarHBondContact O-NH1 3.17Å; L541-R937 HydrophobicContact CD2-CG 4.28Å; R937-Y940 HydrophobicContact CB-CE2 4.47Å; R937-Y940 WeakPolarHBondContact CD-OH 3.48Å; R937-Y940 HydrophobicContact CG-CE2 4.27Å; R937-Y940 PolarHBondContact NE-OH 2.86Å; R937-Y940 PolarHBondContact NH1-OH 2.93Å; R937-G941 VanDerWaalsContact O-CA 3.26Å; R937-G941 WeakPolarHBondContact O-CA 3.25Å; R937-G941 PolarHBondContact O-N 3.14Å; R937-A942 HydrophobicContact CB-CB 4.16Å; R937-A942 PolarHBondContact N-O 3.3Å; R937-L944 HydrophobicContact CB-CD1 4.17Å; R937-L944 HydrophobicContact CB-CD2 4.1Å; R937-L944 HydrophobicContact CB-CG 4.23Å
938	T	90	Very high	91.7	Very high	16 Å²	16	25.9 Å²	25.9	10%	0.098	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	141	170.5	-50.7	0	0	0	0	110.8	W845 F917 A921 D922 W923	W845-T938 HydrophobicContact CB-CG2 4.38Å; W845-T938 HydrophobicContact CG-CG2 4.1Å; F917-T938 HydrophobicContact CE1-CG2 4.01Å; A921-T938 WeakPolarHBondContact O-CB 3.37Å; A921-T938 WeakPolarHBondContact O-CG2 3.37Å; A921-T938 PolarHBondContact O-OG1 3.49Å; D922-T938 PolarHBondContact O-N 3.18Å; W923-T938 PolarHBondContact N-OG1 2.96Å
939	P	84.1	Confident	91.8	Very high	30 Å²	30	26.6 Å²	26.6	20%	0.195	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	cis	-91.8	-21.3	-9.4	36.2	-35.4	0	0	0	113.6	W845 V857 F903 G941	W845-P939 HydrophobicContact CD2-CB 3.39Å; W845-P939 HydrophobicContact CD2-CG 4.43Å; W845-P939 VanDerWaalsContact CE2-CB 3.44Å; W845-P939 HydrophobicContact CE3-CB 3.47Å; W845-P939 VanDerWaalsContact CE3-CB 3.47Å; W845-P939 HydrophobicContact CG-CB 4.09Å; W845-P939 HydrophobicContact CH2-CB 3.66Å; W845-P939 HydrophobicContact CH2-CG 3.92Å; W845-P939 HydrophobicContact CZ2-CB 3.6Å; W845-P939 HydrophobicContact CZ2-CG 3.76Å; W845-P939 HydrophobicContact CZ3-CB 3.6Å; W845-P939 HydrophobicContact CZ3-CG 4.33Å; V857-P939 WeakPolarHBondContact CG1-O 3.41Å; F903-P939 WeakPolarHBondContact CD2-O 3.27Å; F903-P939 HydrophobicContact CE2-CB 3.92Å; F903-P939 HydrophobicContact CE2-CG 4.06Å; F903-P939 HydrophobicContact CZ-CG 4.36Å; P939-G941 VanDerWaalsContact C-N 3.27Å; P939-G941 PolarHBondContact O-N 3.19Å
940	Y	84.2	Confident	91.7	Very high	34 Å²	34	26.3 Å²	26.3	13%	0.133	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	5.6	-165.4	51.7	-109.4	0	0	0	115.1	S515 L529 A530 A535 F903 R937 A942	S515-Y940 WeakPolarHBondContact CB-O 3.33Å; S515-Y940 PolarHBondContact OG-O 3.01Å; L529-Y940 HydrophobicContact CB-CD1 4.13Å; L529-Y940 HydrophobicContact CB-CD2 4.49Å; L529-Y940 HydrophobicContact CB-CE1 4.46Å; L529-Y940 HydrophobicContact CB-CG 4.14Å; L529-Y940 HydrophobicContact CD1-CD1 4.48Å; A530-Y940 HydrophobicContact CB-CD2 3.93Å; A535-Y940 HydrophobicContact CB-CE2 3.98Å; F903-Y940 VanDerWaalsContact CE1-CB 3.45Å; R937-Y940 HydrophobicContact CB-CE2 4.47Å; R937-Y940 WeakPolarHBondContact CD-OH 3.48Å; R937-Y940 HydrophobicContact CG-CE2 4.27Å; R937-Y940 PolarHBondContact NE-OH 2.86Å; R937-Y940 PolarHBondContact NH1-OH 2.93Å; Y940-A942 HydrophobicContact CD2-CB 4.24Å; Y940-A942 HydrophobicContact CE2-CB 3.93Å; Y940-A942 PolarHBondContact O-N 3.08Å
941	G	84.9	Confident	91.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	48.4	171	0	0	0	0	0	115	R937 P939 C943	R937-G941 VanDerWaalsContact O-CA 3.26Å; R937-G941 WeakPolarHBondContact O-CA 3.25Å; R937-G941 PolarHBondContact O-N 3.14Å; P939-G941 VanDerWaalsContact C-N 3.27Å; P939-G941 PolarHBondContact O-N 3.19Å; G941-C943 PolarHBondContact O-N 3.17Å
942	A	86	Confident	91.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	124.6	161	0	0	0	0	0	108.7	A530 A535 T536 W936 R937 Y940 L944	A530-A942 HydrophobicContact CB-CB 4.16Å; A530-A942 WeakPolarHBondContact O-CB 3.37Å; A535-A942 HydrophobicContact CB-CB 3.87Å; T536-A942 HydrophobicContact CG2-CB 4.34Å; W936-A942 CarbonylContact C-O 3.54Å; W936-A942 WeakPolarHBondContact CA-O 3.5Å; R937-A942 HydrophobicContact CB-CB 4.16Å; R937-A942 PolarHBondContact N-O 3.3Å; Y940-A942 HydrophobicContact CD2-CB 4.24Å; Y940-A942 HydrophobicContact CE2-CB 3.93Å; Y940-A942 PolarHBondContact O-N 3.08Å; A942-L944 PolarHBondContact O-N 2.79Å
943	C	89	Confident	91.8	Very high	15 Å²	15	24 Å²	24	10%	0.101	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	123.1	172.2	-177.3	0	0	0	0	109.1	P511 T536 W936 G941	P511-C943 WeakPolarHBondContact CB-O 3.26Å; T536-C943 WeakPolarHBondContact CG2-O 3.47Å; W936-C943 HydrophobicContact CE3-CB 4.01Å; W936-C943 HydrophobicContact CZ3-CB 3.94Å; G941-C943 PolarHBondContact O-N 3.17Å
944	L	89.8	Confident	91.7	Very high	23 Å²	23	24.8 Å²	24.8	12%	0.12	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-40.3	-176	-63	176.6	0	0	0	111.6	T536 L541 P542 W923 A935 R937 A942	T536-L944 HydrophobicContact CG2-CD2 4.06Å; L541-L944 HydrophobicContact CB-CD1 4.35Å; L541-L944 HydrophobicContact CB-CD2 4.37Å; L541-L944 HydrophobicContact CD1-CD2 4Å; L541-L944 HydrophobicContact CD2-CD1 4.08Å; P542-L944 HydrophobicContact CG-CB 4.47Å; P542-L944 HydrophobicContact CG-CD1 3.82Å; W923-L944 HydrophobicContact CB-CD1 3.8Å; A935-L944 HydrophobicContact CB-CB 4.45Å; A935-L944 WeakPolarHBondContact O-CB 3.43Å; A935-L944 PolarHBondContact O-N 3.12Å; R937-L944 HydrophobicContact CB-CD1 4.17Å; R937-L944 HydrophobicContact CB-CD2 4.1Å; R937-L944 HydrophobicContact CB-CG 4.23Å; A942-L944 PolarHBondContact O-N 2.79Å
945	L	91.7	Very high	91.7	Very high	13 Å²	13	25.7 Å²	25.7	7%	0.068	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	153.5	174	65.6	92.1	0	0	0	110.1	P542 L545 A935	P542-L945 HydrophobicContact CB-CD2 3.89Å; P542-L945 HydrophobicContact CG-CD2 4.39Å; L545-L945 HydrophobicContact CD1-CD1 3.85Å; L545-L945 HydrophobicContact CG-CD1 3.72Å; L545-L945 HydrophobicContact CG-CD2 4.18Å; A935-L945 HydrophobicContact CB-CD1 4.16Å; A935-L945 HydrophobicContact CB-CD2 4.07Å; A935-L945 HydrophobicContact CB-CG 3.74Å; A935-L945 PolarHBondContact N-O 3.37Å
946	E	92.3	Very high	91.8	Very high	90 Å²	90	26.2 Å²	26.2	42%	0.421	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	148.5	163.8	171.5	175.5	170.9	0	0	108.3	H907 Q932	H907-E946 IonicContact CD2-OE2 3.48Å; H907-E946 IonicContact CE1-OE2 3.93Å; H907-E946 IonicContact NE2-OE2 3.64Å; H907-E946 PolarHBondContact NE2-OE2 3.47Å; Q932-E946 HydrophobicContact CG-CG 4.43Å; Q932-E946 PolarHBondContact NE2-OE1 3.03Å
947	T	94.7	Very high	91.9	Very high	26 Å²	26	26.7 Å²	26.7	16%	0.16	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	138.7	168.4	-68.9	0	0	0	0	107.7	Q932 V933 Y977	Q932-T947 CarbonylContact C-O 3.57Å; V933-T947 PolarHBondContact N-O 2.97Å; V933-T947 PolarHBondContact O-N 3.43Å; T947-Y977 HydrophobicContact CG2-CE1 3.96Å
948	K	94.8	Very high	92	Very high	108 Å²	108	24.6 Å²	24.6	47%	0.47	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	130.1	-176.7	-164.9	156.2	-169.9	145.4	0	111.1	E909 D930 H931	E909-K948 IonicContact OE2-NZ 3.52Å; D930-K948 WeakPolarHBondContact O-CE 3.33Å; D930-K948 PolarHBondContact O-NZ 3.25Å; H931-K948 HydrophobicContact CB-CG 4.11Å; H931-K948 WeakPolarHBondContact O-CA 3.35Å
949	E	94.9	Very high	92.1	Very high	16 Å²	16	24 Å²	24	8%	0.075	13%	0.133	C	C	.	.			trans	-95	175	178.5	-70.8	-164.3	-148.7	0	0	112.7	H931 V933 A951 V953 T967 S969 N975	H931-E949 WeakPolarHBondContact CB-O 3.43Å; H931-E949 PolarHBondContact O-N 3.44Å; V933-E949 HydrophobicContact CG2-CG 4.33Å; E949-A951 VanDerWaalsContact C-N 3.31Å; E949-A951 PolarHBondContact O-N 2.91Å; E949-V953 HydrophobicContact CB-CG2 3.65Å; E949-V953 HydrophobicContact CG-CG2 3.72Å; E949-T967 VanDerWaalsContact OE1-CB 3.28Å; E949-T967 WeakPolarHBondContact OE1-CB 3.36Å; E949-T967 PolarHBondContact OE1-OG1 3.45Å; E949-S969 WeakPolarHBondContact OE2-CB 3.26Å; E949-S969 PolarHBondContact OE2-OG 3.28Å; E949-N975 PolarHBondContact OE2-ND2 3.48Å
950	A	92.1	Very high	92.2	Very high	74 Å²	74	28.2 Å²	28.2	61%	0.612	15%	0.154	S	C	*	.	S	Bend	trans	-73.5	-20.3	179.3	0	0	0	0	0	113.8
951	A	94.6	Very high	92.2	Very high	4 Å²	4	29.2 Å²	29.2	3%	0.033	16%	0.162	C	C	.	.	S	Bend	trans	-149.9	173.7	-176.9	0	0	0	0	0	110.9	H931 E949 V953 D971	H931-A951 VanDerWaalsContact CB-O 3.26Å; H931-A951 WeakPolarHBondContact CB-O 3.49Å; E949-A951 VanDerWaalsContact C-N 3.31Å; E949-A951 PolarHBondContact O-N 2.91Å; A951-V953 PolarHBondContact O-N 3.22Å; A951-D971 HydrophobicContact CB-CB 4.14Å
952	S	94.2	Very high	92.4	Very high	7 Å²	7	29.3 Å²	29.3	5%	0.049	16%	0.162	C	C	.	.			trans	-53.8	132.7	176.9	-54.7	0	0	0	0	111.7	K929 H931 G970	K929-S952 WeakPolarHBondContact O-CB 3.32Å; K929-S952 PolarHBondContact O-OG 3.46Å; H931-S952 PolarHBondContact CD2-N 2.95Å; S952-G970 PolarHBondContact O-N 2.95Å
953	V	96.6	Very high	92.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	105.6	-175.1	-174.2	0	0	0	0	109	T927 G928 V933 E949 A951 T967	T927-V953 WeakPolarHBondContact CB-O 3.23Å; T927-V953 HydrophobicContact CG2-CB 4.45Å; T927-V953 HydrophobicContact CG2-CG1 3.77Å; T927-V953 PolarHBondContact OG1-O 3.37Å; G928-V953 PolarHBondContact O-N 3.18Å; G928-V953 VanDerWaalsContact O-N 3.1Å; V933-V953 HydrophobicContact CG2-CB 4.22Å; V933-V953 HydrophobicContact CG2-CG1 3.98Å; V933-V953 HydrophobicContact CG2-CG2 3.94Å; E949-V953 HydrophobicContact CB-CG2 3.65Å; E949-V953 HydrophobicContact CG-CG2 3.72Å; A951-V953 PolarHBondContact O-N 3.22Å; V953-T967 HydrophobicContact CG1-CG2 4.01Å
954	L	95.5	Very high	92.7	Very high	18 Å²	18	31.7 Å²	31.7	9%	0.094	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-23.1	-162.2	-52.1	-175.4	0	0	0	113.5	A265 A266 V556 L913 G968	A265-L954 HydrophobicContact CB-CD1 4.31Å; A266-L954 HydrophobicContact CB-CD2 4.32Å; V556-L954 HydrophobicContact CG1-CD1 3.34Å; L913-L954 HydrophobicContact CD1-CD2 3.54Å; L954-G968 PolarHBondContact N-O 3.02Å
955	T	96.6	Very high	93	Very high	19 Å²	19	30.6 Å²	30.6	12%	0.117	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	150.7	-169.2	-176.7	0	0	0	0	110.1	V560 T967 G968	V560-T955 HydrophobicContact CB-CG2 4.37Å; V560-T955 HydrophobicContact CG1-CG2 3.95Å; V560-T955 HydrophobicContact CG2-CG2 3.95Å; V560-T955 PolarHBondContact N-OG1 3.12Å; T955-T967 CarbonylContact O-C 3.53Å; T955-T967 WeakPolarHBondContact O-CA 3.41Å; T955-G968 PolarHBondContact O-N 3.32Å
956	C	97.3	Very high	93.2	Very high	10 Å²	10	30 Å²	30	7%	0.068	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	156.6	174.7	63.1	0	0	0	0	111.5	L925 T927 V966 T967	L925-C956 HydrophobicContact CD2-CB 3.95Å; T927-C956 HydrophobicContact CG2-CB 3.75Å; C956-V966 CarbonylContact C-O 3.56Å; C956-V966 VanDerWaalsContact CA-O 3.26Å; C956-V966 WeakPolarHBondContact CA-O 3.49Å; C956-T967 HydrophobicContact CB-CG2 4.22Å
957	D	96	Very high	93.5	Very high	11 Å²	11	25.7 Å²	25.7	6%	0.059	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	158.5	166.4	-160.6	20.5	0	0	0	110.8	V560 T561 L562 R916 V966	V560-D957 HydrophobicContact CG2-CB 4.23Å; T561-D957 WeakPolarHBondContact CA-OD2 3.42Å; L562-D957 PolarHBondContact N-OD2 3.39Å; R916-D957 IonicContact CZ-OD1 3.52Å; R916-D957 IonicContact NE-OD1 2.84Å; R916-D957 PolarHBondContact NE-OD1 3.27Å; R916-D957 IonicContact NH2-OD1 3.91Å; R916-D957 PolarHBondContact NH2-OD1 3.03Å; D957-V966 HydrophobicContact CB-CG1 4.25Å; D957-V966 PolarHBondContact N-O 3.24Å; D957-V966 PolarHBondContact O-N 3.47Å
958	I	93.6	Very high	93.6	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.015	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	140.9	-174.2	-52.2	178.6	0	0	0	108.3	R916 W923 L925 D962 V965	R916-I958 HydrophobicContact CB-CD1 4.09Å; R916-I958 HydrophobicContact CB-CG1 4.21Å; R916-I958 HydrophobicContact CG-CD1 4.18Å; R916-I958 HydrophobicContact CG-CG1 4.04Å; W923-I958 HydrophobicContact CH2-CD1 4.07Å; W923-I958 HydrophobicContact CH2-CG2 4.39Å; W923-I958 HydrophobicContact CZ3-CD1 4.05Å; L925-I958 HydrophobicContact CB-CD1 4.14Å; I958-D962 WeakPolarHBondContact CG2-OD1 3.37Å; I958-V965 HydrophobicContact CG1-CG2 4.34Å
959	S	90.8	Very high	93.5	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.014	11%	0.112	C	C	.	.			trans	-70.7	155.4	177.8	60.2	0	0	0	0	112.2	H919 D961 D962 K963 F964	H919-S959 PolarHBondContact CD2-O 3.31Å; S959-D961 VanDerWaalsContact CB-OD1 3.28Å; S959-D961 WeakPolarHBondContact CB-OD1 3.32Å; S959-D961 PolarHBondContact O-N 2.93Å; S959-D961 PolarHBondContact OG-OD1 3.03Å; S959-D962 PolarHBondContact O-N 3.39Å; S959-K963 PolarHBondContact OG-N 2.68Å; S959-F964 PolarHBondContact N-O 2.9Å; S959-F964 PolarHBondContact OG-N 3.18Å; S959-F964 PolarHBondContact OG-O 3.05Å
960	L	85.7	Confident	93.4	Very high	119 Å²	119	18.6 Å²	18.6	62%	0.623	11%	0.108	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-13.2	-178.4	-59.5	178.5	0	0	0	115.2	H919	H919-L960 VanDerWaalsContact CE1-CD2 3.47Å; H919-L960 WeakPolarHBondContact CE1-CD2 3.44Å
961	D	85	Confident	93.5	Very high	55 Å²	55	17 Å²	17	29%	0.294	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	11.5	178.4	69	-23.3	0	0	0	113	H608 S959 K963	H608-D961 IonicContact CE1-OD1 2.9Å; H608-D961 PolarHBondContact CE1-OD1 3.4Å; H608-D961 IonicContact CE1-OD2 3.97Å; H608-D961 PolarHBondContact CE1-OD2 3.01Å; H608-D961 IonicContact NE2-OD1 3.2Å; H608-D961 IonicContact NE2-OD2 3.44Å; S959-D961 VanDerWaalsContact CB-OD1 3.28Å; S959-D961 WeakPolarHBondContact CB-OD1 3.32Å; S959-D961 PolarHBondContact O-N 2.93Å; S959-D961 PolarHBondContact OG-OD1 3.03Å; D961-K963 PolarHBondContact O-N 2.99Å; D961-K963 WeakPolarHBondContact OD1-CB 3.27Å; D961-K963 PolarHBondContact OD1-N 3.08Å; D961-K963 VanDerWaalsContact OD2-CB 3.31Å; D961-K963 WeakPolarHBondContact OD2-CB 3.34Å
962	D	89.9	Confident	93.5	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.016	10%	0.101	C	C	.	.	S	Bend	trans	55.2	12.3	-176.5	-66.2	-31.7	0	0	0	115.5	A918 H919 H920 W923 I958 S959 V979 F981	A918-D962 WeakPolarHBondContact CA-OD1 3.42Å; A918-D962 WeakPolarHBondContact CB-OD1 3.45Å; H919-D962 IonicContact CD2-OD1 3.25Å; H919-D962 PolarHBondContact N-OD1 2.92Å; H919-D962 PolarHBondContact N-OD2 2.89Å; H920-D962 WeakPolarHBondContact CB-OD2 3.46Å; H920-D962 IonicContact CD2-OD2 3.1Å; H920-D962 PolarHBondContact CD2-OD2 2.87Å; H920-D962 VanDerWaalsContact CD2-OD2 3.27Å; H920-D962 IonicContact CG-OD2 3.05Å; H920-D962 PolarHBondContact N-OD2 3.34Å; W923-D962 HydrophobicContact CZ2-CB 4.18Å; I958-D962 WeakPolarHBondContact CG2-OD1 3.37Å; S959-D962 PolarHBondContact O-N 3.39Å; D962-V979 WeakPolarHBondContact O-CB 3.38Å; D962-V979 WeakPolarHBondContact O-CG2 3.43Å; D962-F981 HydrophobicContact CB-CZ 4.25Å; D962-F981 WeakPolarHBondContact O-CZ 3.3Å
963	K	88.7	Confident	93.5	Very high	57 Å²	57	24.9 Å²	24.9	25%	0.248	12%	0.119	C	C	.	.			trans	-82.9	-30.9	-174.4	-172.1	176.4	-177.7	-151.5	0	113.9	S959 D961 E978 V979	S959-K963 PolarHBondContact OG-N 2.68Å; D961-K963 PolarHBondContact O-N 2.99Å; D961-K963 WeakPolarHBondContact OD1-CB 3.27Å; D961-K963 PolarHBondContact OD1-N 3.08Å; D961-K963 VanDerWaalsContact OD2-CB 3.31Å; D961-K963 WeakPolarHBondContact OD2-CB 3.34Å; K963-E978 WeakPolarHBondContact CE-OE1 3.37Å; K963-E978 IonicContact NZ-OE1 3.22Å; K963-E978 PolarHBondContact NZ-OE1 2.89Å; K963-V979 WeakPolarHBondContact O-CB 3.36Å; K963-V979 WeakPolarHBondContact O-CG2 3.4Å; K963-V979 PolarHBondContact O-N 3.04Å
964	F	92.5	Very high	93.5	Very high	8 Å²	8	24.9 Å²	24.9	4%	0.035	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.1	-176.1	-63.9	-84.1	0	0	0	111.5	L548 H608 S959 L976 Y977 E978	L548-F964 HydrophobicContact CD1-CD1 4.12Å; L548-F964 HydrophobicContact CD1-CE1 3.68Å; H608-F964 AromaticContact CD2-CD2 3.44Å; H608-F964 VanDerWaalsContact CD2-CD2 3.44Å; H608-F964 WeakPolarHBondContact CD2-CD2 3.42Å; H608-F964 AromaticContact CD2-CE2 3.29Å; H608-F964 WeakPolarHBondContact CD2-CE2 3.4Å; H608-F964 AromaticContact CE1-CD2 3.89Å; H608-F964 AromaticContact CG-CD2 3.94Å; H608-F964 AromaticContact NE2-CD2 3.42Å; H608-F964 WeakPolarHBondContact NE2-CD2 3.37Å; H608-F964 AromaticContact NE2-CE2 3.32Å; H608-F964 VanDerWaalsContact NE2-CE2 3.32Å; H608-F964 WeakPolarHBondContact NE2-CE2 3.38Å; S959-F964 PolarHBondContact N-O 2.9Å; S959-F964 PolarHBondContact OG-N 3.18Å; S959-F964 PolarHBondContact OG-O 3.05Å; F964-L976 HydrophobicContact CD1-CD1 4.32Å; F964-Y977 WeakPolarHBondContact CA-O 3.31Å; F964-E978 HydrophobicContact CE1-CB 4.43Å; F964-E978 HydrophobicContact CE1-CG 4.45Å
965	V	95.6	Very high	93.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	135	170.6	169.1	0	0	0	0	107.9	L545 W923 L925 I958 T967 Y977 V979	L545-V965 HydrophobicContact CD2-CB 4.22Å; L545-V965 HydrophobicContact CD2-CG2 3.96Å; W923-V965 HydrophobicContact CH2-CG2 4.34Å; L925-V965 HydrophobicContact CD2-CG1 3.56Å; L925-V965 HydrophobicContact CD2-CG2 4.39Å; I958-V965 HydrophobicContact CG1-CG2 4.34Å; V965-T967 HydrophobicContact CG1-CG2 4.16Å; V965-Y977 PolarHBondContact N-O 3.44Å; V965-Y977 PolarHBondContact O-N 3.42Å; V965-V979 HydrophobicContact CG2-CG2 3.71Å
966	V	96.4	Very high	93.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	140	166.4	71.3	0	0	0	0	109.5	V560 L562 C956 D957 A974 N975	V560-V966 HydrophobicContact CB-CG1 3.87Å; V560-V966 HydrophobicContact CG1-CG2 4.47Å; V560-V966 HydrophobicContact CG2-CG1 3.83Å; L562-V966 HydrophobicContact CD1-CB 4.3Å; L562-V966 HydrophobicContact CD1-CG1 3.86Å; L562-V966 HydrophobicContact CD2-CB 4.12Å; L562-V966 HydrophobicContact CD2-CG1 3.79Å; L562-V966 HydrophobicContact CG-CB 4.29Å; L562-V966 HydrophobicContact CG-CG1 3.55Å; C956-V966 CarbonylContact C-O 3.56Å; C956-V966 VanDerWaalsContact CA-O 3.26Å; C956-V966 WeakPolarHBondContact CA-O 3.49Å; D957-V966 HydrophobicContact CB-CG1 4.25Å; D957-V966 PolarHBondContact N-O 3.24Å; D957-V966 PolarHBondContact O-N 3.47Å; V966-A974 HydrophobicContact CG2-CB 4.3Å; V966-N975 WeakPolarHBondContact CA-O 3.41Å
967	T	97.9	Very high	93.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.1	175.9	57.8	0	0	0	0	110.5	T927 V933 E949 V953 T955 C956 V965 A974 N975 Y977	T927-T967 HydrophobicContact CG2-CG2 4.48Å; V933-T967 HydrophobicContact CG1-CG2 4.3Å; V933-T967 HydrophobicContact CG2-CG2 4.15Å; E949-T967 VanDerWaalsContact OE1-CB 3.28Å; E949-T967 WeakPolarHBondContact OE1-CB 3.36Å; E949-T967 PolarHBondContact OE1-OG1 3.45Å; V953-T967 HydrophobicContact CG1-CG2 4.01Å; T955-T967 CarbonylContact O-C 3.53Å; T955-T967 WeakPolarHBondContact O-CA 3.41Å; C956-T967 HydrophobicContact CB-CG2 4.22Å; V965-T967 HydrophobicContact CG1-CG2 4.16Å; T967-A974 CarbonylContact O-C 3.51Å; T967-A974 WeakPolarHBondContact O-CA 3.45Å; T967-A974 WeakPolarHBondContact O-CB 3.33Å; T967-N975 PolarHBondContact N-O 3.21Å; T967-N975 PolarHBondContact O-N 2.91Å; T967-N975 PolarHBondContact OG1-O 2.99Å; T967-Y977 HydrophobicContact CG2-CE2 4.34Å
968	G	96	Very high	93.1	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.2	171.1	0	0	0	0	0	110.6	V557 L954 T955	V557-G968 CarbonylContact O-C 3.6Å; L954-G968 PolarHBondContact N-O 3.02Å; T955-G968 PolarHBondContact O-N 3.32Å
969	S	94.4	Very high	93.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.1	-161.9	-154.6	0	0	0	0	113.4	V557 E949 D971 K972 R973	V557-S969 PolarHBondContact N-O 3.31Å; E949-S969 WeakPolarHBondContact OE2-CB 3.26Å; E949-S969 PolarHBondContact OE2-OG 3.28Å; S969-D971 WeakPolarHBondContact CB-OD1 3.38Å; S969-D971 PolarHBondContact O-N 3.49Å; S969-K972 PolarHBondContact O-N 3.12Å; S969-R973 WeakPolarHBondContact CB-O 3.49Å; S969-R973 PolarHBondContact N-O 3.45Å
970	G	92.6	Very high	93.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.7	177.2	0	0	0	0	0	115.1	S952 K972	S952-G970 PolarHBondContact O-N 2.95Å; G970-K972 PolarHBondContact O-N 3.42Å
971	D	93.2	Very high	93.3	Very high	40 Å²	40	23.6 Å²	23.6	21%	0.214	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	6.8	179.6	81	-20.8	0	0	0	114.1	A951 S969 R973	A951-D971 HydrophobicContact CB-CB 4.14Å; S969-D971 WeakPolarHBondContact CB-OD1 3.38Å; S969-D971 PolarHBondContact O-N 3.49Å; D971-R973 WeakPolarHBondContact OD1-CB 3.46Å; D971-R973 WeakPolarHBondContact OD1-CG 3.47Å; D971-R973 PolarHBondContact OD1-N 3.26Å; D971-R973 WeakPolarHBondContact OD2-CD 3.32Å
972	K	94.8	Very high	93	Very high	61 Å²	61	25.9 Å²	25.9	27%	0.265	12%	0.122	S	C	.	.	S	Bend	trans	73.4	25.3	-175.8	-55.7	163	152.9	-88.4	0	114.4	H553 G554 D555 V556 S969 G970	H553-K972 PolarHBondContact N-O 2.89Å; G554-K972 PolarHBondContact N-O 3Å; G554-K972 WeakPolarHBondContact O-CD 3.45Å; G554-K972 PolarHBondContact O-NZ 3.3Å; D555-K972 CarbonylContact O-C 3.56Å; D555-K972 VanDerWaalsContact O-CA 3.32Å; D555-K972 WeakPolarHBondContact O-CA 3.47Å; D555-K972 IonicContact OD1-NZ 3.27Å; D555-K972 PolarHBondContact OD1-NZ 3.46Å; V556-K972 HydrophobicContact CG2-CG 4.32Å; S969-K972 PolarHBondContact O-N 3.12Å; G970-K972 PolarHBondContact O-N 3.42Å
973	R	94.7	Very high	91.6	Very high	116 Å²	116	30.3 Å²	30.3	44%	0.438	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	164.9	178.3	-48.1	-177.6	175.8	-156.5	-9.8	111.5	L551 V557 S969 D971	L551-R973 VanDerWaalsContact O-CA 3.32Å; L551-R973 WeakPolarHBondContact O-CA 3.25Å; V557-R973 VanDerWaalsContact CG2-C 3.48Å; V557-R973 WeakPolarHBondContact CG2-O 3.49Å; S969-R973 WeakPolarHBondContact CB-O 3.49Å; S969-R973 PolarHBondContact N-O 3.45Å; D971-R973 WeakPolarHBondContact OD1-CB 3.46Å; D971-R973 WeakPolarHBondContact OD1-CG 3.47Å; D971-R973 PolarHBondContact OD1-N 3.26Å; D971-R973 WeakPolarHBondContact OD2-CD 3.32Å
974	A	96.3	Very high	89.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	139.1	160.3	0	0	0	0	0	109	S550 L551 V557 V560 T612 V966 T967	S550-A974 CarbonylContact C-O 3.52Å; S550-A974 WeakPolarHBondContact CA-O 3.47Å; L551-A974 HydrophobicContact CB-CB 4.25Å; L551-A974 HydrophobicContact CD1-CB 4.39Å; L551-A974 PolarHBondContact N-O 3.03Å; L551-A974 PolarHBondContact O-N 3.08Å; V557-A974 HydrophobicContact CG1-CB 4.27Å; V557-A974 HydrophobicContact CG2-CB 4.43Å; V560-A974 HydrophobicContact CG1-CB 4.44Å; T612-A974 HydrophobicContact CG2-CB 3.64Å; V966-A974 HydrophobicContact CG2-CB 4.3Å; T967-A974 CarbonylContact O-C 3.51Å; T967-A974 WeakPolarHBondContact O-CA 3.45Å; T967-A974 WeakPolarHBondContact O-CB 3.33Å
975	N	95.6	Very high	87.2	Confident	10 Å²	10	49.3 Å²	49.3	5%	0.053	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.9	179.6	-71.3	-60.3	0	0	0	110.7	H547 S550 E949 V966 T967 Y977	H547-N975 WeakPolarHBondContact NE2-CB 3.4Å; H547-N975 PolarHBondContact NE2-OD1 3.43Å; S550-N975 VanDerWaalsContact CB-OD1 3.3Å; S550-N975 WeakPolarHBondContact CB-OD1 3.48Å; S550-N975 PolarHBondContact OG-OD1 3.49Å; E949-N975 PolarHBondContact OE2-ND2 3.48Å; V966-N975 WeakPolarHBondContact CA-O 3.41Å; T967-N975 PolarHBondContact N-O 3.21Å; T967-N975 PolarHBondContact O-N 2.91Å; T967-N975 PolarHBondContact OG1-O 2.99Å; N975-Y977 HydrophobicContact CB-CD2 4.46Å; N975-Y977 HydrophobicContact CB-CE2 3.52Å
976	L	94.9	Very high	86.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.2	179.3	177.4	68.9	0	0	0	109.8	L548 A549 L623 F964	L548-L976 HydrophobicContact CB-CD2 4.04Å; L548-L976 HydrophobicContact CB-CG 4.18Å; L548-L976 HydrophobicContact CD1-CD2 4.16Å; L548-L976 HydrophobicContact CD1-CG 4.35Å; L548-L976 PolarHBondContact N-O 3.21Å; A549-L976 HydrophobicContact CB-CB 4.29Å; A549-L976 HydrophobicContact CB-CD2 4.41Å; A549-L976 PolarHBondContact O-N 3.28Å; L623-L976 HydrophobicContact CB-CD2 4.34Å; L623-L976 HydrophobicContact CD1-CD1 3.85Å; L623-L976 HydrophobicContact CD2-CD1 4.25Å; L623-L976 HydrophobicContact CD2-CD2 4.06Å; F964-L976 HydrophobicContact CD1-CD1 4.32Å
977	Y	94.2	Very high	86.3	Confident	12 Å²	12	54.5 Å²	54.5	5%	0.047	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	141.8	178.5	-57.1	-95.7	0	0	0	111.6	L545 Q546 H547 T947 F964 V965 T967 N975	L545-Y977 HydrophobicContact CB-CD1 3.68Å; L545-Y977 HydrophobicContact CB-CE1 4.45Å; L545-Y977 HydrophobicContact CB-CG 3.98Å; Q546-Y977 CarbonylContact O-C 3.52Å; Q546-Y977 VanDerWaalsContact O-CA 3.27Å; Q546-Y977 WeakPolarHBondContact O-CA 3.44Å; H547-Y977 HydrophobicContact CB-CD1 3.95Å; H547-Y977 HydrophobicContact CB-CE1 3.83Å; H547-Y977 AromaticContact CD2-CE1 3.74Å; H547-Y977 AromaticContact CD2-CZ 3.83Å; T947-Y977 HydrophobicContact CG2-CE1 3.96Å; F964-Y977 WeakPolarHBondContact CA-O 3.31Å; V965-Y977 PolarHBondContact N-O 3.44Å; V965-Y977 PolarHBondContact O-N 3.42Å; T967-Y977 HydrophobicContact CG2-CE2 4.34Å; N975-Y977 HydrophobicContact CB-CD2 4.46Å; N975-Y977 HydrophobicContact CB-CE2 3.52Å
978	E	92.5	Very high	85.7	Confident	40 Å²	40	57.5 Å²	57.5	19%	0.187	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134	162	-170.2	171.6	-140.7	0	0	109.4	Q546 L548 K963 F964 I980	Q546-E978 HydrophobicContact CB-CB 4.48Å; Q546-E978 PolarHBondContact N-O 3.1Å; Q546-E978 PolarHBondContact O-N 3.08Å; L548-E978 HydrophobicContact CD1-CB 3.94Å; L548-E978 HydrophobicContact CD2-CB 4.21Å; L548-E978 HydrophobicContact CG-CB 4.09Å; K963-E978 WeakPolarHBondContact CE-OE1 3.37Å; K963-E978 IonicContact NZ-OE1 3.22Å; K963-E978 PolarHBondContact NZ-OE1 2.89Å; F964-E978 HydrophobicContact CE1-CB 4.43Å; F964-E978 HydrophobicContact CE1-CG 4.45Å; E978-I980 HydrophobicContact CB-CD1 4.42Å; E978-I980 HydrophobicContact CG-CD1 4.05Å; E978-I980 PolarHBondContact O-N 2.96Å
979	V	92.8	Very high	85.1	Confident	5 Å²	5	60.9 Å²	60.9	3%	0.03	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	111.4	178.7	-175.2	0	0	0	0	109	P542 L545 W923 D962 K963 V965 F981	P542-V979 HydrophobicContact CB-CG1 3.53Å; L545-V979 HydrophobicContact CD2-CG2 3.89Å; W923-V979 HydrophobicContact CH2-CG1 4.42Å; W923-V979 HydrophobicContact CH2-CG2 4.34Å; W923-V979 HydrophobicContact CZ2-CG1 4.19Å; D962-V979 WeakPolarHBondContact O-CB 3.38Å; D962-V979 WeakPolarHBondContact O-CG2 3.43Å; K963-V979 WeakPolarHBondContact O-CB 3.36Å; K963-V979 WeakPolarHBondContact O-CG2 3.4Å; K963-V979 PolarHBondContact O-N 3.04Å; V965-V979 HydrophobicContact CG2-CG2 3.71Å; V979-F981 HydrophobicContact CB-CE2 3.87Å; V979-F981 HydrophobicContact CB-CZ 4.1Å; V979-F981 HydrophobicContact CG1-CD1 4.48Å; V979-F981 HydrophobicContact CG1-CD2 4.18Å; V979-F981 HydrophobicContact CG1-CE1 3.94Å; V979-F981 HydrophobicContact CG1-CE2 3.6Å; V979-F981 HydrophobicContact CG1-CZ 3.46Å; V979-F981 VanDerWaalsContact CG1-CZ 3.46Å; V979-F981 WeakPolarHBondContact O-CD2 3.36Å
980	I	92	Very high	84.5	Confident	26 Å²	26	64.7 Å²	64.7	13%	0.133	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	108.8	-179.2	-53	-57.3	0	0	0	109.3	R543 R544 Q546 E978 T982	R543-I980 WeakPolarHBondContact CA-O 3.29Å; R543-I980 WeakPolarHBondContact CB-O 3.28Å; R543-I980 PolarHBondContact N-O 3.43Å; R544-I980 HydrophobicContact CB-CB 4.4Å; R544-I980 PolarHBondContact N-O 3.21Å; R544-I980 WeakPolarHBondContact O-CB 3.45Å; R544-I980 PolarHBondContact O-N 2.77Å; Q546-I980 HydrophobicContact CB-CD1 4.15Å; Q546-I980 HydrophobicContact CB-CG1 3.79Å; E978-I980 HydrophobicContact CB-CD1 4.42Å; E978-I980 HydrophobicContact CG-CD1 4.05Å; E978-I980 PolarHBondContact O-N 2.96Å; I980-T982 WeakPolarHBondContact CG2-O 3.41Å
981	F	88.8	Confident	83.9	Confident	63 Å²	63	69 Å²	69	28%	0.276	32%	0.318	S	S	.	.			trans	-88.4	-27	179.9	-63.6	-86.1	0	0	0	113.9	G540 P542 R543 D962 V979	G540-F981 VanDerWaalsContact O-CD1 3.27Å; G540-F981 WeakPolarHBondContact O-CD1 3.17Å; G540-F981 VanDerWaalsContact O-CE1 3.25Å; G540-F981 WeakPolarHBondContact O-CE1 3.26Å; P542-F981 HydrophobicContact CB-CE1 4.36Å; R543-F981 WeakPolarHBondContact CG-O 3.31Å; D962-F981 HydrophobicContact CB-CZ 4.25Å; D962-F981 WeakPolarHBondContact O-CZ 3.3Å; V979-F981 HydrophobicContact CB-CE2 3.87Å; V979-F981 HydrophobicContact CB-CZ 4.1Å; V979-F981 HydrophobicContact CG1-CD1 4.48Å; V979-F981 HydrophobicContact CG1-CD2 4.18Å; V979-F981 HydrophobicContact CG1-CE1 3.94Å; V979-F981 HydrophobicContact CG1-CE2 3.6Å; V979-F981 HydrophobicContact CG1-CZ 3.46Å; V979-F981 VanDerWaalsContact CG1-CZ 3.46Å; V979-F981 WeakPolarHBondContact O-CD2 3.36Å
982	T	78.4	Confident	83.3	Confident	102 Å²	102	71.1 Å²	71.1	63%	0.626	33%	0.326	S	S	*	.	S	Bend	trans	-93	140.9	180	45.8	0	0	0	0	111.3	I980 Q984	I980-T982 WeakPolarHBondContact CG2-O 3.41Å; T982-Q984 PolarHBondContact O-N 3.47Å
983	P	61	Low	82.4	Confident	97 Å²	97	71.8 Å²	71.8	63%	0.63	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-64	135	164.5	28.6	-32.9	0	0	0	109.1	R985	P983-R985 PolarHBondContact O-N 2.86Å
984	Q	52.7	Low	81.4	Confident	143 Å²	143	68.2 Å²	68.2	67%	0.668	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-63.8	134.8	164.7	-65.3	-172.1	-54.1	0	0	108	T982	T982-Q984 PolarHBondContact O-N 3.47Å
985	R	37	Very low	80	Confident	320 Å²	320	74.4 Å²	74.4	100%	1.208	35%	0.351	S	S	*	.			trans	-82.8	0	176.8	-77.5	-174	174.4	-178.1	-1.4	111.2	P983	P983-R985 PolarHBondContact O-N 2.86Å

Retrieved 985 of 985 residues in 810.5 ms (Link to these results)

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