A0A087XNJ1_POEFO Loading...

Protocadherin 12

AlphaFold DB , UniProt , Accession A0A087XNJ1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,170 aa.

						>A0A087XNJ1_POEFO|A0A087XNJ1
MLLALLLVLSLSSGTLCSESSSIIIHYRVWEEQPSGTQVGRLLDDLRQRDEIGPLEDFQVVEQVKALPFSVTARDGVISTQGQLDREALCRGSDLCEVAFSVLYRKSGSVNCLRIRVEVMDLNDHSPSFPNTTQEVEISETAPLRMRIPLDRAVDLDAGPNGLQTYSLSVNQHFALDVTDASGGSKQAELVVIKELDREVQDSFDLILVAYDKGNPPKSGSMSVHVLIQDSNDNSPAFQESSPTVTLSENTPIGTTIFKLTATDPDLGANGEVKYWFSKHTPPEFQKLFHVDSQTGEVIVKAPLDYEREPSYVLNILAIDHGPNSMPTHCKLHIKLVDVNDHAPRISTKWLSPTSSVPTVREGAPIDTFLVLVTVYDADSGKNGEVSLTIQEGSGPFRLKSSDHFNFLIVTNDSLDREKVNNYNIKLIAKDHGNPSLVTIENLPVSVLDENDNAPVFLKSIYNTSIKENNFKEDAVLEVKASDDDQGLNGKVSYKIKTLTDQKSFSIHPTTGIIRVLRSLDHEESQSYSFIVEAVDYGHPPLTGSTTVQINVEDLNDNSPVIKEPKPRNGVVSVSIPVNAHRGEIVTELGNDTEEKPTSLPISRSVLDGFNGFPASTIKAEDPDSGLNGQLKYIISNGNTNGLFWMDEDTGQLFVNATNATELIGRTFKMELSVADMGSPSYKTEATLEVTFINLQDHLKNSSPGNRGQLSFTMMMAVCLGATCLLLLLAIALVTTFCRPEKRDNHAYNCRQAESSYTRHPRRPQKNIRKSDIQLIPVIRGRKEEPSEEDSEVQPLTPAPLPEDQQTEREYNFIPSVMNTSFHSQSYPEVDSPQHIGHHCKTLRKPGNIELDGTLTLTPATSYQTLCKTRNPSSSSSSLSHFSTLKRNKLHPESEESRPQRSTSQATLRRPKTSDGQQDAEHQQMLRNLVRLSMAAFGDTIELSSASPEVQQISQLLSLLRQGQLQPRTNFRGNKYSHRNGRYGGHDCSDWQSTKDSGHGESEAGDVDWEAGRDSPIDPQLEEGLSNLLNSPDDVFSEISDPAWMARLSLPLTVDYHDNVFVPNGPPSPESELPPRDGLNSTSSFSTFGKTPEKDGQLGGALLSEVSTLFEMLMTQKADAHPGPRPDVLYRLSAAYRRSLGLDATTAAGGTSPKNCSEKRPTVASKHQYQ
					

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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	48.9	Very low	44.6	Very low	206 Å²	206	128.2 Å²	128.2	100%	1.015	71%	0.705	S	S	*	*				0	-54.4	0	-79.9	-95.9	55.2	0	0	112.8	L3 A4	M1-L3 PolarHBondContact O-N 2.9Å; M1-A4 PolarHBondContact O-N 2.9Å
2	L	44.7	Very low	44.1	Very low	144 Å²	144	124.9 Å²	124.9	75%	0.754	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-37.3	-178.3	-142.5	76.5	0	0	0	114.4	A4 L5	L2-A4 PolarHBondContact O-N 2.99Å; L2-A4 VanDerWaalsContact O-N 3.14Å; L2-L5 PolarHBondContact O-N 3.44Å
3	L	42.3	Very low	43.9	Very low	146 Å²	146	125.4 Å²	125.4	76%	0.764	72%	0.715	S	S	*	*	H	α-helix	trans	-59.5	-25.7	-179.7	-146.8	80.7	0	0	0	114	M1 L5	M1-L3 PolarHBondContact O-N 2.9Å; L3-L5 VanDerWaalsContact C-N 3.33Å
4	A	49.2	Very low	43.3	Very low	61 Å²	61	120.6 Å²	120.6	50%	0.504	71%	0.706	S	S	.	*	H	α-helix	trans	-77.9	-16.2	179.2	0	0	0	0	0	113.3	M1 L2	M1-A4 PolarHBondContact O-N 2.9Å; L2-A4 PolarHBondContact O-N 2.99Å; L2-A4 VanDerWaalsContact O-N 3.14Å
5	L	47.1	Very low	42.9	Very low	121 Å²	121	122.5 Å²	122.5	63%	0.634	72%	0.721	S	S	*	*	H	α-helix	trans	-89.6	-32.7	-179.2	-149.5	76.8	0	0	0	112.3	L2 L3 L7 V8	L2-L5 PolarHBondContact O-N 3.44Å; L3-L5 VanDerWaalsContact C-N 3.33Å; L5-L7 VanDerWaalsContact C-N 3.27Å; L5-L7 PolarHBondContact O-N 3.07Å; L5-V8 PolarHBondContact O-N 2.98Å
6	L	45.9	Very low	42.4	Very low	121 Å²	121	125 Å²	125	63%	0.634	73%	0.729	S	S	*	*	H	α-helix	trans	-67.1	-27.5	175.3	-79	163.9	0	0	0	112.8	V8 L9	L6-V8 PolarHBondContact O-N 3.23Å; L6-L9 PolarHBondContact O-N 3.09Å
7	L	46.5	Very low	42.1	Very low	131 Å²	131	122.4 Å²	122.4	69%	0.686	72%	0.718	S	S	*	*	H	α-helix	trans	-70.2	-8.4	179.6	-121	163.7	0	0	0	114.2	L5	L5-L7 VanDerWaalsContact C-N 3.27Å; L5-L7 PolarHBondContact O-N 3.07Å
8	V	49.3	Very low	41.7	Very low	102 Å²	102	121.4 Å²	121.4	62%	0.618	72%	0.719	S	S	*	*	H	α-helix	trans	-106	-20.4	-178.7	-177	0	0	0	0	112.3	L5 L6	L5-V8 PolarHBondContact O-N 2.98Å; L6-V8 PolarHBondContact O-N 3.23Å
9	L	40.2	Very low	41.7	Very low	132 Å²	132	125.6 Å²	125.6	69%	0.691	73%	0.73	S	S	*	*	H	α-helix	trans	-97.6	-9.6	-171.9	-80.1	164.7	0	0	0	115.2	L6 L11	L6-L9 PolarHBondContact O-N 3.09Å; L9-L11 VanDerWaalsContact C-N 3.28Å
10	S	37.5	Very low	41.6	Very low	95 Å²	95	123.7 Å²	123.7	66%	0.664	72%	0.724	S	S	*	*	S	Bend	trans	-80.5	-5.9	167.9	53.3	0	0	0	0	113.6	S12	S10-S12 PolarHBondContact O-N 3.25Å; S10-S12 VanDerWaalsContact O-N 3.12Å
11	L	39	Very low	41.9	Very low	151 Å²	151	123.1 Å²	123.1	79%	0.791	73%	0.727	S	S	*	*	S	Bend	trans	-86.1	46.9	179.8	-76.1	165.5	0	0	0	112.9	L9	L9-L11 VanDerWaalsContact C-N 3.28Å
12	S	39.1	Very low	42.4	Very low	89 Å²	89	116.8 Å²	116.8	62%	0.622	70%	0.703	S	S	*	*	S	Bend	trans	-156	156.4	165.3	65.3	0	0	0	0	111.2	S10	S10-S12 PolarHBondContact O-N 3.25Å; S10-S12 VanDerWaalsContact O-N 3.12Å
13	S	41.4	Very low	43.8	Very low	131 Å²	131	111.3 Å²	111.3	92%	0.916	67%	0.674	S	S	*	*	S	Bend	trans	68.1	40.9	177.6	-46	0	0	0	0	116.4
14	G	34.8	Very low	45.8	Very low	58 Å²	58	107.1 Å²	107.1	60%	0.598	65%	0.652	S	S	*	*			trans	-125.5	103	159.3	0	0	0	0	0	110.4	L16	G14-L16 VanDerWaalsContact C-N 3.33Å; G14-L16 PolarHBondContact O-N 2.97Å
15	T	38.3	Very low	47.4	Very low	150 Å²	150	104.4 Å²	104.4	92%	0.92	63%	0.629	S	S	*	*			trans	-73.6	86.2	172.7	43.9	0	0	0	0	109.8	C17	T15-C17 PolarHBondContact O-N 3.11Å
16	L	34.8	Very low	49.3	Very low	162 Å²	162	103.8 Å²	103.8	85%	0.848	62%	0.623	S	S	*	*			trans	-60.9	125	171.6	-73.8	113.7	0	0	0	110	G14 S18	G14-L16 VanDerWaalsContact C-N 3.33Å; G14-L16 PolarHBondContact O-N 2.97Å; L16-S18 PolarHBondContact O-N 3.08Å
17	C	36.7	Very low	51.4	Low	81 Å²	81	99.1 Å²	99.1	55%	0.547	60%	0.597	S	S	.	*			trans	-62.5	107.5	154.4	-75.1	0	0	0	0	107.6	T15 C112	T15-C17 PolarHBondContact O-N 3.11Å; C17-C112 HydrophobicContact CB-CB 4.38Å; C17-C112 VanDerWaalsContact SG-CB 3.55Å
18	S	35	Very low	53.4	Low	104 Å²	104	100.1 Å²	100.1	73%	0.727	59%	0.591	S	S	*	*			trans	-57.5	149.9	172	-169.6	0	0	0	0	110.6	L16 S20	L16-S18 PolarHBondContact O-N 3.08Å; S18-S20 VanDerWaalsContact C-N 3.33Å; S18-S20 PolarHBondContact O-N 3.49Å; S18-S20 PolarHBondContact O-OG 3.26Å
19	E	42.3	Very low	55.4	Low	202 Å²	202	95.7 Å²	95.7	94%	0.944	56%	0.564	S	S	*	*	S	Bend	trans	-65.5	84.6	-170.5	-66.2	-178.7	117.2	0	0	113
20	S	39.2	Very low	57.6	Low	87 Å²	87	95.5 Å²	95.5	61%	0.608	55%	0.554	S	S	*	*	S	Bend	trans	-118.5	83.3	168.8	42.7	0	0	0	0	108.3	S18 S22	S18-S20 VanDerWaalsContact C-N 3.33Å; S18-S20 PolarHBondContact O-N 3.49Å; S18-S20 PolarHBondContact O-OG 3.26Å; S20-S22 PolarHBondContact O-N 3.44Å
21	S	47.4	Very low	60	Low	112 Å²	112	91 Å²	91	78%	0.783	52%	0.523	S	S	*	.			trans	30.6	63.7	168.8	59.8	0	0	0	0	114.7	I23	S21-I23 PolarHBondContact O-N 2.91Å
22	S	59.3	Low	62.3	Low	73 Å²	73	87 Å²	87	51%	0.51	50%	0.501	S	S	.	.			trans	-60.7	104.9	-173.3	62.1	0	0	0	0	110.5	S20 I24	S20-S22 PolarHBondContact O-N 3.44Å; S22-I24 PolarHBondContact O-N 3.25Å; S22-I24 VanDerWaalsContact O-N 3.13Å
23	I	74.2	Confident	64.5	Low	28 Å²	28	85.8 Å²	85.8	14%	0.144	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	118.4	-174.9	-57.2	176.6	0	0	0	108.1	S21 I25 L46 L113 R114	S21-I23 PolarHBondContact O-N 2.91Å; I23-I25 HydrophobicContact CG2-CG1 4.06Å; I23-L46 HydrophobicContact CD1-CD2 4.09Å; I23-L113 HydrophobicContact CB-CD2 3.79Å; I23-L113 HydrophobicContact CD1-CD2 4.35Å; I23-L113 HydrophobicContact CG1-CD2 4.44Å; I23-L113 HydrophobicContact CG2-CD2 4.43Å; I23-R114 PolarHBondContact O-N 2.86Å
24	I	83.5	Confident	66.5	Low	58 Å²	58	83.5 Å²	83.5	30%	0.297	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126.1	173.4	-47.7	-173.2	0	0	0	108.7	S22 H26 R49 R114 R116	S22-I24 PolarHBondContact O-N 3.25Å; S22-I24 VanDerWaalsContact O-N 3.13Å; I24-H26 WeakPolarHBondContact CG2-NE2 3.5Å; I24-R49 PolarHBondContact O-NH1 3.46Å; I24-R49 PolarHBondContact O-NH2 2.95Å; I24-R114 VanDerWaalsContact CA-O 3.3Å; I24-R114 WeakPolarHBondContact CA-O 2.99Å; I24-R114 HydrophobicContact CG1-CB 4.45Å; I24-R114 WeakPolarHBondContact CG2-O 3.5Å; I24-R116 HydrophobicContact CG2-CG 4.09Å
25	I	83.9	Confident	68.9	Low	4 Å²	4	84.6 Å²	84.6	2%	0.021	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	122.7	175.3	-56.7	178.2	0	0	0	107	I23 Y27 L42 D45 L46 L113 R114 I115 R116	I23-I25 HydrophobicContact CG2-CG1 4.06Å; I25-Y27 HydrophobicContact CB-CE2 4.47Å; I25-Y27 HydrophobicContact CG2-CD2 4.15Å; I25-Y27 HydrophobicContact CG2-CE1 4.02Å; I25-Y27 HydrophobicContact CG2-CE2 3.52Å; I25-Y27 VanDerWaalsContact CG2-CZ 3.46Å; I25-L42 HydrophobicContact CD1-CD2 3.78Å; I25-D45 HydrophobicContact CD1-CB 4.37Å; I25-L46 HydrophobicContact CD1-CD2 4.34Å; I25-L113 HydrophobicContact CD1-CD1 4.4Å; I25-R114 PolarHBondContact N-O 3.48Å; I25-R114 VanDerWaalsContact N-O 3.11Å; I25-I115 WeakPolarHBondContact O-CA 3.49Å; I25-R116 PolarHBondContact O-N 2.99Å
26	H	87.1	Confident	71	Confident	109 Å²	109	79.9 Å²	79.9	51%	0.505	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.3	176.6	-68.6	-100.4	0	0	0	108.6	I24 E97 R116	I24-H26 WeakPolarHBondContact CG2-NE2 3.5Å; H26-E97 IonicContact CE1-OE1 3.7Å; H26-E97 IonicContact ND1-OE1 2.78Å; H26-R116 CarbonylContact C-O 3.54Å; H26-R116 WeakPolarHBondContact CA-O 3.49Å
27	Y	89.6	Confident	73.6	Confident	22 Å²	22	73.8 Å²	73.8	9%	0.086	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	160.8	168.4	-63.6	-67.3	0	0	0	110	I25 V39 R41 L42 D45 I78 I115 R116 V117 E118	I25-Y27 HydrophobicContact CB-CE2 4.47Å; I25-Y27 HydrophobicContact CG2-CD2 4.15Å; I25-Y27 HydrophobicContact CG2-CE1 4.02Å; I25-Y27 HydrophobicContact CG2-CE2 3.52Å; I25-Y27 VanDerWaalsContact CG2-CZ 3.46Å; Y27-V39 HydrophobicContact CG-CG1 4.3Å; Y27-R41 PolarHBondContact OH-N 3.4Å; Y27-L42 HydrophobicContact CE2-CD2 3.94Å; Y27-L42 PolarHBondContact OH-N 2.96Å; Y27-D45 VanDerWaalsContact CE1-OD2 3.23Å; Y27-D45 WeakPolarHBondContact CE1-OD2 3.39Å; Y27-D45 VanDerWaalsContact CZ-OD2 3.28Å; Y27-D45 PolarHBondContact OH-OD2 2.95Å; Y27-I78 HydrophobicContact CD2-CD1 3.72Å; Y27-I78 HydrophobicContact CE2-CD1 3.4Å; Y27-I78 VanDerWaalsContact CE2-CD1 3.4Å; Y27-I78 HydrophobicContact CE2-CG1 4.44Å; Y27-I115 HydrophobicContact CD2-CG2 3.95Å; Y27-I115 HydrophobicContact CE2-CG2 4.28Å; Y27-R116 PolarHBondContact N-O 3.17Å; Y27-V117 WeakPolarHBondContact O-CA 3.47Å; Y27-E118 PolarHBondContact O-N 2.86Å
28	R	89.2	Confident	76	Confident	153 Å²	153	75.6 Å²	75.6	58%	0.577	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.6	175.2	-81.4	173.3	173.9	-155.3	-16	108.6	E118 M120	R28-E118 WeakPolarHBondContact CA-O 3.42Å; R28-E118 HydrophobicContact CG-CB 4.02Å; R28-E118 HydrophobicContact CG-CG 4.4Å; R28-E118 IonicContact CZ-OE1 3.2Å; R28-E118 IonicContact CZ-OE2 3.91Å; R28-E118 IonicContact NE-OE1 3.39Å; R28-E118 IonicContact NE-OE2 2.86Å; R28-E118 PolarHBondContact NE-OE2 3.28Å; R28-E118 IonicContact NH2-OE1 2.7Å; R28-E118 PolarHBondContact NH2-OE1 3.26Å; R28-E118 IonicContact NH2-OE2 3.67Å; R28-E118 PolarHBondContact NH2-OE2 3.32Å; R28-M120 HydrophobicContact CB-CE 3.84Å; R28-M120 HydrophobicContact CB-CG 4.25Å; R28-M120 HydrophobicContact CB-SD 3.75Å; R28-M120 HydrophobicContact CG-CG 4.29Å; R28-M120 HydrophobicContact CG-SD 4Å
29	V	90.1	Very high	78.5	Confident	8 Å²	8	71.5 Å²	71.5	5%	0.048	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	139.1	172.7	72.8	0	0	0	0	107.4	Q33 V39 F69 T80 L84 V117 E118 V119 M120	V29-Q33 HydrophobicContact CG2-CG 4.41Å; V29-V39 HydrophobicContact CB-CG1 4.14Å; V29-V39 HydrophobicContact CB-CG2 4.11Å; V29-V39 HydrophobicContact CG2-CG2 3.81Å; V29-F69 HydrophobicContact CG1-CE1 4.19Å; V29-F69 HydrophobicContact CG1-CZ 4.14Å; V29-T80 HydrophobicContact CG2-CG2 4.49Å; V29-L84 HydrophobicContact CG1-CD2 3.49Å; V29-L84 VanDerWaalsContact CG1-CD2 3.49Å; V29-V117 HydrophobicContact CB-CG1 4.28Å; V29-V117 HydrophobicContact CG1-CG1 3.7Å; V29-E118 PolarHBondContact N-O 2.76Å; V29-E118 VanDerWaalsContact N-O 3.13Å; V29-V119 HydrophobicContact CG1-CG2 4.48Å; V29-M120 PolarHBondContact O-N 3.24Å
30	W	86.8	Confident	80.6	Confident	128 Å²	128	62.3 Å²	62.3	49%	0.485	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	156.6	164.4	-64.5	104.3	0	0	0	109.3	Q33 M120 D121 L122	W30-Q33 HydrophobicContact CB-CG 4.2Å; W30-Q33 VanDerWaalsContact O-CG 3.29Å; W30-Q33 WeakPolarHBondContact O-CG 3.48Å; W30-M120 HydrophobicContact CD2-CB 3.99Å; W30-M120 HydrophobicContact CD2-CE 3.67Å; W30-M120 VanDerWaalsContact CE2-CE 3.49Å; W30-M120 HydrophobicContact CE3-CB 3.48Å; W30-M120 VanDerWaalsContact CE3-CB 3.48Å; W30-M120 HydrophobicContact CE3-CE 4.27Å; W30-M120 HydrophobicContact CG-CE 3.87Å; W30-M120 HydrophobicContact CH2-CB 4.37Å; W30-M120 HydrophobicContact CH2-SD 4.47Å; W30-M120 HydrophobicContact CZ2-CE 3.97Å; W30-M120 HydrophobicContact CZ2-SD 4.32Å; W30-M120 HydrophobicContact CZ3-CB 3.7Å; W30-D121 WeakPolarHBondContact CZ3-O 3.48Å; W30-L122 HydrophobicContact CB-CD1 4.47Å; W30-L122 HydrophobicContact CD2-CD2 4.06Å; W30-L122 HydrophobicContact CE3-CD2 3.52Å; W30-L122 HydrophobicContact CE3-CG 4.08Å; W30-L122 HydrophobicContact CZ3-CD2 4.09Å
31	E	88.8	Confident	82.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.331	C	S	.	.	S	Bend	trans	-75.5	179.7	167	76.2	-177.3	109.9	0	0	112.5	Q33 L84 R86 V119 M120 D121 L122	E31-Q33 WeakPolarHBondContact O-CG 3.35Å; E31-Q33 PolarHBondContact O-N 3.16Å; E31-Q33 PolarHBondContact O-NE2 3.42Å; E31-L84 WeakPolarHBondContact CA-O 3.36Å; E31-L84 VanDerWaalsContact CB-O 3.27Å; E31-L84 WeakPolarHBondContact CB-O 3.5Å; E31-R86 HydrophobicContact CB-CB 4.18Å; E31-R86 VanDerWaalsContact CD-CB 3.46Å; E31-R86 WeakPolarHBondContact OE1-CD 3.33Å; E31-R86 IonicContact OE1-NE 2.69Å; E31-R86 WeakPolarHBondContact OE2-CB 3.35Å; E31-R86 PolarHBondContact OE2-N 3.18Å; E31-V119 HydrophobicContact CB-CG1 4.01Å; E31-M120 PolarHBondContact N-O 3.03Å; E31-M120 VanDerWaalsContact N-O 3.1Å; E31-D121 VanDerWaalsContact OE1-CA 3.25Å; E31-D121 WeakPolarHBondContact OE1-CA 3.17Å; E31-L122 HydrophobicContact CG-CB 3.89Å; E31-L122 HydrophobicContact CG-CD1 3.88Å; E31-L122 HydrophobicContact CG-CG 3.85Å; E31-L122 WeakPolarHBondContact O-CD1 3.49Å; E31-L122 PolarHBondContact OE1-N 3.4Å
32	E	87.1	Confident	84.7	Confident	69 Å²	69	56.5 Å²	56.5	32%	0.322	29%	0.294	S	S	.	.	S	Bend	trans	54.7	11	-179.4	-71.2	-69.2	83.7	0	0	115.9	Q83 L84 L122	E32-Q83 WeakPolarHBondContact OE1-CG 3.27Å; E32-Q83 PolarHBondContact OE1-NE2 2.88Å; E32-Q83 PolarHBondContact OE2-NE2 3.26Å; E32-L84 PolarHBondContact N-O 2.88Å; E32-L122 HydrophobicContact CB-CD1 4.28Å
33	Q	84.1	Confident	85.7	Confident	62 Å²	62	53.6 Å²	53.6	29%	0.29	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-70.8	140.4	176.6	-59.4	-52.1	-72.5	0	0	110.8	V29 W30 E31 T37	V29-Q33 HydrophobicContact CG2-CG 4.41Å; W30-Q33 HydrophobicContact CB-CG 4.2Å; W30-Q33 VanDerWaalsContact O-CG 3.29Å; W30-Q33 WeakPolarHBondContact O-CG 3.48Å; E31-Q33 WeakPolarHBondContact O-CG 3.35Å; E31-Q33 PolarHBondContact O-N 3.16Å; E31-Q33 PolarHBondContact O-NE2 3.42Å; Q33-T37 HydrophobicContact CB-CG2 3.98Å; Q33-T37 HydrophobicContact CG-CG2 4.32Å
34	P	84.4	Confident	86	Confident	84 Å²	84	54.7 Å²	54.7	55%	0.545	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-63.1	153.4	-178.9	25.7	-33.9	0	0	0	111.9	G36 T37 T80	P34-G36 PolarHBondContact O-N 3.47Å; P34-T37 WeakPolarHBondContact CD-OG1 3.38Å; P34-T37 WeakPolarHBondContact O-CB 3.36Å; P34-T37 PolarHBondContact O-N 3.26Å; P34-T37 VanDerWaalsContact O-N 3.16Å; P34-T37 PolarHBondContact O-OG1 2.89Å; P34-T80 PolarHBondContact O-OG1 2.72Å
35	S	85.2	Confident	85.9	Confident	81 Å²	81	54 Å²	54	57%	0.566	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	136.7	173	179.1	0	0	0	0	111.1	Q81	S35-Q81 PolarHBondContact OG-O 3Å
36	G	82.9	Confident	85.6	Confident	50 Å²	50	53.9 Å²	53.9	52%	0.515	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	1.3	-174.1	0	0	0	0	0	115.1	P34 Q38 T80	P34-G36 PolarHBondContact O-N 3.47Å; G36-Q38 PolarHBondContact O-N 2.98Å; G36-T80 PolarHBondContact N-O 2.86Å; G36-T80 PolarHBondContact N-OG1 2.92Å
37	T	87.8	Confident	85	Confident	35 Å²	35	54.9 Å²	54.9	22%	0.215	28%	0.275	C	S	.	.			trans	-64.2	123.9	176.5	-64.5	0	0	0	0	110.5	Q33 P34 V39 S79 T80	Q33-T37 HydrophobicContact CB-CG2 3.98Å; Q33-T37 HydrophobicContact CG-CG2 4.32Å; P34-T37 WeakPolarHBondContact CD-OG1 3.38Å; P34-T37 WeakPolarHBondContact O-CB 3.36Å; P34-T37 PolarHBondContact O-N 3.26Å; P34-T37 VanDerWaalsContact O-N 3.16Å; P34-T37 PolarHBondContact O-OG1 2.89Å; T37-V39 PolarHBondContact O-N 3.44Å; T37-S79 CarbonylContact O-C 3.6Å; T37-S79 WeakPolarHBondContact O-CA 3.35Å; T37-S79 WeakPolarHBondContact O-CB 3.18Å; T37-T80 PolarHBondContact N-OG1 3.42Å; T37-T80 PolarHBondContact O-N 3.22Å
38	Q	88.2	Confident	84.2	Confident	118 Å²	118	61.3 Å²	61.3	55%	0.551	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	115.9	-179.1	175.6	168	-3.7	0	0	111.4	G36 V77 I78	G36-Q38 PolarHBondContact O-N 2.98Å; Q38-V77 HydrophobicContact CB-CG1 4.47Å; Q38-V77 HydrophobicContact CG-CG1 3.87Å; Q38-I78 WeakPolarHBondContact CA-O 3.36Å
39	V	87.6	Confident	83.4	Confident	18 Å²	18	60 Å²	60	11%	0.109	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-34.7	-179.2	177.7	0	0	0	0	112.1	Y27 V29 T37 F69 I78 T80 V117	Y27-V39 HydrophobicContact CG-CG1 4.3Å; V29-V39 HydrophobicContact CB-CG1 4.14Å; V29-V39 HydrophobicContact CB-CG2 4.11Å; V29-V39 HydrophobicContact CG2-CG2 3.81Å; T37-V39 PolarHBondContact O-N 3.44Å; V39-F69 HydrophobicContact CG2-CD1 4.03Å; V39-F69 HydrophobicContact CG2-CE1 3.91Å; V39-I78 HydrophobicContact CB-CB 4.25Å; V39-I78 HydrophobicContact CB-CG2 4.12Å; V39-I78 HydrophobicContact CG2-CG2 4.47Å; V39-I78 PolarHBondContact N-O 2.82Å; V39-T80 HydrophobicContact CG2-CG2 4.25Å; V39-V117 HydrophobicContact CG1-CG1 3.95Å; V39-V117 HydrophobicContact CG1-CG2 4.32Å
40	G	86.2	Confident	82.3	Confident	10 Å²	10	66 Å²	66	10%	0.103	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	175.6	-172.2	0	0	0	0	0	112.3	I78	G40-I78 PolarHBondContact O-N 2.82Å
41	R	87.1	Confident	81.4	Confident	76 Å²	76	61.6 Å²	61.6	29%	0.287	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	95.4	-179.1	-170.3	171.8	-178.4	-143.1	15	112.5	Y27 L43 D44 D45 D75 V77	Y27-R41 PolarHBondContact OH-N 3.4Å; R41-L43 HydrophobicContact CG-CB 4.4Å; R41-L43 PolarHBondContact O-N 3.15Å; R41-D44 VanDerWaalsContact CD-OD2 3.31Å; R41-D44 WeakPolarHBondContact CD-OD2 3.42Å; R41-D44 IonicContact CZ-OD2 3.9Å; R41-D44 IonicContact NE-OD2 2.63Å; R41-D44 IonicContact NH1-OD1 3.91Å; R41-D44 IonicContact NH1-OD2 3.14Å; R41-D44 PolarHBondContact NH1-OD2 2.89Å; R41-D44 PolarHBondContact O-N 3.46Å; R41-D45 PolarHBondContact O-N 3.3Å; R41-D75 WeakPolarHBondContact CG-O 3.38Å; R41-D75 PolarHBondContact NE-O 2.83Å; R41-V77 HydrophobicContact CB-CG2 4.44Å; R41-V77 HydrophobicContact CG-CG2 3.8Å
42	L	85	Confident	80	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-50.7	-38.1	-175.5	-60.3	165.2	0	0	0	113	I25 Y27 D44 D45 L46 F58 V71 G76 I78 V102 L113 I115	I25-L42 HydrophobicContact CD1-CD2 3.78Å; Y27-L42 HydrophobicContact CE2-CD2 3.94Å; Y27-L42 PolarHBondContact OH-N 2.96Å; L42-D44 VanDerWaalsContact C-N 3.27Å; L42-D44 PolarHBondContact O-N 3.02Å; L42-D45 PolarHBondContact O-N 2.91Å; L42-L46 WeakPolarHBondContact O-CB 3.38Å; L42-L46 WeakPolarHBondContact O-CD1 3.33Å; L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 2.97Å; L42-F58 HydrophobicContact CB-CD1 4.11Å; L42-F58 HydrophobicContact CB-CE1 3.7Å; L42-F58 HydrophobicContact CB-CZ 4.4Å; L42-F58 HydrophobicContact CD1-CD1 3.93Å; L42-F58 HydrophobicContact CD1-CE1 4.36Å; L42-V71 HydrophobicContact CD1-CG1 3.88Å; L42-G76 WeakPolarHBondContact CG-O 3.2Å; L42-G76 PolarHBondContact N-O 2.95Å; L42-I78 HydrophobicContact CD1-CD1 4.33Å; L42-I78 HydrophobicContact CD1-CG1 4.31Å; L42-I78 HydrophobicContact CD2-CD1 4.17Å; L42-I78 HydrophobicContact CG-CD1 4.15Å; L42-I78 HydrophobicContact CG-CG1 4.25Å; L42-V102 HydrophobicContact CD1-CB 4.35Å; L42-V102 HydrophobicContact CD1-CG1 3.93Å; L42-V102 HydrophobicContact CD1-CG2 4.44Å; L42-L113 HydrophobicContact CD2-CD1 4.19Å; L42-I115 HydrophobicContact CD1-CD1 3.8Å; L42-I115 HydrophobicContact CD2-CD1 3.71Å; L42-I115 HydrophobicContact CD2-CG1 3.83Å; L42-I115 HydrophobicContact CG-CD1 4.33Å
43	L	80.8	Confident	78.9	Confident	12 Å²	12	66.7 Å²	66.7	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-56.6	-37.9	179.3	177.8	61.3	0	0	0	113.3	R41 R47 L55 F58 D75	R41-L43 HydrophobicContact CG-CB 4.4Å; R41-L43 PolarHBondContact O-N 3.15Å; L43-R47 VanDerWaalsContact O-CD 3.24Å; L43-R47 WeakPolarHBondContact O-CD 3.48Å; L43-R47 WeakPolarHBondContact O-CG 3.43Å; L43-R47 PolarHBondContact O-N 3.24Å; L43-L55 HydrophobicContact CD1-CB 3.68Å; L43-L55 HydrophobicContact CD1-CD1 4.21Å; L43-F58 HydrophobicContact CB-CE2 4.31Å; L43-F58 HydrophobicContact CB-CZ 4.17Å; L43-F58 HydrophobicContact CD1-CE2 4.49Å; L43-F58 HydrophobicContact CD1-CZ 4.44Å; L43-D75 VanDerWaalsContact CB-O 3.25Å; L43-D75 WeakPolarHBondContact CB-O 3.23Å; L43-D75 HydrophobicContact CD2-CB 4.37Å
44	D	80.1	Confident	77.9	Confident	51 Å²	51	67.8 Å²	67.8	27%	0.273	37%	0.365	S	S	.	.	H	α-helix	trans	-89.9	-33	-176.7	-62.4	-36.9	0	0	0	111.7	R41 L42 L46 R47 Q48	R41-D44 VanDerWaalsContact CD-OD2 3.31Å; R41-D44 WeakPolarHBondContact CD-OD2 3.42Å; R41-D44 IonicContact CZ-OD2 3.9Å; R41-D44 IonicContact NE-OD2 2.63Å; R41-D44 IonicContact NH1-OD1 3.91Å; R41-D44 IonicContact NH1-OD2 3.14Å; R41-D44 PolarHBondContact NH1-OD2 2.89Å; R41-D44 PolarHBondContact O-N 3.46Å; L42-D44 VanDerWaalsContact C-N 3.27Å; L42-D44 PolarHBondContact O-N 3.02Å; D44-L46 VanDerWaalsContact C-N 3.33Å; D44-L46 PolarHBondContact O-N 2.93Å; D44-R47 PolarHBondContact O-N 3.16Å; D44-R47 IonicContact OD1-CZ 3.75Å; D44-R47 IonicContact OD1-NH1 3.97Å; D44-R47 PolarHBondContact OD1-NH1 3.48Å; D44-Q48 WeakPolarHBondContact O-CG 3.33Å; D44-Q48 PolarHBondContact O-N 3.39Å; D44-Q48 VanDerWaalsContact O-N 3.09Å
45	D	81.7	Confident	77.4	Confident	45 Å²	45	64.1 Å²	64.1	24%	0.241	34%	0.341	C	S	.	.	H	α-helix	trans	-67.1	-31.1	173.3	-66.4	-63.9	0	0	0	113	I25 Y27 R41 L42	I25-D45 HydrophobicContact CD1-CB 4.37Å; Y27-D45 VanDerWaalsContact CE1-OD2 3.23Å; Y27-D45 WeakPolarHBondContact CE1-OD2 3.39Å; Y27-D45 VanDerWaalsContact CZ-OD2 3.28Å; Y27-D45 PolarHBondContact OH-OD2 2.95Å; R41-D45 PolarHBondContact O-N 3.3Å; L42-D45 PolarHBondContact O-N 2.91Å
46	L	77.9	Confident	76.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-70.8	-43.8	172	-69.2	167.1	0	0	0	111.3	I23 I25 L42 D44 Q48 R49 E51 L55 F58 Y104 L113	I23-L46 HydrophobicContact CD1-CD2 4.09Å; I25-L46 HydrophobicContact CD1-CD2 4.34Å; L42-L46 WeakPolarHBondContact O-CB 3.38Å; L42-L46 WeakPolarHBondContact O-CD1 3.33Å; L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 2.97Å; D44-L46 VanDerWaalsContact C-N 3.33Å; D44-L46 PolarHBondContact O-N 2.93Å; L46-Q48 PolarHBondContact O-N 3.33Å; L46-R49 CarbonylContact O-C 3.56Å; L46-R49 WeakPolarHBondContact O-CA 3.39Å; L46-R49 PolarHBondContact O-N 3Å; L46-E51 HydrophobicContact CB-CB 4.1Å; L46-E51 HydrophobicContact CB-CG 4.24Å; L46-E51 HydrophobicContact CD2-CG 4.32Å; L46-E51 VanDerWaalsContact O-CB 3.3Å; L46-E51 WeakPolarHBondContact O-CB 3.36Å; L46-E51 PolarHBondContact O-N 3.43Å; L46-L55 HydrophobicContact CB-CD1 3.88Å; L46-L55 HydrophobicContact CD1-CD1 4.26Å; L46-F58 HydrophobicContact CD1-CE1 3.86Å; L46-F58 HydrophobicContact CD1-CZ 4.14Å; L46-Y104 HydrophobicContact CD1-CD2 4.26Å; L46-Y104 HydrophobicContact CD1-CE2 4.18Å; L46-Y104 HydrophobicContact CD1-CG 4.49Å; L46-L113 HydrophobicContact CD1-CD1 4Å; L46-L113 HydrophobicContact CD2-CD1 4.23Å; L46-L113 HydrophobicContact CD2-CD2 3.73Å; L46-L113 HydrophobicContact CG-CD1 4.48Å
47	R	74.3	Confident	76.4	Confident	130 Å²	130	66 Å²	66	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-59.2	-34.6	176.6	-74.7	165.4	173.3	169.4	-7	112.6	L43 D44 R49 D50 L55	L43-R47 VanDerWaalsContact O-CD 3.24Å; L43-R47 WeakPolarHBondContact O-CD 3.48Å; L43-R47 WeakPolarHBondContact O-CG 3.43Å; L43-R47 PolarHBondContact O-N 3.24Å; D44-R47 PolarHBondContact O-N 3.16Å; D44-R47 IonicContact OD1-CZ 3.75Å; D44-R47 IonicContact OD1-NH1 3.97Å; D44-R47 PolarHBondContact OD1-NH1 3.48Å; R47-R49 PolarHBondContact O-N 2.97Å; R47-D50 PolarHBondContact O-N 3.44Å; R47-L55 HydrophobicContact CG-CD1 4.49Å
48	Q	74.1	Confident	76.1	Confident	157 Å²	157	64.5 Å²	64.5	73%	0.734	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.2	173.9	-71.6	-178	39.8	0	0	114.1	D44 L46	D44-Q48 WeakPolarHBondContact O-CG 3.33Å; D44-Q48 PolarHBondContact O-N 3.39Å; D44-Q48 VanDerWaalsContact O-N 3.09Å; L46-Q48 PolarHBondContact O-N 3.33Å
49	R	72.3	Confident	75.7	Confident	126 Å²	126	63.5 Å²	63.5	48%	0.475	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	29.1	175.8	-59.9	-177.4	-170.9	-147.3	14.1	112.3	I24 L46 R47 E51	I24-R49 PolarHBondContact O-NH1 3.46Å; I24-R49 PolarHBondContact O-NH2 2.95Å; L46-R49 CarbonylContact O-C 3.56Å; L46-R49 WeakPolarHBondContact O-CA 3.39Å; L46-R49 PolarHBondContact O-N 3Å; R47-R49 PolarHBondContact O-N 2.97Å; R49-E51 PolarHBondContact O-N 3.4Å
50	D	66.6	Low	75.4	Confident	135 Å²	135	65.3 Å²	65.3	72%	0.722	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	25	-179.2	-63.2	-45.7	0	0	0	115.2	R47 I52	R47-D50 PolarHBondContact O-N 3.44Å; D50-I52 PolarHBondContact O-N 2.9Å
51	E	66.5	Low	75.2	Confident	35 Å²	35	67.7 Å²	67.7	16%	0.164	34%	0.338	C	S	.	.			trans	-74.3	70.6	172.2	-66.7	-68.9	169.9	0	0	111.6	L46 R49 G53 L55 K106	L46-E51 HydrophobicContact CB-CB 4.1Å; L46-E51 HydrophobicContact CB-CG 4.24Å; L46-E51 HydrophobicContact CD2-CG 4.32Å; L46-E51 VanDerWaalsContact O-CB 3.3Å; L46-E51 WeakPolarHBondContact O-CB 3.36Å; L46-E51 PolarHBondContact O-N 3.43Å; R49-E51 PolarHBondContact O-N 3.4Å; E51-G53 PolarHBondContact O-N 3.46Å; E51-L55 HydrophobicContact CB-CD1 4.24Å; E51-K106 WeakPolarHBondContact OE2-CD 3.31Å; E51-K106 VanDerWaalsContact OE2-CE 3.26Å; E51-K106 WeakPolarHBondContact OE2-CE 3.41Å; E51-K106 IonicContact OE2-NZ 2.75Å; E51-K106 PolarHBondContact OE2-NZ 3.47Å
52	I	59.8	Low	74.3	Confident	143 Å²	143	73.3 Å²	73.3	73%	0.733	37%	0.368	S	S	*	.			trans	-74.9	119.7	-177.3	-59.3	169.8	0	0	0	110.9	D50	D50-I52 PolarHBondContact O-N 2.9Å
53	G	65.4	Low	73.4	Confident	32 Å²	32	77.5 Å²	77.5	33%	0.33	39%	0.387	S	S	.	.	S	Bend	trans	157.9	177.9	173	0	0	0	0	0	112.9	E51 L55	E51-G53 PolarHBondContact O-N 3.46Å; G53-L55 PolarHBondContact O-N 3Å
54	P	62.9	Low	72.3	Confident	85 Å²	85	84.5 Å²	84.5	55%	0.552	43%	0.43	S	S	*	.			trans	-67.9	125.3	159.8	29.8	-31.3	0	0	0	108.9
55	L	72.3	Confident	71.6	Confident	7 Å²	7	90.3 Å²	90.3	4%	0.037	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	108.6	-178.7	-65.9	174.7	0	0	0	107.6	L43 L46 R47 E51 G53 F58 Y104 K106	L43-L55 HydrophobicContact CD1-CB 3.68Å; L43-L55 HydrophobicContact CD1-CD1 4.21Å; L46-L55 HydrophobicContact CB-CD1 3.88Å; L46-L55 HydrophobicContact CD1-CD1 4.26Å; R47-L55 HydrophobicContact CG-CD1 4.49Å; E51-L55 HydrophobicContact CB-CD1 4.24Å; G53-L55 PolarHBondContact O-N 3Å; L55-F58 HydrophobicContact CB-CZ 4.43Å; L55-Y104 HydrophobicContact CD2-CD2 3.94Å; L55-Y104 HydrophobicContact CD2-CE2 3.7Å; L55-K106 HydrophobicContact CD2-CB 3.93Å; L55-K106 HydrophobicContact CD2-CD 4.46Å; L55-K106 HydrophobicContact CD2-CG 3.99Å
56	E	70	Confident	71.2	Confident	125 Å²	125	93.1 Å²	93.1	58%	0.584	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	166.2	-166.2	-65.6	178.9	-165.1	0	0	111.3	R105	E56-R105 PolarHBondContact N-O 3.38Å; E56-R105 PolarHBondContact O-N 3.29Å
57	D	77.4	Confident	71.3	Confident	47 Å²	47	94.6 Å²	94.6	25%	0.251	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.8	59.3	175.8	-165.7	32.7	0	0	0	113.9	Q59 A73 R105	D57-Q59 PolarHBondContact O-N 3.06Å; D57-Q59 PolarHBondContact OD1-NE2 2.99Å; D57-Q59 PolarHBondContact OD2-NE2 3.46Å; D57-A73 WeakPolarHBondContact CA-O 3.35Å; D57-A73 PolarHBondContact N-O 2.96Å; D57-R105 HydrophobicContact CB-CG 4.2Å; D57-R105 IonicContact OD2-CZ 3.86Å; D57-R105 IonicContact OD2-NE 2.67Å; D57-R105 PolarHBondContact OD2-NE 3.47Å; D57-R105 IonicContact OD2-NH2 2.67Å; D57-R105 PolarHBondContact OD2-NH2 2.88Å
58	F	81.6	Confident	71.8	Confident	2 Å²	2	89.8 Å²	89.8	1%	0.009	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	112.2	175.1	-66.8	-90.4	0	0	0	111.2	L42 L43 L46 L55 V71 A73 V102 L103 Y104	L42-F58 HydrophobicContact CB-CD1 4.11Å; L42-F58 HydrophobicContact CB-CE1 3.7Å; L42-F58 HydrophobicContact CB-CZ 4.4Å; L42-F58 HydrophobicContact CD1-CD1 3.93Å; L42-F58 HydrophobicContact CD1-CE1 4.36Å; L43-F58 HydrophobicContact CB-CE2 4.31Å; L43-F58 HydrophobicContact CB-CZ 4.17Å; L43-F58 HydrophobicContact CD1-CE2 4.49Å; L43-F58 HydrophobicContact CD1-CZ 4.44Å; L46-F58 HydrophobicContact CD1-CE1 3.86Å; L46-F58 HydrophobicContact CD1-CZ 4.14Å; L55-F58 HydrophobicContact CB-CZ 4.43Å; F58-V71 HydrophobicContact CB-CG1 4.3Å; F58-A73 PolarHBondContact N-O 3.19Å; F58-A73 VanDerWaalsContact O-CA 3.25Å; F58-A73 WeakPolarHBondContact O-CA 3.41Å; F58-A73 WeakPolarHBondContact O-CB 3.25Å; F58-V102 HydrophobicContact CB-CG1 4.21Å; F58-V102 HydrophobicContact CD1-CG1 4.09Å; F58-L103 CarbonylContact C-O 3.58Å; F58-L103 VanDerWaalsContact CA-O 3.32Å; F58-L103 WeakPolarHBondContact CA-O 3.34Å; F58-Y104 HydrophobicContact CE1-CG 4.27Å
59	Q	79.9	Confident	72.3	Confident	98 Å²	98	82.5 Å²	82.5	46%	0.458	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130.9	-178	-59.6	-170.7	8.1	0	0	111.8	D57 V102 L103	D57-Q59 PolarHBondContact O-N 3.06Å; D57-Q59 PolarHBondContact OD1-NE2 2.99Å; D57-Q59 PolarHBondContact OD2-NE2 3.46Å; Q59-V102 CarbonylContact O-C 3.39Å; Q59-V102 VanDerWaalsContact O-CA 3.32Å; Q59-V102 WeakPolarHBondContact O-CA 3.38Å; Q59-L103 PolarHBondContact N-O 3.47Å; Q59-L103 PolarHBondContact O-N 3.44Å
60	V	82.4	Confident	73	Confident	56 Å²	56	78.6 Å²	78.6	34%	0.339	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	133.7	174	-177.2	0	0	0	0	109.7	E62 L67 V71 F100 V102	V60-E62 PolarHBondContact O-N 2.92Å; V60-L67 HydrophobicContact CG1-CD2 3.91Å; V60-V71 HydrophobicContact CG2-CB 3.8Å; V60-V71 HydrophobicContact CG2-CG2 3.6Å; V60-F100 HydrophobicContact CG1-CD2 4.31Å; V60-V102 HydrophobicContact CG2-CG2 4.05Å
61	V	80.7	Confident	73.9	Confident	59 Å²	59	73.3 Å²	73.3	36%	0.358	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-73.4	119.8	170.2	-178.3	0	0	0	0	108.6	Q63 S101 L103	V61-Q63 PolarHBondContact O-N 3.12Å; V61-S101 PolarHBondContact N-O 2.88Å; V61-L103 HydrophobicContact CG2-CD1 4.25Å; V61-L103 HydrophobicContact CG2-CD2 4.14Å; V61-L103 HydrophobicContact CG2-CG 3.8Å
62	E	69.4	Low	74.8	Confident	194 Å²	194	73.9 Å²	73.9	91%	0.907	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-56.5	130.1	-176.8	-167	169.2	-139.3	0	0	111.8	V60	V60-E62 PolarHBondContact O-N 2.92Å
63	Q	64.3	Low	75.8	Confident	89 Å²	89	69.3 Å²	69.3	42%	0.416	40%	0.396	S	S	.	.			trans	-116.4	153.9	-177.2	-69.1	-163.6	-11.3	0	0	111.9	V61 K65 A99	V61-Q63 PolarHBondContact O-N 3.12Å; Q63-K65 PolarHBondContact O-N 3.26Å; Q63-A99 PolarHBondContact NE2-O 2.69Å
64	V	58.7	Low	76.4	Confident	159 Å²	159	77.2 Å²	77.2	96%	0.964	42%	0.416	S	S	*	.	S	Bend	trans	-67.4	-15.7	179.3	-174	0	0	0	0	112.9
65	K	66.1	Low	77	Confident	172 Å²	172	73.8 Å²	73.8	75%	0.748	39%	0.393	S	S	*	.	S	Bend	trans	-109.1	143.2	169.4	-69.3	-174.6	176.1	-174.7	0	109.4	Q63 L67	Q63-K65 PolarHBondContact O-N 3.26Å; K65-L67 PolarHBondContact O-N 2.96Å
66	A	72.4	Confident	77.4	Confident	105 Å²	105	73.5 Å²	73.5	87%	0.868	39%	0.391	S	S	*	.			trans	-58.7	130.9	168.6	0	0	0	0	0	109.9
67	L	80.8	Confident	78.2	Confident	30 Å²	30	68.5 Å²	68.5	16%	0.157	37%	0.369	C	S	.	.			trans	-90	132	-178.8	-166.9	71.5	0	0	0	109.4	V60 K65 F69 Q81 V98 F100	V60-L67 HydrophobicContact CG1-CD2 3.91Å; K65-L67 PolarHBondContact O-N 2.96Å; L67-F69 HydrophobicContact CD2-CB 4.4Å; L67-F69 WeakPolarHBondContact CD2-O 3.41Å; L67-F69 HydrophobicContact CG-CB 4.41Å; L67-F69 PolarHBondContact O-N 3.36Å; L67-F69 VanDerWaalsContact O-N 3.17Å; L67-Q81 PolarHBondContact O-OE1 2.94Å; L67-V98 HydrophobicContact CD1-CG1 3.92Å; L67-F100 HydrophobicContact CD1-CB 3.8Å; L67-F100 HydrophobicContact CD1-CD1 3.76Å; L67-F100 HydrophobicContact CD1-CE1 4.49Å; L67-F100 HydrophobicContact CD1-CG 3.9Å; L67-F100 HydrophobicContact CD2-CB 4Å; L67-F100 HydrophobicContact CD2-CD1 3.9Å; L67-F100 HydrophobicContact CD2-CD2 3.66Å; L67-F100 HydrophobicContact CD2-CE1 4.2Å; L67-F100 HydrophobicContact CD2-CE2 3.99Å; L67-F100 HydrophobicContact CD2-CG 3.6Å; L67-F100 HydrophobicContact CD2-CZ 4.24Å; L67-F100 HydrophobicContact CG-CD1 4.34Å; L67-F100 HydrophobicContact CG-CG 4.39Å
68	P	83.3	Confident	78.7	Confident	30 Å²	30	66.2 Å²	66.2	20%	0.195	36%	0.357	C	S	.	.	S	Bend	trans	-76.5	5.1	178.6	30.7	-34.3	0	0	0	113.7	Q81 L84 L89 V98	P68-Q81 PolarHBondContact O-N 3.42Å; P68-L84 HydrophobicContact CB-CD1 3.79Å; P68-L84 HydrophobicContact CG-CD1 4.05Å; P68-L89 HydrophobicContact CG-CD1 4.46Å; P68-V98 HydrophobicContact CG-CG1 4.35Å
69	F	86.5	Confident	79	Confident	4 Å²	4	67 Å²	67	2%	0.018	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	141.9	-178.1	-57.5	-70.9	0	0	0	111.3	V29 V39 L67 I78 S79 T80 L84 V98 F100 V117	V29-F69 HydrophobicContact CG1-CE1 4.19Å; V29-F69 HydrophobicContact CG1-CZ 4.14Å; V39-F69 HydrophobicContact CG2-CD1 4.03Å; V39-F69 HydrophobicContact CG2-CE1 3.91Å; L67-F69 HydrophobicContact CD2-CB 4.4Å; L67-F69 WeakPolarHBondContact CD2-O 3.41Å; L67-F69 HydrophobicContact CG-CB 4.41Å; L67-F69 PolarHBondContact O-N 3.36Å; L67-F69 VanDerWaalsContact O-N 3.17Å; F69-I78 HydrophobicContact CB-CG2 4.1Å; F69-I78 HydrophobicContact CD1-CG2 4.45Å; F69-I78 HydrophobicContact CG-CG2 4.46Å; F69-S79 WeakPolarHBondContact CA-O 3.49Å; F69-T80 HydrophobicContact CD1-CG2 4.31Å; F69-T80 HydrophobicContact CE1-CG2 4.04Å; F69-L84 HydrophobicContact CE1-CD2 4.23Å; F69-L84 HydrophobicContact CZ-CD1 4.22Å; F69-L84 HydrophobicContact CZ-CD2 4Å; F69-V98 HydrophobicContact CD2-CG1 4.15Å; F69-V98 HydrophobicContact CE2-CB 3.94Å; F69-V98 HydrophobicContact CE2-CG1 3.91Å; F69-V98 HydrophobicContact CE2-CG2 4.29Å; F69-F100 HydrophobicContact CB-CE1 4.26Å; F69-F100 HydrophobicContact CB-CZ 4.16Å; F69-F100 AromaticContact CD2-CE1 3.84Å; F69-F100 HydrophobicContact CD2-CE1 3.84Å; F69-F100 HydrophobicContact CG-CE1 4.32Å; F69-V117 HydrophobicContact CD2-CG2 4.28Å; F69-V117 HydrophobicContact CE1-CG1 4.13Å; F69-V117 HydrophobicContact CE2-CB 3.83Å; F69-V117 HydrophobicContact CE2-CG1 4.01Å; F69-V117 HydrophobicContact CE2-CG2 4.06Å; F69-V117 HydrophobicContact CZ-CB 3.95Å; F69-V117 HydrophobicContact CZ-CG1 3.57Å; F69-V117 HydrophobicContact CZ-CG2 4.31Å
70	S	85.7	Confident	79.4	Confident	44 Å²	44	62.4 Å²	62.4	31%	0.308	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	152.1	169.2	69.3	0	0	0	0	110.4	I78 S79	S70-I78 WeakPolarHBondContact O-CA 3.37Å; S70-S79 PolarHBondContact N-O 3.24Å; S70-S79 PolarHBondContact O-N 2.96Å; S70-S79 PolarHBondContact OG-O 3.03Å; S70-S79 PolarHBondContact OG-OG 2.87Å; S70-S79 VanDerWaalsContact OG-OG 3.07Å
71	V	85.4	Confident	79.4	Confident	23 Å²	23	65.6 Å²	65.6	14%	0.139	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	129.7	178.1	-173.7	0	0	0	0	110	L42 F58 V60 V77 I78 F100 V102	L42-V71 HydrophobicContact CD1-CG1 3.88Å; F58-V71 HydrophobicContact CB-CG1 4.3Å; V60-V71 HydrophobicContact CG2-CB 3.8Å; V60-V71 HydrophobicContact CG2-CG2 3.6Å; V71-V77 WeakPolarHBondContact CA-O 3.35Å; V71-I78 HydrophobicContact CG1-CG1 4.44Å; V71-I78 HydrophobicContact CG2-CG1 4.09Å; V71-I78 HydrophobicContact CG2-CG2 4.38Å; V71-F100 HydrophobicContact CG2-CE2 3.89Å; V71-F100 HydrophobicContact CG2-CZ 4.39Å; V71-V102 HydrophobicContact CG1-CG2 4.47Å; V71-V102 HydrophobicContact CG2-CG2 4.08Å
72	T	86.6	Confident	79.6	Confident	48 Å²	48	64.3 Å²	64.3	29%	0.294	35%	0.351	S	S	.	.			trans	-85.9	115.7	-173.8	-53.4	0	0	0	0	111.1	R74 D75 G76 V77	T72-R74 HydrophobicContact CG2-CG 4.12Å; T72-R74 PolarHBondContact O-N 2.83Å; T72-R74 VanDerWaalsContact O-N 3.08Å; T72-D75 VanDerWaalsContact CB-OD1 3.26Å; T72-D75 WeakPolarHBondContact CB-OD1 3.49Å; T72-D75 VanDerWaalsContact CG2-OD1 3.22Å; T72-D75 WeakPolarHBondContact CG2-OD1 3.4Å; T72-D75 PolarHBondContact O-N 2.84Å; T72-G76 PolarHBondContact O-N 3.03Å; T72-V77 PolarHBondContact N-O 2.92Å; T72-V77 PolarHBondContact OG1-O 3.33Å
73	A	79.5	Confident	80.3	Confident	47 Å²	47	61 Å²	61	39%	0.388	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.2	-168.5	0	0	0	0	0	116.3	D57 F58	D57-A73 WeakPolarHBondContact CA-O 3.35Å; D57-A73 PolarHBondContact N-O 2.96Å; F58-A73 PolarHBondContact N-O 3.19Å; F58-A73 VanDerWaalsContact O-CA 3.25Å; F58-A73 WeakPolarHBondContact O-CA 3.41Å; F58-A73 WeakPolarHBondContact O-CB 3.25Å
74	R	78.1	Confident	81.4	Confident	197 Å²	197	56.9 Å²	56.9	74%	0.743	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-26.5	-176.4	80.6	-168.3	-177.6	-165.4	-6.1	114.2	T72	T72-R74 HydrophobicContact CG2-CG 4.12Å; T72-R74 PolarHBondContact O-N 2.83Å; T72-R74 VanDerWaalsContact O-N 3.08Å
75	D	75.4	Confident	82.7	Confident	14 Å²	14	52.9 Å²	52.9	8%	0.075	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-146.7	6	-165.6	54.7	12.5	0	0	0	114.4	R41 L43 T72 V77	R41-D75 WeakPolarHBondContact CG-O 3.38Å; R41-D75 PolarHBondContact NE-O 2.83Å; L43-D75 VanDerWaalsContact CB-O 3.25Å; L43-D75 WeakPolarHBondContact CB-O 3.23Å; L43-D75 HydrophobicContact CD2-CB 4.37Å; T72-D75 VanDerWaalsContact CB-OD1 3.26Å; T72-D75 WeakPolarHBondContact CB-OD1 3.49Å; T72-D75 VanDerWaalsContact CG2-OD1 3.22Å; T72-D75 WeakPolarHBondContact CG2-OD1 3.4Å; T72-D75 PolarHBondContact O-N 2.84Å; D75-V77 HydrophobicContact CB-CG2 4.44Å; D75-V77 PolarHBondContact O-N 3.38Å
76	G	82	Confident	83.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.255	C	S	.	.			trans	66.4	17	172.5	0	0	0	0	0	114.3	L42 T72 I78	L42-G76 WeakPolarHBondContact CG-O 3.2Å; L42-G76 PolarHBondContact N-O 2.95Å; T72-G76 PolarHBondContact O-N 3.03Å; G76-I78 PolarHBondContact O-N 2.95Å
77	V	86.1	Confident	84.5	Confident	20 Å²	20	40.8 Å²	40.8	12%	0.121	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	121.1	178.2	174.5	0	0	0	0	109.4	Q38 R41 V71 T72 D75	Q38-V77 HydrophobicContact CB-CG1 4.47Å; Q38-V77 HydrophobicContact CG-CG1 3.87Å; R41-V77 HydrophobicContact CB-CG2 4.44Å; R41-V77 HydrophobicContact CG-CG2 3.8Å; V71-V77 WeakPolarHBondContact CA-O 3.35Å; T72-V77 PolarHBondContact N-O 2.92Å; T72-V77 PolarHBondContact OG1-O 3.33Å; D75-V77 HydrophobicContact CB-CG2 4.44Å; D75-V77 PolarHBondContact O-N 3.38Å
78	I	88.1	Confident	84.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	130.2	172.8	-49.6	-173.2	0	0	0	108.1	Y27 Q38 V39 G40 L42 F69 S70 V71 G76 F100 I115	Y27-I78 HydrophobicContact CD2-CD1 3.72Å; Y27-I78 HydrophobicContact CE2-CD1 3.4Å; Y27-I78 VanDerWaalsContact CE2-CD1 3.4Å; Y27-I78 HydrophobicContact CE2-CG1 4.44Å; Q38-I78 WeakPolarHBondContact CA-O 3.36Å; V39-I78 HydrophobicContact CB-CB 4.25Å; V39-I78 HydrophobicContact CB-CG2 4.12Å; V39-I78 HydrophobicContact CG2-CG2 4.47Å; V39-I78 PolarHBondContact N-O 2.82Å; G40-I78 PolarHBondContact O-N 2.82Å; L42-I78 HydrophobicContact CD1-CD1 4.33Å; L42-I78 HydrophobicContact CD1-CG1 4.31Å; L42-I78 HydrophobicContact CD2-CD1 4.17Å; L42-I78 HydrophobicContact CG-CD1 4.15Å; L42-I78 HydrophobicContact CG-CG1 4.25Å; F69-I78 HydrophobicContact CB-CG2 4.1Å; F69-I78 HydrophobicContact CD1-CG2 4.45Å; F69-I78 HydrophobicContact CG-CG2 4.46Å; S70-I78 WeakPolarHBondContact O-CA 3.37Å; V71-I78 HydrophobicContact CG1-CG1 4.44Å; V71-I78 HydrophobicContact CG2-CG1 4.09Å; V71-I78 HydrophobicContact CG2-CG2 4.38Å; G76-I78 PolarHBondContact O-N 2.95Å; I78-F100 HydrophobicContact CD1-CZ 4.26Å; I78-F100 HydrophobicContact CG2-CZ 4.24Å; I78-I115 HydrophobicContact CD1-CD1 3.87Å; I78-I115 HydrophobicContact CD1-CG1 4.46Å; I78-I115 HydrophobicContact CD1-CG2 3.91Å
79	S	86.7	Confident	84.6	Confident	18 Å²	18	45 Å²	45	13%	0.126	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.3	176.2	61.3	0	0	0	0	112.9	T37 F69 S70	T37-S79 CarbonylContact O-C 3.6Å; T37-S79 WeakPolarHBondContact O-CA 3.35Å; T37-S79 WeakPolarHBondContact O-CB 3.18Å; F69-S79 WeakPolarHBondContact CA-O 3.49Å; S70-S79 PolarHBondContact N-O 3.24Å; S70-S79 PolarHBondContact O-N 2.96Å; S70-S79 PolarHBondContact OG-O 3.03Å; S70-S79 PolarHBondContact OG-OG 2.87Å; S70-S79 VanDerWaalsContact OG-OG 3.07Å
80	T	88.5	Confident	84.4	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	134	176.6	52.5	0	0	0	0	110.8	V29 P34 G36 T37 V39 F69 G82	V29-T80 HydrophobicContact CG2-CG2 4.49Å; P34-T80 PolarHBondContact O-OG1 2.72Å; G36-T80 PolarHBondContact N-O 2.86Å; G36-T80 PolarHBondContact N-OG1 2.92Å; T37-T80 PolarHBondContact N-OG1 3.42Å; T37-T80 PolarHBondContact O-N 3.22Å; V39-T80 HydrophobicContact CG2-CG2 4.25Å; F69-T80 HydrophobicContact CD1-CG2 4.31Å; F69-T80 HydrophobicContact CE1-CG2 4.04Å; T80-G82 WeakPolarHBondContact CB-O 3.5Å
81	Q	83.7	Confident	83.9	Confident	123 Å²	123	54.8 Å²	54.8	58%	0.575	28%	0.282	S	S	*	.	S	Bend	trans	-85.7	-34	179.1	-173.8	168.8	-10.6	0	0	111.9	S35 L67 P68	S35-Q81 PolarHBondContact OG-O 3Å; L67-Q81 PolarHBondContact O-OE1 2.94Å; P68-Q81 PolarHBondContact O-N 3.42Å
82	G	83.7	Confident	83.1	Confident	31 Å²	31	55.7 Å²	55.7	32%	0.32	30%	0.296	S	S	.	.	S	Bend	trans	-126.5	-170.2	170.4	0	0	0	0	0	111.1	T80	T80-G82 WeakPolarHBondContact CB-O 3.5Å
83	Q	85.5	Confident	82.8	Confident	125 Å²	125	56.2 Å²	56.2	58%	0.584	30%	0.302	S	S	*	.			trans	-67.6	141.9	157.6	-173.2	164.6	-5.5	0	0	108.3	E32	E32-Q83 WeakPolarHBondContact OE1-CG 3.27Å; E32-Q83 PolarHBondContact OE1-NE2 2.88Å; E32-Q83 PolarHBondContact OE2-NE2 3.26Å
84	L	86.6	Confident	82.6	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.016	32%	0.319	C	S	.	.			trans	-109.6	96.5	-168.9	-175	73.4	0	0	0	109	V29 E31 E32 P68 F69 L89 V119	V29-L84 HydrophobicContact CG1-CD2 3.49Å; V29-L84 VanDerWaalsContact CG1-CD2 3.49Å; E31-L84 WeakPolarHBondContact CA-O 3.36Å; E31-L84 VanDerWaalsContact CB-O 3.27Å; E31-L84 WeakPolarHBondContact CB-O 3.5Å; E32-L84 PolarHBondContact N-O 2.88Å; P68-L84 HydrophobicContact CB-CD1 3.79Å; P68-L84 HydrophobicContact CG-CD1 4.05Å; F69-L84 HydrophobicContact CE1-CD2 4.23Å; F69-L84 HydrophobicContact CZ-CD1 4.22Å; F69-L84 HydrophobicContact CZ-CD2 4Å; L84-L89 HydrophobicContact CD1-CD1 3.57Å; L84-L89 HydrophobicContact CG-CD1 4.41Å; L84-V119 HydrophobicContact CD2-CB 4.46Å; L84-V119 HydrophobicContact CD2-CG1 3.69Å; L84-V119 HydrophobicContact CD2-CG2 3.97Å; L84-V119 HydrophobicContact CG-CG1 4.19Å
85	D	87.3	Confident	82.8	Confident	75 Å²	75	56 Å²	56	40%	0.401	31%	0.308	S	S	.	.			trans	-87.4	117.5	174.3	160.2	-10.9	0	0	0	108.5	E87 A88 L89	D85-E87 PolarHBondContact OD1-N 3.21Å; D85-A88 VanDerWaalsContact CG-CB 3.45Å; D85-A88 WeakPolarHBondContact OD1-CB 3.35Å; D85-A88 PolarHBondContact OD1-N 2.86Å; D85-A88 VanDerWaalsContact OD2-CB 3.28Å; D85-A88 WeakPolarHBondContact OD2-CB 3.44Å; D85-L89 VanDerWaalsContact O-CD1 3.32Å; D85-L89 WeakPolarHBondContact O-CD1 3.4Å; D85-L89 VanDerWaalsContact O-CG 3.22Å; D85-L89 WeakPolarHBondContact O-CG 3.44Å
86	R	87.7	Confident	83.4	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-83.7	-31.2	-175.2	-170.4	-155.3	70.5	98.5	9.3	111.6	E31 L89 C90 S93 C96 V119 D121 L156	E31-R86 HydrophobicContact CB-CB 4.18Å; E31-R86 VanDerWaalsContact CD-CB 3.46Å; E31-R86 WeakPolarHBondContact OE1-CD 3.33Å; E31-R86 IonicContact OE1-NE 2.69Å; E31-R86 WeakPolarHBondContact OE2-CB 3.35Å; E31-R86 PolarHBondContact OE2-N 3.18Å; R86-L89 PolarHBondContact O-N 3.47Å; R86-C90 WeakPolarHBondContact O-CA 3.32Å; R86-C90 WeakPolarHBondContact O-CB 3.5Å; R86-C90 PolarHBondContact O-N 3.14Å; R86-S93 PolarHBondContact NH1-O 2.97Å; R86-S93 VanDerWaalsContact NH1-O 3.14Å; R86-C96 HydrophobicContact CG-CB 3.78Å; R86-C96 VanDerWaalsContact CG-SG 3.58Å; R86-V119 HydrophobicContact CB-CG1 4.04Å; R86-V119 HydrophobicContact CG-CB 4.27Å; R86-V119 HydrophobicContact CG-CG1 3.87Å; R86-D121 IonicContact CZ-OD1 3.93Å; R86-D121 IonicContact NE-OD1 3.68Å; R86-D121 PolarHBondContact NE-OD1 3.43Å; R86-D121 IonicContact NH1-OD1 3.52Å; R86-D121 PolarHBondContact NH1-OD1 3.08Å; R86-D121 VanDerWaalsContact NH1-OD1 3.16Å; R86-D121 IonicContact NH2-OD1 3.92Å; R86-D121 PolarHBondContact NH2-OD1 2.84Å; R86-D121 VanDerWaalsContact NH2-OD1 3.13Å; R86-L156 PolarHBondContact NH2-O 2.96Å; R86-L156 VanDerWaalsContact NH2-O 3.11Å
87	E	87.4	Confident	83.6	Confident	18 Å²	18	58.5 Å²	58.5	8%	0.084	32%	0.32	C	S	.	.	H	α-helix	trans	-66.6	-42.9	-177.6	-71.7	54.8	-110.5	0	0	110.3	D85 R91 H125 L156	D85-E87 PolarHBondContact OD1-N 3.21Å; E87-R91 WeakPolarHBondContact O-CA 3.37Å; E87-R91 WeakPolarHBondContact O-CG 3.46Å; E87-R91 PolarHBondContact O-N 3.43Å; E87-H125 IonicContact OE2-CE1 3.45Å; E87-L156 HydrophobicContact CB-CB 4.45Å; E87-L156 HydrophobicContact CG-CB 3.59Å
88	A	84.6	Confident	83.7	Confident	65 Å²	65	58.7 Å²	58.7	54%	0.537	32%	0.321	S	S	.	.	H	α-helix	trans	-67.9	-36.2	174.6	0	0	0	0	0	112.5	D85	D85-A88 VanDerWaalsContact CG-CB 3.45Å; D85-A88 WeakPolarHBondContact OD1-CB 3.35Å; D85-A88 PolarHBondContact OD1-N 2.86Å; D85-A88 VanDerWaalsContact OD2-CB 3.28Å; D85-A88 WeakPolarHBondContact OD2-CB 3.44Å
89	L	82.7	Confident	83.6	Confident	85 Å²	85	60.2 Å²	60.2	45%	0.445	33%	0.333	S	S	.	.	H	α-helix	trans	-74.7	-43.5	179.8	-75	175.5	0	0	0	113.2	P68 L84 D85 R86	P68-L89 HydrophobicContact CG-CD1 4.46Å; L84-L89 HydrophobicContact CD1-CD1 3.57Å; L84-L89 HydrophobicContact CG-CD1 4.41Å; D85-L89 VanDerWaalsContact O-CD1 3.32Å; D85-L89 WeakPolarHBondContact O-CD1 3.4Å; D85-L89 VanDerWaalsContact O-CG 3.22Å; D85-L89 WeakPolarHBondContact O-CG 3.44Å; R86-L89 PolarHBondContact O-N 3.47Å
90	C	81.4	Confident	83.6	Confident	32 Å²	32	59.4 Å²	59.4	22%	0.216	33%	0.328	C	S	.	.	H	α-helix	trans	-126.2	-8.3	-163.7	-71.3	0	0	0	0	114.8	R86 G92 S93 C96	R86-C90 WeakPolarHBondContact O-CA 3.32Å; R86-C90 WeakPolarHBondContact O-CB 3.5Å; R86-C90 PolarHBondContact O-N 3.14Å; C90-G92 PolarHBondContact O-N 2.91Å; C90-S93 VanDerWaalsContact O-CB 3.28Å; C90-S93 WeakPolarHBondContact O-CB 3.3Å; C90-S93 PolarHBondContact O-N 3.34Å; C90-S93 VanDerWaalsContact O-N 3.16Å; C90-C96 HydrophobicContact CB-CB 3.58Å; C90-C96 WeakPolarHBondContact CB-SG 3.38Å; C90-C96 WeakPolarHBondContact SG-CA 3.36Å; C90-C96 WeakPolarHBondContact SG-CB 3.47Å; C90-C96 CovalentContact SG-SG 2.03Å; C90-C96 PolarHBondContact SG-SG 3.46Å
91	R	75.8	Confident	83.4	Confident	220 Å²	220	61 Å²	61	83%	0.83	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	52	165.4	-56.7	-178.7	179.4	-166.3	-4.3	114.6	E87 S93	E87-R91 WeakPolarHBondContact O-CA 3.37Å; E87-R91 WeakPolarHBondContact O-CG 3.46Å; E87-R91 PolarHBondContact O-N 3.43Å; R91-S93 VanDerWaalsContact C-N 3.32Å; R91-S93 PolarHBondContact O-N 3.28Å
92	G	68.9	Low	83.4	Confident	42 Å²	42	55.1 Å²	55.1	43%	0.433	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	19.4	178.2	0	0	0	0	0	114.9	C90	C90-G92 PolarHBondContact O-N 2.91Å
93	S	79.3	Confident	83.4	Confident	60 Å²	60	56.1 Å²	56.1	42%	0.42	31%	0.309	S	S	.	.			trans	-75.7	135.1	171.7	-172.2	0	0	0	0	111.6	R86 C90 R91 L95	R86-S93 PolarHBondContact NH1-O 2.97Å; R86-S93 VanDerWaalsContact NH1-O 3.14Å; C90-S93 VanDerWaalsContact O-CB 3.28Å; C90-S93 WeakPolarHBondContact O-CB 3.3Å; C90-S93 PolarHBondContact O-N 3.34Å; C90-S93 VanDerWaalsContact O-N 3.16Å; R91-S93 VanDerWaalsContact C-N 3.32Å; R91-S93 PolarHBondContact O-N 3.28Å; S93-L95 PolarHBondContact O-N 3.45Å; S93-L95 VanDerWaalsContact O-N 3.14Å
94	D	74.4	Confident	83.3	Confident	140 Å²	140	50.4 Å²	50.4	75%	0.749	28%	0.283	S	S	*	.	S	Bend	trans	-58.7	-23.2	177.5	-66.5	-48	0	0	0	114.3
95	L	83.2	Confident	82.9	Confident	99 Å²	99	56.1 Å²	56.1	52%	0.518	30%	0.304	S	S	.	.			trans	-128.7	101	178.5	-179.5	63.9	0	0	0	110.6	S93 E97 E118	S93-L95 PolarHBondContact O-N 3.45Å; S93-L95 VanDerWaalsContact O-N 3.14Å; L95-E97 HydrophobicContact CG-CB 4.33Å; L95-E97 PolarHBondContact O-N 3.17Å; L95-E118 HydrophobicContact CD1-CG 4.29Å
96	C	87.4	Confident	82.3	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.02	30%	0.296	C	S	.	.			trans	-92.3	90.5	173.5	-169	0	0	0	0	110.8	R86 C90 V119	R86-C96 HydrophobicContact CG-CB 3.78Å; R86-C96 VanDerWaalsContact CG-SG 3.58Å; C90-C96 HydrophobicContact CB-CB 3.58Å; C90-C96 WeakPolarHBondContact CB-SG 3.38Å; C90-C96 WeakPolarHBondContact SG-CA 3.36Å; C90-C96 WeakPolarHBondContact SG-CB 3.47Å; C90-C96 CovalentContact SG-SG 2.03Å; C90-C96 PolarHBondContact SG-SG 3.46Å; C96-V119 HydrophobicContact CB-CB 4.11Å; C96-V119 PolarHBondContact O-N 3.3Å
97	E	87.6	Confident	81.4	Confident	63 Å²	63	59.6 Å²	59.6	29%	0.294	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	112.7	-178.6	-168.8	-176	-122.8	0	0	112.3	H26 L95 R116	H26-E97 IonicContact CE1-OE1 3.7Å; H26-E97 IonicContact ND1-OE1 2.78Å; L95-E97 HydrophobicContact CG-CB 4.33Å; L95-E97 PolarHBondContact O-N 3.17Å; E97-R116 HydrophobicContact CG-CB 4Å; E97-R116 WeakPolarHBondContact OE1-CD 3.3Å; E97-R116 IonicContact OE1-NH1 2.7Å; E97-R116 VanDerWaalsContact OE2-CD 3.24Å; E97-R116 WeakPolarHBondContact OE2-CD 3.23Å; E97-R116 IonicContact OE2-CZ 2.77Å; E97-R116 IonicContact OE2-NE 3.6Å; E97-R116 IonicContact OE2-NH1 3.31Å; E97-R116 PolarHBondContact OE2-NH1 3.32Å
98	V	86.7	Confident	80.6	Confident	25 Å²	25	62 Å²	62	15%	0.152	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	107.9	174.8	-178	0	0	0	0	109.4	L67 P68 F69 F100 V117 V119	L67-V98 HydrophobicContact CD1-CG1 3.92Å; P68-V98 HydrophobicContact CG-CG1 4.35Å; F69-V98 HydrophobicContact CD2-CG1 4.15Å; F69-V98 HydrophobicContact CE2-CB 3.94Å; F69-V98 HydrophobicContact CE2-CG1 3.91Å; F69-V98 HydrophobicContact CE2-CG2 4.29Å; V98-F100 HydrophobicContact CG1-CD1 4.49Å; V98-V117 PolarHBondContact N-O 2.84Å; V98-V117 PolarHBondContact O-N 2.61Å; V98-V119 HydrophobicContact CG2-CG2 4.2Å
99	A	85.8	Confident	80	Confident	31 Å²	31	62.5 Å²	62.5	26%	0.256	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.7	-176.4	0	0	0	0	0	113	Q63 I115 R116	Q63-A99 PolarHBondContact NE2-O 2.69Å; A99-I115 WeakPolarHBondContact CA-O 3.47Å; A99-R116 HydrophobicContact CB-CG 4.21Å
100	F	86.9	Confident	79.6	Confident	1 Å²	1	62.6 Å²	62.6	0%	0.004	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	165.4	179.4	63.3	-86	0	0	0	112.7	V60 L67 F69 V71 I78 V98 V102 I115 V117	V60-F100 HydrophobicContact CG1-CD2 4.31Å; L67-F100 HydrophobicContact CD1-CB 3.8Å; L67-F100 HydrophobicContact CD1-CD1 3.76Å; L67-F100 HydrophobicContact CD1-CE1 4.49Å; L67-F100 HydrophobicContact CD1-CG 3.9Å; L67-F100 HydrophobicContact CD2-CB 4Å; L67-F100 HydrophobicContact CD2-CD1 3.9Å; L67-F100 HydrophobicContact CD2-CD2 3.66Å; L67-F100 HydrophobicContact CD2-CE1 4.2Å; L67-F100 HydrophobicContact CD2-CE2 3.99Å; L67-F100 HydrophobicContact CD2-CG 3.6Å; L67-F100 HydrophobicContact CD2-CZ 4.24Å; L67-F100 HydrophobicContact CG-CD1 4.34Å; L67-F100 HydrophobicContact CG-CG 4.39Å; F69-F100 HydrophobicContact CB-CE1 4.26Å; F69-F100 HydrophobicContact CB-CZ 4.16Å; F69-F100 AromaticContact CD2-CE1 3.84Å; F69-F100 HydrophobicContact CD2-CE1 3.84Å; F69-F100 HydrophobicContact CG-CE1 4.32Å; V71-F100 HydrophobicContact CG2-CE2 3.89Å; V71-F100 HydrophobicContact CG2-CZ 4.39Å; I78-F100 HydrophobicContact CD1-CZ 4.26Å; I78-F100 HydrophobicContact CG2-CZ 4.24Å; V98-F100 HydrophobicContact CG1-CD1 4.49Å; F100-V102 HydrophobicContact CD2-CG2 4.14Å; F100-V102 HydrophobicContact CE2-CG2 3.98Å; F100-I115 HydrophobicContact CD1-CG2 4.48Å; F100-I115 HydrophobicContact CD2-CB 4.36Å; F100-I115 HydrophobicContact CD2-CD1 4.12Å; F100-I115 HydrophobicContact CE1-CB 4.32Å; F100-I115 HydrophobicContact CE1-CG2 3.88Å; F100-I115 HydrophobicContact CE2-CB 4.14Å; F100-I115 HydrophobicContact CE2-CD1 3.55Å; F100-I115 HydrophobicContact CE2-CG1 4.48Å; F100-I115 HydrophobicContact CE2-CG2 4.26Å; F100-I115 HydrophobicContact CZ-CB 4.14Å; F100-I115 HydrophobicContact CZ-CD1 4.08Å; F100-I115 HydrophobicContact CZ-CG2 3.77Å; F100-I115 PolarHBondContact N-O 2.69Å; F100-I115 PolarHBondContact O-N 3.15Å; F100-I115 VanDerWaalsContact O-O 3.07Å; F100-V117 HydrophobicContact CE1-CG2 3.84Å; F100-V117 HydrophobicContact CZ-CG2 4.46Å
101	S	84.8	Confident	79.5	Confident	35 Å²	35	63.4 Å²	63.4	25%	0.245	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	140.9	-177.3	-59.6	0	0	0	0	111.2	V61 L113	V61-S101 PolarHBondContact N-O 2.88Å; S101-L113 CarbonylContact C-O 3.42Å; S101-L113 VanDerWaalsContact CA-O 3.23Å; S101-L113 WeakPolarHBondContact CA-O 3.4Å
102	V	84.8	Confident	79.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.5	174.2	165.8	0	0	0	0	109.5	L42 F58 Q59 V60 V71 F100 L113 I115	L42-V102 HydrophobicContact CD1-CB 4.35Å; L42-V102 HydrophobicContact CD1-CG1 3.93Å; L42-V102 HydrophobicContact CD1-CG2 4.44Å; F58-V102 HydrophobicContact CB-CG1 4.21Å; F58-V102 HydrophobicContact CD1-CG1 4.09Å; Q59-V102 CarbonylContact O-C 3.39Å; Q59-V102 VanDerWaalsContact O-CA 3.32Å; Q59-V102 WeakPolarHBondContact O-CA 3.38Å; V60-V102 HydrophobicContact CG2-CG2 4.05Å; V71-V102 HydrophobicContact CG1-CG2 4.47Å; V71-V102 HydrophobicContact CG2-CG2 4.08Å; F100-V102 HydrophobicContact CD2-CG2 4.14Å; F100-V102 HydrophobicContact CE2-CG2 3.98Å; V102-L113 PolarHBondContact N-O 2.82Å; V102-L113 PolarHBondContact O-N 3.45Å; V102-I115 HydrophobicContact CB-CD1 3.75Å; V102-I115 HydrophobicContact CG2-CD1 3.4Å
103	L	82.8	Confident	80.5	Confident	53 Å²	53	52.4 Å²	52.4	28%	0.277	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	145.5	169.2	-56.9	179.1	0	0	0	109.4	F58 Q59 V61 V110 N111 C112	F58-L103 CarbonylContact C-O 3.58Å; F58-L103 VanDerWaalsContact CA-O 3.32Å; F58-L103 WeakPolarHBondContact CA-O 3.34Å; Q59-L103 PolarHBondContact N-O 3.47Å; Q59-L103 PolarHBondContact O-N 3.44Å; V61-L103 HydrophobicContact CG2-CD1 4.25Å; V61-L103 HydrophobicContact CG2-CD2 4.14Å; V61-L103 HydrophobicContact CG2-CG 3.8Å; L103-V110 HydrophobicContact CB-CG1 4.09Å; L103-V110 HydrophobicContact CD1-CG1 4.35Å; L103-V110 HydrophobicContact CD2-CG1 4.27Å; L103-V110 HydrophobicContact CG-CG1 4.47Å; L103-N111 WeakPolarHBondContact CA-O 3.44Å; L103-C112 HydrophobicContact CD2-CB 3.78Å
104	Y	83.9	Confident	80.8	Confident	5 Å²	5	55 Å²	55	2%	0.02	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	160	171.7	73.4	-77.2	0	0	0	109.9	L46 L55 F58 K106 N111 L113	L46-Y104 HydrophobicContact CD1-CD2 4.26Å; L46-Y104 HydrophobicContact CD1-CE2 4.18Å; L46-Y104 HydrophobicContact CD1-CG 4.49Å; L55-Y104 HydrophobicContact CD2-CD2 3.94Å; L55-Y104 HydrophobicContact CD2-CE2 3.7Å; F58-Y104 HydrophobicContact CE1-CG 4.27Å; Y104-K106 HydrophobicContact CE2-CB 4.08Å; Y104-N111 HydrophobicContact CD1-CB 3.9Å; Y104-N111 HydrophobicContact CE1-CB 3.26Å; Y104-N111 HydrophobicContact CE2-CB 4.06Å; Y104-N111 PolarHBondContact N-O 2.97Å; Y104-N111 PolarHBondContact O-N 2.81Å; Y104-N111 PolarHBondContact OH-ND2 2.92Å; Y104-L113 HydrophobicContact CD1-CD1 3.68Å; Y104-L113 HydrophobicContact CD1-CD2 4.05Å; Y104-L113 HydrophobicContact CD1-CG 3.59Å; Y104-L113 HydrophobicContact CE1-CD1 3.93Å; Y104-L113 HydrophobicContact CE1-CD2 3.43Å; Y104-L113 VanDerWaalsContact CE1-CD2 3.43Å; Y104-L113 HydrophobicContact CE1-CG 3.53Å; Y104-L113 HydrophobicContact CG-CD1 4.47Å
105	R	78.6	Confident	81.4	Confident	123 Å²	123	48.4 Å²	48.4	46%	0.464	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	132.2	175.8	-57.9	-173.5	-159.1	-139.5	6.8	111.5	E56 D57 S109 V110	E56-R105 PolarHBondContact N-O 3.38Å; E56-R105 PolarHBondContact O-N 3.29Å; D57-R105 HydrophobicContact CB-CG 4.2Å; D57-R105 IonicContact OD2-CZ 3.86Å; D57-R105 IonicContact OD2-NE 2.67Å; D57-R105 PolarHBondContact OD2-NE 3.47Å; D57-R105 IonicContact OD2-NH2 2.67Å; D57-R105 PolarHBondContact OD2-NH2 2.88Å; R105-S109 VanDerWaalsContact CA-O 3.3Å; R105-S109 WeakPolarHBondContact CA-O 3.39Å; R105-V110 HydrophobicContact CG-CG2 4.37Å
106	K	74.3	Confident	81.6	Confident	56 Å²	56	47 Å²	47	24%	0.243	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.8	166.8	-177.2	-177.2	-178.4	-176.5	0	109.1	E51 L55 Y104 G108 S109	E51-K106 WeakPolarHBondContact OE2-CD 3.31Å; E51-K106 VanDerWaalsContact OE2-CE 3.26Å; E51-K106 WeakPolarHBondContact OE2-CE 3.41Å; E51-K106 IonicContact OE2-NZ 2.75Å; E51-K106 PolarHBondContact OE2-NZ 3.47Å; L55-K106 HydrophobicContact CD2-CB 3.93Å; L55-K106 HydrophobicContact CD2-CD 4.46Å; L55-K106 HydrophobicContact CD2-CG 3.99Å; Y104-K106 HydrophobicContact CE2-CB 4.08Å; K106-G108 PolarHBondContact O-N 3.09Å; K106-S109 PolarHBondContact N-O 2.96Å; K106-S109 PolarHBondContact O-N 3.19Å
107	S	68.9	Low	81.6	Confident	96 Å²	96	46.8 Å²	46.8	67%	0.671	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	31.1	175.9	-54.9	0	0	0	0	115
108	G	69	Low	81.7	Confident	68 Å²	68	46.2 Å²	46.2	70%	0.701	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	99	-19.4	-178.4	0	0	0	0	0	115.7	K106	K106-G108 PolarHBondContact O-N 3.09Å
109	S	72.2	Confident	81.8	Confident	75 Å²	75	45.3 Å²	45.3	52%	0.524	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	139.5	176.2	-64.2	0	0	0	0	111.7	R105 K106	R105-S109 VanDerWaalsContact CA-O 3.3Å; R105-S109 WeakPolarHBondContact CA-O 3.39Å; K106-S109 PolarHBondContact N-O 2.96Å; K106-S109 PolarHBondContact O-N 3.19Å
110	V	75.4	Confident	81.9	Confident	88 Å²	88	45.7 Å²	45.7	53%	0.533	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	119	171.8	-178.9	0	0	0	0	109.2	L103 R105	L103-V110 HydrophobicContact CB-CG1 4.09Å; L103-V110 HydrophobicContact CD1-CG1 4.35Å; L103-V110 HydrophobicContact CD2-CG1 4.27Å; L103-V110 HydrophobicContact CG-CG1 4.47Å; R105-V110 HydrophobicContact CG-CG2 4.37Å
111	N	79	Confident	81.9	Confident	49 Å²	49	46.9 Å²	46.9	26%	0.262	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	156.9	177.3	-71.2	-7.4	0	0	0	109.9	L103 Y104	L103-N111 WeakPolarHBondContact CA-O 3.44Å; Y104-N111 HydrophobicContact CD1-CB 3.9Å; Y104-N111 HydrophobicContact CE1-CB 3.26Å; Y104-N111 HydrophobicContact CE2-CB 4.06Å; Y104-N111 PolarHBondContact N-O 2.97Å; Y104-N111 PolarHBondContact O-N 2.81Å; Y104-N111 PolarHBondContact OH-ND2 2.92Å
112	C	80.6	Confident	82.1	Confident	29 Å²	29	47.7 Å²	47.7	20%	0.196	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.5	-177.6	-172.8	0	0	0	0	111.8	C17 L103	C17-C112 HydrophobicContact CB-CB 4.38Å; C17-C112 VanDerWaalsContact SG-CB 3.55Å; L103-C112 HydrophobicContact CD2-CB 3.78Å
113	L	84.8	Confident	82.3	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.5	176.5	-55	173.1	0	0	0	109.1	I23 I25 L42 L46 S101 V102 Y104	I23-L113 HydrophobicContact CB-CD2 3.79Å; I23-L113 HydrophobicContact CD1-CD2 4.35Å; I23-L113 HydrophobicContact CG1-CD2 4.44Å; I23-L113 HydrophobicContact CG2-CD2 4.43Å; I25-L113 HydrophobicContact CD1-CD1 4.4Å; L42-L113 HydrophobicContact CD2-CD1 4.19Å; L46-L113 HydrophobicContact CD1-CD1 4Å; L46-L113 HydrophobicContact CD2-CD1 4.23Å; L46-L113 HydrophobicContact CD2-CD2 3.73Å; L46-L113 HydrophobicContact CG-CD1 4.48Å; S101-L113 CarbonylContact C-O 3.42Å; S101-L113 VanDerWaalsContact CA-O 3.23Å; S101-L113 WeakPolarHBondContact CA-O 3.4Å; V102-L113 PolarHBondContact N-O 2.82Å; V102-L113 PolarHBondContact O-N 3.45Å; Y104-L113 HydrophobicContact CD1-CD1 3.68Å; Y104-L113 HydrophobicContact CD1-CD2 4.05Å; Y104-L113 HydrophobicContact CD1-CG 3.59Å; Y104-L113 HydrophobicContact CE1-CD1 3.93Å; Y104-L113 HydrophobicContact CE1-CD2 3.43Å; Y104-L113 VanDerWaalsContact CE1-CD2 3.43Å; Y104-L113 HydrophobicContact CE1-CG 3.53Å; Y104-L113 HydrophobicContact CG-CD1 4.47Å
114	R	85.3	Confident	82.5	Confident	116 Å²	116	49.4 Å²	49.4	44%	0.438	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	107.9	167.8	-171.5	171.2	-176.7	159.9	1.8	109	I23 I24 I25	I23-R114 PolarHBondContact O-N 2.86Å; I24-R114 VanDerWaalsContact CA-O 3.3Å; I24-R114 WeakPolarHBondContact CA-O 2.99Å; I24-R114 HydrophobicContact CG1-CB 4.45Å; I24-R114 WeakPolarHBondContact CG2-O 3.5Å; I25-R114 PolarHBondContact N-O 3.48Å; I25-R114 VanDerWaalsContact N-O 3.11Å
115	I	86.7	Confident	82.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	138.6	177.3	-60.9	158.3	0	0	0	107.9	I25 Y27 L42 I78 A99 F100 V102 V117	I25-I115 WeakPolarHBondContact O-CA 3.49Å; Y27-I115 HydrophobicContact CD2-CG2 3.95Å; Y27-I115 HydrophobicContact CE2-CG2 4.28Å; L42-I115 HydrophobicContact CD1-CD1 3.8Å; L42-I115 HydrophobicContact CD2-CD1 3.71Å; L42-I115 HydrophobicContact CD2-CG1 3.83Å; L42-I115 HydrophobicContact CG-CD1 4.33Å; I78-I115 HydrophobicContact CD1-CD1 3.87Å; I78-I115 HydrophobicContact CD1-CG1 4.46Å; I78-I115 HydrophobicContact CD1-CG2 3.91Å; A99-I115 WeakPolarHBondContact CA-O 3.47Å; F100-I115 HydrophobicContact CD1-CG2 4.48Å; F100-I115 HydrophobicContact CD2-CB 4.36Å; F100-I115 HydrophobicContact CD2-CD1 4.12Å; F100-I115 HydrophobicContact CE1-CB 4.32Å; F100-I115 HydrophobicContact CE1-CG2 3.88Å; F100-I115 HydrophobicContact CE2-CB 4.14Å; F100-I115 HydrophobicContact CE2-CD1 3.55Å; F100-I115 HydrophobicContact CE2-CG1 4.48Å; F100-I115 HydrophobicContact CE2-CG2 4.26Å; F100-I115 HydrophobicContact CZ-CB 4.14Å; F100-I115 HydrophobicContact CZ-CD1 4.08Å; F100-I115 HydrophobicContact CZ-CG2 3.77Å; F100-I115 PolarHBondContact N-O 2.69Å; F100-I115 PolarHBondContact O-N 3.15Å; F100-I115 VanDerWaalsContact O-O 3.07Å; V102-I115 HydrophobicContact CB-CD1 3.75Å; V102-I115 HydrophobicContact CG2-CD1 3.4Å; I115-V117 HydrophobicContact CG2-CG2 4.03Å
116	R	88.4	Confident	83.2	Confident	69 Å²	69	48.9 Å²	48.9	26%	0.26	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.5	167.6	-51.3	-155.1	-166.2	-169.6	10.5	108.2	I24 I25 H26 Y27 E97 A99	I24-R116 HydrophobicContact CG2-CG 4.09Å; I25-R116 PolarHBondContact O-N 2.99Å; H26-R116 CarbonylContact C-O 3.54Å; H26-R116 WeakPolarHBondContact CA-O 3.49Å; Y27-R116 PolarHBondContact N-O 3.17Å; E97-R116 HydrophobicContact CG-CB 4Å; E97-R116 WeakPolarHBondContact OE1-CD 3.3Å; E97-R116 IonicContact OE1-NH1 2.7Å; E97-R116 VanDerWaalsContact OE2-CD 3.24Å; E97-R116 WeakPolarHBondContact OE2-CD 3.23Å; E97-R116 IonicContact OE2-CZ 2.77Å; E97-R116 IonicContact OE2-NE 3.6Å; E97-R116 IonicContact OE2-NH1 3.31Å; E97-R116 PolarHBondContact OE2-NH1 3.32Å; A99-R116 HydrophobicContact CB-CG 4.21Å
117	V	88.3	Confident	84.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	112.1	173.1	-172.9	0	0	0	0	107.6	Y27 V29 V39 F69 V98 F100 I115	Y27-V117 WeakPolarHBondContact O-CA 3.47Å; V29-V117 HydrophobicContact CB-CG1 4.28Å; V29-V117 HydrophobicContact CG1-CG1 3.7Å; V39-V117 HydrophobicContact CG1-CG1 3.95Å; V39-V117 HydrophobicContact CG1-CG2 4.32Å; F69-V117 HydrophobicContact CD2-CG2 4.28Å; F69-V117 HydrophobicContact CE1-CG1 4.13Å; F69-V117 HydrophobicContact CE2-CB 3.83Å; F69-V117 HydrophobicContact CE2-CG1 4.01Å; F69-V117 HydrophobicContact CE2-CG2 4.06Å; F69-V117 HydrophobicContact CZ-CB 3.95Å; F69-V117 HydrophobicContact CZ-CG1 3.57Å; F69-V117 HydrophobicContact CZ-CG2 4.31Å; V98-V117 PolarHBondContact N-O 2.84Å; V98-V117 PolarHBondContact O-N 2.61Å; F100-V117 HydrophobicContact CE1-CG2 3.84Å; F100-V117 HydrophobicContact CZ-CG2 4.46Å; I115-V117 HydrophobicContact CG2-CG2 4.03Å
118	E	88.9	Confident	85.2	Confident	50 Å²	50	44.7 Å²	44.7	23%	0.234	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	116.4	169.1	-177.7	179.8	178	0	0	107.6	Y27 R28 V29 L95	Y27-E118 PolarHBondContact O-N 2.86Å; R28-E118 WeakPolarHBondContact CA-O 3.42Å; R28-E118 HydrophobicContact CG-CB 4.02Å; R28-E118 HydrophobicContact CG-CG 4.4Å; R28-E118 IonicContact CZ-OE1 3.2Å; R28-E118 IonicContact CZ-OE2 3.91Å; R28-E118 IonicContact NE-OE1 3.39Å; R28-E118 IonicContact NE-OE2 2.86Å; R28-E118 PolarHBondContact NE-OE2 3.28Å; R28-E118 IonicContact NH2-OE1 2.7Å; R28-E118 PolarHBondContact NH2-OE1 3.26Å; R28-E118 IonicContact NH2-OE2 3.67Å; R28-E118 PolarHBondContact NH2-OE2 3.32Å; V29-E118 PolarHBondContact N-O 2.76Å; V29-E118 VanDerWaalsContact N-O 3.13Å; L95-E118 HydrophobicContact CD1-CG 4.29Å
119	V	88.7	Confident	86.3	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.042	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	113.8	175.5	-172.6	0	0	0	0	107.2	V29 E31 L84 R86 C96 V98	V29-V119 HydrophobicContact CG1-CG2 4.48Å; E31-V119 HydrophobicContact CB-CG1 4.01Å; L84-V119 HydrophobicContact CD2-CB 4.46Å; L84-V119 HydrophobicContact CD2-CG1 3.69Å; L84-V119 HydrophobicContact CD2-CG2 3.97Å; L84-V119 HydrophobicContact CG-CG1 4.19Å; R86-V119 HydrophobicContact CB-CG1 4.04Å; R86-V119 HydrophobicContact CG-CB 4.27Å; R86-V119 HydrophobicContact CG-CG1 3.87Å; C96-V119 HydrophobicContact CB-CB 4.11Å; C96-V119 PolarHBondContact O-N 3.3Å; V98-V119 HydrophobicContact CG2-CG2 4.2Å
120	M	87.1	Confident	87.1	Confident	39 Å²	39	43.5 Å²	43.5	19%	0.192	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	129.2	-178.4	-60.6	-175.4	-62.9	0	0	110.1	R28 V29 W30 E31	R28-M120 HydrophobicContact CB-CE 3.84Å; R28-M120 HydrophobicContact CB-CG 4.25Å; R28-M120 HydrophobicContact CB-SD 3.75Å; R28-M120 HydrophobicContact CG-CG 4.29Å; R28-M120 HydrophobicContact CG-SD 4Å; V29-M120 PolarHBondContact O-N 3.24Å; W30-M120 HydrophobicContact CD2-CB 3.99Å; W30-M120 HydrophobicContact CD2-CE 3.67Å; W30-M120 VanDerWaalsContact CE2-CE 3.49Å; W30-M120 HydrophobicContact CE3-CB 3.48Å; W30-M120 VanDerWaalsContact CE3-CB 3.48Å; W30-M120 HydrophobicContact CE3-CE 4.27Å; W30-M120 HydrophobicContact CG-CE 3.87Å; W30-M120 HydrophobicContact CH2-CB 4.37Å; W30-M120 HydrophobicContact CH2-SD 4.47Å; W30-M120 HydrophobicContact CZ2-CE 3.97Å; W30-M120 HydrophobicContact CZ2-SD 4.32Å; W30-M120 HydrophobicContact CZ3-CB 3.7Å; E31-M120 PolarHBondContact N-O 3.03Å; E31-M120 VanDerWaalsContact N-O 3.1Å
121	D	87.8	Confident	87.8	Confident	25 Å²	25	43.3 Å²	43.3	13%	0.134	23%	0.227	C	C	.	.			trans	-71.3	131.6	-172.9	-175.6	115.6	0	0	0	112.8	W30 E31 R86 A158 N161	W30-D121 WeakPolarHBondContact CZ3-O 3.48Å; E31-D121 VanDerWaalsContact OE1-CA 3.25Å; E31-D121 WeakPolarHBondContact OE1-CA 3.17Å; R86-D121 IonicContact CZ-OD1 3.93Å; R86-D121 IonicContact NE-OD1 3.68Å; R86-D121 PolarHBondContact NE-OD1 3.43Å; R86-D121 IonicContact NH1-OD1 3.52Å; R86-D121 PolarHBondContact NH1-OD1 3.08Å; R86-D121 VanDerWaalsContact NH1-OD1 3.16Å; R86-D121 IonicContact NH2-OD1 3.92Å; R86-D121 PolarHBondContact NH2-OD1 2.84Å; R86-D121 VanDerWaalsContact NH2-OD1 3.13Å; D121-A158 WeakPolarHBondContact OD1-CA 3.47Å; D121-A158 WeakPolarHBondContact OD1-CB 3.44Å; D121-A158 PolarHBondContact OD1-N 2.84Å; D121-N161 PolarHBondContact O-ND2 3.36Å; D121-N161 VanDerWaalsContact OD2-CB 3.24Å; D121-N161 WeakPolarHBondContact OD2-CB 3.42Å; D121-N161 PolarHBondContact OD2-ND2 3.29Å
122	L	88.6	Confident	88.3	Confident	53 Å²	53	46.3 Å²	46.3	28%	0.277	25%	0.248	S	C	.	.			trans	-106.4	145.1	172.8	-70.5	176.2	0	0	0	110.5	W30 E31 E32 D124	W30-L122 HydrophobicContact CB-CD1 4.47Å; W30-L122 HydrophobicContact CD2-CD2 4.06Å; W30-L122 HydrophobicContact CE3-CD2 3.52Å; W30-L122 HydrophobicContact CE3-CG 4.08Å; W30-L122 HydrophobicContact CZ3-CD2 4.09Å; E31-L122 HydrophobicContact CG-CB 3.89Å; E31-L122 HydrophobicContact CG-CD1 3.88Å; E31-L122 HydrophobicContact CG-CG 3.85Å; E31-L122 WeakPolarHBondContact O-CD1 3.49Å; E31-L122 PolarHBondContact OE1-N 3.4Å; E32-L122 HydrophobicContact CB-CD1 4.28Å; L122-D124 VanDerWaalsContact C-N 3.26Å; L122-D124 PolarHBondContact O-N 2.83Å
123	N	88.6	Confident	88.9	Confident	23 Å²	23	48.9 Å²	48.9	12%	0.123	26%	0.263	C	S	.	.	S	Bend	trans	-76.3	79.9	171.9	-159.7	52.8	0	0	0	108.9	D157 N161 D212 P216 K218	N123-D157 VanDerWaalsContact CA-OD2 3.29Å; N123-D157 WeakPolarHBondContact CA-OD2 3.4Å; N123-D157 PolarHBondContact OD1-OD2 3.29Å; N123-N161 HydrophobicContact CB-CB 4Å; N123-N161 PolarHBondContact N-ND2 2.98Å; N123-N161 WeakPolarHBondContact OD1-CB 3.33Å; N123-N161 PolarHBondContact OD1-O 2.91Å; N123-N161 VanDerWaalsContact OD1-O 3.06Å; N123-D212 PolarHBondContact ND2-OD2 3.24Å; N123-D212 PolarHBondContact OD1-OD2 2.66Å; N123-P216 PolarHBondContact ND2-O 2.74Å; N123-K218 VanDerWaalsContact O-CE 3.28Å; N123-K218 WeakPolarHBondContact O-CE 3.15Å; N123-K218 PolarHBondContact O-NZ 2.6Å
124	D	86.8	Confident	89.3	Confident	66 Å²	66	50.2 Å²	50.2	35%	0.353	27%	0.269	S	S	.	.			trans	-113.6	-32.3	-174.4	99.3	-48	0	0	0	112.8	L122 D157 K218	L122-D124 VanDerWaalsContact C-N 3.26Å; L122-D124 PolarHBondContact O-N 2.83Å; D124-D157 PolarHBondContact N-OD2 2.83Å; D124-K218 PolarHBondContact O-NZ 2.75Å
125	H	87.9	Confident	89.8	Confident	66 Å²	66	51.6 Å²	51.6	31%	0.306	28%	0.28	S	S	.	.	S	Bend	trans	-81.1	-160.2	164.1	-59.5	77.8	0	0	0	111.6	E87 L156 D157 K218	E87-H125 IonicContact OE2-CE1 3.45Å; H125-L156 HydrophobicContact CB-CB 4.41Å; H125-D157 WeakPolarHBondContact CB-OD1 3.36Å; H125-D157 IonicContact CG-OD1 3.64Å; H125-D157 PolarHBondContact N-OD1 3.08Å; H125-D157 PolarHBondContact N-OD2 2.85Å; H125-D157 VanDerWaalsContact N-OD2 3.1Å; H125-D157 IonicContact ND1-OD1 2.62Å; H125-D157 PolarHBondContact ND1-OD1 2.82Å; H125-K218 WeakPolarHBondContact O-CD 3.43Å; H125-K218 WeakPolarHBondContact O-CE 3.3Å; H125-K218 PolarHBondContact O-NZ 2.74Å
126	S	90.2	Very high	90.1	Very high	51 Å²	51	52 Å²	52	36%	0.357	28%	0.282	S	S	.	.			trans	-166	151.9	179.5	60.6	0	0	0	0	110.3	S128 D155	S126-S128 PolarHBondContact O-N 3.3Å; S126-D155 VanDerWaalsContact C-OD1 3.29Å; S126-D155 PolarHBondContact N-OD1 2.87Å
127	P	92.5	Very high	90.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	30%	0.298	C	S	.	.			trans	-54.9	126.7	175.7	-22.2	29.9	0	0	0	111	A153 D155 L163 A210 D212 G220	P127-A153 HydrophobicContact CB-CB 4.45Å; P127-D155 WeakPolarHBondContact CD-OD2 3.5Å; P127-D155 VanDerWaalsContact CG-OD2 3.24Å; P127-D155 WeakPolarHBondContact CG-OD2 3.4Å; P127-D155 VanDerWaalsContact N-OD2 3.17Å; P127-L163 HydrophobicContact CB-CD1 4.45Å; P127-A210 HydrophobicContact CB-CB 3.66Å; P127-D212 HydrophobicContact CG-CB 4.43Å; P127-G220 WeakPolarHBondContact O-CA 3.28Å; P127-G220 PolarHBondContact O-N 2.67Å
128	S	91.8	Very high	90.7	Very high	63 Å²	63	54.7 Å²	54.7	44%	0.441	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-134	138.6	-176.4	64.3	0	0	0	0	111.1	S126 A153 V154	S126-S128 PolarHBondContact O-N 3.3Å; S128-A153 CarbonylContact O-C 3.54Å; S128-A153 VanDerWaalsContact O-CA 3.3Å; S128-A153 WeakPolarHBondContact O-CA 3.07Å; S128-V154 PolarHBondContact N-O 3Å; S128-V154 PolarHBondContact O-N 2.79Å; S128-V154 PolarHBondContact OG-O 2.64Å
129	F	92.2	Very high	90.9	Very high	29 Å²	29	54.1 Å²	54.1	13%	0.127	30%	0.3	C	S	.	.			trans	-93.6	144.6	176.2	-68.8	-85.1	0	0	0	110.5	N131 D151 A153 Y166 L208 A210 M222	F129-N131 VanDerWaalsContact CB-O 3.25Å; F129-N131 WeakPolarHBondContact CB-O 3.49Å; F129-N131 PolarHBondContact O-N 3.46Å; F129-D151 WeakPolarHBondContact CD1-O 3.38Å; F129-D151 WeakPolarHBondContact CE1-O 3.4Å; F129-A153 HydrophobicContact CD1-CB 4.05Å; F129-A153 HydrophobicContact CE1-CB 3.79Å; F129-A153 HydrophobicContact CE2-CB 4.33Å; F129-A153 HydrophobicContact CG-CB 4.43Å; F129-A153 HydrophobicContact CZ-CB 3.95Å; F129-Y166 HydrophobicContact CE1-CD1 4.45Å; F129-Y166 AromaticContact CE1-CE1 3.92Å; F129-Y166 HydrophobicContact CE1-CE1 3.92Å; F129-Y166 HydrophobicContact CZ-CD1 4.12Å; F129-Y166 AromaticContact CZ-CE1 3.95Å; F129-Y166 HydrophobicContact CZ-CE1 3.95Å; F129-L208 HydrophobicContact CE1-CD2 3.56Å; F129-L208 HydrophobicContact CE1-CG 4.33Å; F129-L208 HydrophobicContact CZ-CB 4.49Å; F129-L208 HydrophobicContact CZ-CD2 3.67Å; F129-L208 HydrophobicContact CZ-CG 3.93Å; F129-A210 HydrophobicContact CE2-CB 3.88Å; F129-A210 HydrophobicContact CZ-CB 3.75Å; F129-M222 HydrophobicContact CB-CB 3.97Å; F129-M222 HydrophobicContact CB-CG 4.46Å; F129-M222 HydrophobicContact CB-SD 4.13Å; F129-M222 HydrophobicContact CD1-CB 4.03Å; F129-M222 HydrophobicContact CD1-CE 4.02Å; F129-M222 HydrophobicContact CD1-SD 3.94Å; F129-M222 HydrophobicContact CD2-CB 3.6Å; F129-M222 HydrophobicContact CE1-CB 4.42Å; F129-M222 HydrophobicContact CE1-CE 4.18Å; F129-M222 HydrophobicContact CE2-CB 4.02Å; F129-M222 HydrophobicContact CG-CB 3.6Å; F129-M222 HydrophobicContact CG-CG 4.42Å; F129-M222 HydrophobicContact CG-SD 4.15Å; F129-M222 HydrophobicContact CZ-CB 4.41Å
130	P	89.1	Confident	91.2	Very high	89 Å²	89	54.3 Å²	54.3	58%	0.578	30%	0.3	S	S	*	.	S	Bend	trans	-67.1	-28.7	177.8	28.4	-35	0	0	0	112.3	D151 R152	P130-D151 HydrophobicContact CG-CB 4.42Å; P130-R152 WeakPolarHBondContact CD-O 3.26Å
131	N	90.6	Very high	91.4	Very high	83 Å²	83	56.5 Å²	56.5	44%	0.444	32%	0.316	S	S	.	.			trans	-118.8	147.5	175.6	-63.2	-54.3	0	0	0	109.6	F129 D151 M222	F129-N131 VanDerWaalsContact CB-O 3.25Å; F129-N131 WeakPolarHBondContact CB-O 3.49Å; F129-N131 PolarHBondContact O-N 3.46Å; N131-D151 PolarHBondContact ND2-OD2 3.14Å; N131-M222 WeakPolarHBondContact O-CG 3.42Å
132	T	89.3	Confident	91.7	Very high	112 Å²	112	55.9 Å²	55.9	69%	0.687	31%	0.314	S	S	*	.	S	Bend	trans	-81.1	-20.3	172.2	48.3	0	0	0	0	113.2	S223	T132-S223 PolarHBondContact O-N 2.97Å
133	T	92.9	Very high	92	Very high	83 Å²	83	57.6 Å²	57.6	51%	0.509	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	127.5	-174.4	44.6	0	0	0	0	108.8	S223	T133-S223 CarbonylContact C-O 3.46Å; T133-S223 VanDerWaalsContact CA-O 3.29Å; T133-S223 WeakPolarHBondContact CA-O 3.2Å
134	Q	94	Very high	92.1	Very high	30 Å²	30	60.7 Å²	60.7	14%	0.14	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.8	168.7	-174.3	-176.2	0.5	0	0	108.7	V136 P149 M222 S223 V224 H225	Q134-V136 HydrophobicContact CG-CG2 4.14Å; Q134-P149 PolarHBondContact NE2-O 2.85Å; Q134-M222 HydrophobicContact CB-CE 3.9Å; Q134-M222 HydrophobicContact CB-SD 3.95Å; Q134-S223 PolarHBondContact N-O 2.76Å; Q134-V224 CarbonylContact O-C 3.37Å; Q134-V224 WeakPolarHBondContact O-CA 3.44Å; Q134-H225 PolarHBondContact O-N 2.97Å
135	E	94.5	Very high	92.4	Very high	144 Å²	144	67.6 Å²	67.6	67%	0.673	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	137.7	171.5	-72.2	170.1	-176.2	0	0	109.5	H225	E135-H225 WeakPolarHBondContact CA-O 3.1Å; E135-H225 HydrophobicContact CG-CB 4.32Å
136	V	93.4	Very high	92.6	Very high	8 Å²	8	67.9 Å²	67.9	5%	0.048	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	115.6	-176.2	179.4	0	0	0	0	109.4	Q134 I138 I148 L150 V224 H225 V226 L227	Q134-V136 HydrophobicContact CG-CG2 4.14Å; V136-I138 HydrophobicContact CG1-CD1 4.11Å; V136-I138 HydrophobicContact CG1-CG1 3.84Å; V136-I148 HydrophobicContact CG1-CD1 3.95Å; V136-I148 HydrophobicContact CG1-CG2 3.87Å; V136-L150 HydrophobicContact CG2-CD2 4.46Å; V136-V224 HydrophobicContact CG2-CG1 3.86Å; V136-H225 PolarHBondContact N-O 2.86Å; V136-V226 CarbonylContact O-C 3.57Å; V136-V226 WeakPolarHBondContact O-CA 3.46Å; V136-L227 PolarHBondContact O-N 2.93Å
137	E	94.8	Very high	92.7	Very high	126 Å²	126	71.5 Å²	71.5	59%	0.589	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.8	176	-66.4	178.8	-160.8	0	0	110.5	L227 Q229	E137-L227 WeakPolarHBondContact CA-O 3.29Å; E137-L227 HydrophobicContact CG-CB 4.38Å; E137-Q229 HydrophobicContact CB-CG 4.07Å; E137-Q229 PolarHBondContact OE2-NE2 2.64Å
138	I	94.9	Very high	92.7	Very high	1 Å²	1	72.4 Å²	72.4	1%	0.005	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	121.8	-178.4	-45.3	-178.7	0	0	0	110	V136 A142 I148 F174 L196 V226 L227 I228 Q229	V136-I138 HydrophobicContact CG1-CD1 4.11Å; V136-I138 HydrophobicContact CG1-CG1 3.84Å; I138-A142 HydrophobicContact CG2-CB 3.69Å; I138-I148 HydrophobicContact CD1-CD1 3.34Å; I138-I148 HydrophobicContact CG1-CD1 3.57Å; I138-I148 HydrophobicContact CG2-CD1 4.43Å; I138-F174 HydrophobicContact CD1-CE1 3.61Å; I138-F174 HydrophobicContact CD1-CZ 4.11Å; I138-L196 HydrophobicContact CG2-CD1 3.89Å; I138-V226 HydrophobicContact CD1-CG1 3.41Å; I138-V226 VanDerWaalsContact CD1-CG1 3.41Å; I138-V226 HydrophobicContact CG1-CG1 3.83Å; I138-L227 PolarHBondContact N-O 2.85Å; I138-I228 CarbonylContact O-C 3.33Å; I138-I228 VanDerWaalsContact O-CA 3.32Å; I138-I228 WeakPolarHBondContact O-CA 3.34Å; I138-Q229 PolarHBondContact O-N 2.87Å
139	S	93.6	Very high	92.7	Very high	38 Å²	38	73.5 Å²	73.5	27%	0.266	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	134.7	168.7	-167.4	0	0	0	0	110.8	T141 A142 Q229 S231	S139-T141 PolarHBondContact O-N 3.47Å; S139-T141 PolarHBondContact OG-OG1 2.85Å; S139-A142 WeakPolarHBondContact O-CB 3.01Å; S139-A142 PolarHBondContact O-N 2.64Å; S139-Q229 WeakPolarHBondContact CA-O 3.14Å; S139-S231 PolarHBondContact OG-OG 2.87Å; S139-S231 VanDerWaalsContact OG-OG 3.08Å
140	E	93.9	Very high	92.8	Very high	10 Å²	10	72.3 Å²	72.3	5%	0.047	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.4	178.8	66.6	-145	117.5	0	0	113.3	A142 L196 R198 I228 Q229 D230 S231	E140-A142 PolarHBondContact O-N 2.81Å; E140-L196 HydrophobicContact CB-CB 4.17Å; E140-R198 WeakPolarHBondContact OE2-CB 3.33Å; E140-R198 PolarHBondContact OE2-N 3.08Å; E140-I228 HydrophobicContact CB-CG2 3.66Å; E140-Q229 PolarHBondContact N-O 2.79Å; E140-D230 VanDerWaalsContact OE1-CA 3.28Å; E140-D230 WeakPolarHBondContact OE1-CA 3.26Å; E140-S231 PolarHBondContact OE1-N 3.14Å
141	T	92.4	Very high	92.8	Very high	85 Å²	85	70.4 Å²	70.4	52%	0.521	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	9.2	170.6	52.3	0	0	0	0	114.1	S139 S231	S139-T141 PolarHBondContact O-N 3.47Å; S139-T141 PolarHBondContact OG-OG1 2.85Å; T141-S231 PolarHBondContact OG1-OG 2.95Å
142	A	93.7	Very high	92.8	Very high	12 Å²	12	71.1 Å²	71.1	10%	0.099	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-60	128.3	174.3	0	0	0	0	0	111.7	I138 S139 E140 M146	I138-A142 HydrophobicContact CG2-CB 3.69Å; S139-A142 WeakPolarHBondContact O-CB 3.01Å; S139-A142 PolarHBondContact O-N 2.64Å; E140-A142 PolarHBondContact O-N 2.81Å; A142-M146 HydrophobicContact CB-SD 3.71Å
143	P	93.9	Very high	92.8	Very high	90 Å²	90	65.8 Å²	65.8	58%	0.584	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-69.3	144	-176.7	28.3	-34.8	0	0	0	111.8	R145 M146	P143-R145 PolarHBondContact O-N 2.94Å; P143-M146 HydrophobicContact CG-CB 4.42Å; P143-M146 WeakPolarHBondContact O-CB 3.37Å; P143-M146 PolarHBondContact O-N 3.37Å
144	L	92.7	Very high	92.6	Very high	87 Å²	87	65.3 Å²	65.3	46%	0.455	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	135	170.9	-63	178.5	0	0	0	111	M146 V192 K194 E195	L144-M146 VanDerWaalsContact C-N 3.32Å; L144-V192 HydrophobicContact CD2-CG1 4.49Å; L144-K194 VanDerWaalsContact CD2-C 3.43Å; L144-E195 HydrophobicContact CD2-CG 4.3Å
145	R	91.5	Very high	92.4	Very high	211 Å²	211	65 Å²	65	80%	0.796	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	14.7	-172.3	-45.9	174	-177.4	173.9	0.5	115.5	P143 R147 V192	P143-R145 PolarHBondContact O-N 2.94Å; R145-R147 PolarHBondContact O-N 2.88Å; R145-V192 WeakPolarHBondContact CA-O 3.22Å; R145-V192 PolarHBondContact N-O 2.78Å
146	M	93.2	Very high	92	Very high	72 Å²	72	62 Å²	62	36%	0.355	31%	0.312	S	S	.	.			trans	-54.2	132.9	159.4	175.3	161.4	169.7	0	0	109.5	A142 P143 L144 I148 V191 V192	A142-M146 HydrophobicContact CB-SD 3.71Å; P143-M146 HydrophobicContact CG-CB 4.42Å; P143-M146 WeakPolarHBondContact O-CB 3.37Å; P143-M146 PolarHBondContact O-N 3.37Å; L144-M146 VanDerWaalsContact C-N 3.32Å; M146-I148 HydrophobicContact CE-CD1 4.16Å; M146-I148 HydrophobicContact CE-CG1 4.05Å; M146-I148 HydrophobicContact CG-CG1 4.43Å; M146-V191 WeakPolarHBondContact O-CA 3.04Å; M146-V192 HydrophobicContact CB-CB 4.5Å; M146-V192 HydrophobicContact CB-CG2 4.13Å; M146-V192 PolarHBondContact O-N 2.93Å
147	R	92.6	Very high	91.8	Very high	127 Å²	127	62 Å²	62	48%	0.479	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.2	-178.2	-72.6	163.7	174.4	-90.6	-9.8	109.3	R145 D177 E189 L190 V191	R145-R147 PolarHBondContact O-N 2.88Å; R147-D177 IonicContact CZ-OD2 2.78Å; R147-D177 IonicContact NH1-OD2 3.69Å; R147-D177 PolarHBondContact NH1-OD2 2.83Å; R147-D177 IonicContact NH2-OD2 3.51Å; R147-D177 PolarHBondContact NH2-OD2 3.42Å; R147-E189 VanDerWaalsContact CD-OE2 3.25Å; R147-E189 WeakPolarHBondContact CD-OE2 3.33Å; R147-E189 WeakPolarHBondContact CG-OE2 3.48Å; R147-E189 IonicContact CZ-OE2 2.72Å; R147-E189 IonicContact NE-OE2 2.69Å; R147-E189 IonicContact NH1-OE2 3.12Å; R147-E189 PolarHBondContact NH1-OE2 3.48Å; R147-L190 CarbonylContact C-O 3.49Å; R147-L190 WeakPolarHBondContact CA-O 3.33Å; R147-V191 HydrophobicContact CG-CG2 4.1Å
148	I	92.7	Very high	91.2	Very high	21 Å²	21	56.3 Å²	56.3	11%	0.108	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122.6	178.7	-57.1	170.8	0	0	0	108.4	V136 I138 M146 L150 E189 L190	V136-I148 HydrophobicContact CG1-CD1 3.95Å; V136-I148 HydrophobicContact CG1-CG2 3.87Å; I138-I148 HydrophobicContact CD1-CD1 3.34Å; I138-I148 HydrophobicContact CG1-CD1 3.57Å; I138-I148 HydrophobicContact CG2-CD1 4.43Å; M146-I148 HydrophobicContact CE-CD1 4.16Å; M146-I148 HydrophobicContact CE-CG1 4.05Å; M146-I148 HydrophobicContact CG-CG1 4.43Å; I148-L150 PolarHBondContact O-N 2.77Å; I148-E189 CarbonylContact O-C 3.57Å; I148-E189 VanDerWaalsContact O-CA 3.31Å; I148-E189 WeakPolarHBondContact O-CA 3.45Å; I148-L190 HydrophobicContact CB-CB 4.37Å; I148-L190 PolarHBondContact N-O 2.71Å; I148-L190 PolarHBondContact O-N 2.61Å
149	P	91.8	Very high	90.6	Very high	86 Å²	86	58 Å²	58	56%	0.558	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	129.4	179.4	28.7	-34	0	0	0	110.8	Q134	Q134-P149 PolarHBondContact NE2-O 2.85Å
150	L	92.6	Very high	90.1	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-94	155.2	172.7	-61.7	178.8	0	0	0	110.7	V136 I148 R152 L176 Q187 A188 L190 L208 V224	V136-L150 HydrophobicContact CG2-CD2 4.46Å; I148-L150 PolarHBondContact O-N 2.77Å; L150-R152 PolarHBondContact O-N 2.95Å; L150-L176 HydrophobicContact CD1-CD1 3.94Å; L150-Q187 PolarHBondContact O-NE2 2.97Å; L150-A188 HydrophobicContact CB-CB 4.11Å; L150-A188 PolarHBondContact N-O 3.2Å; L150-L190 HydrophobicContact CD1-CB 4.08Å; L150-L190 HydrophobicContact CD1-CD1 4.43Å; L150-L190 HydrophobicContact CD2-CB 4.06Å; L150-L190 HydrophobicContact CG-CB 4.09Å; L150-L208 HydrophobicContact CB-CD2 4.1Å; L150-L208 HydrophobicContact CD1-CD1 3.96Å; L150-L208 HydrophobicContact CD1-CD2 3.95Å; L150-L208 HydrophobicContact CD1-CG 4.47Å; L150-V224 HydrophobicContact CD1-CG2 4.46Å; L150-V224 HydrophobicContact CD2-CG1 3.97Å; L150-V224 HydrophobicContact CD2-CG2 4.13Å
151	D	90.9	Very high	89.7	Confident	48 Å²	48	60.4 Å²	60.4	26%	0.257	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-57.6	129.9	175.5	-88.7	-8.2	0	0	0	110.2	F129 P130 N131 M222	F129-D151 WeakPolarHBondContact CD1-O 3.38Å; F129-D151 WeakPolarHBondContact CE1-O 3.4Å; P130-D151 HydrophobicContact CG-CB 4.42Å; N131-D151 PolarHBondContact ND2-OD2 3.14Å; D151-M222 HydrophobicContact CB-CE 3.92Å; D151-M222 HydrophobicContact CB-SD 3.92Å
152	R	89.5	Confident	89.4	Confident	99 Å²	99	56.7 Å²	56.7	37%	0.374	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-75.1	134.4	-179	163.6	172.3	177	-171	6.1	110.5	P130 L150 S185	P130-R152 WeakPolarHBondContact CD-O 3.26Å; L150-R152 PolarHBondContact O-N 2.95Å; R152-S185 PolarHBondContact NH1-OG 2.95Å; R152-S185 PolarHBondContact NH2-OG 2.86Å
153	A	90.1	Very high	89.1	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-70.3	138.5	164.3	0	0	0	0	0	111	P127 S128 F129 L163 Y166 A210	P127-A153 HydrophobicContact CB-CB 4.45Å; S128-A153 CarbonylContact O-C 3.54Å; S128-A153 VanDerWaalsContact O-CA 3.3Å; S128-A153 WeakPolarHBondContact O-CA 3.07Å; F129-A153 HydrophobicContact CD1-CB 4.05Å; F129-A153 HydrophobicContact CE1-CB 3.79Å; F129-A153 HydrophobicContact CE2-CB 4.33Å; F129-A153 HydrophobicContact CG-CB 4.43Å; F129-A153 HydrophobicContact CZ-CB 3.95Å; A153-L163 HydrophobicContact CB-CD1 4.19Å; A153-L163 HydrophobicContact CB-CD2 4.43Å; A153-L163 WeakPolarHBondContact O-CD2 3.38Å; A153-Y166 HydrophobicContact CB-CE1 3.8Å; A153-Y166 PolarHBondContact N-OH 2.85Å; A153-A210 HydrophobicContact CB-CB 3.48Å; A153-A210 VanDerWaalsContact CB-CB 3.48Å
154	V	88.1	Confident	88.8	Confident	72 Å²	72	54.9 Å²	54.9	44%	0.436	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-104.5	131.6	170.6	-178.7	0	0	0	0	108.3	S128 L156	S128-V154 PolarHBondContact N-O 3Å; S128-V154 PolarHBondContact O-N 2.79Å; S128-V154 PolarHBondContact OG-O 2.64Å; V154-L156 HydrophobicContact CG1-CD2 4.18Å
155	D	89.3	Confident	88.6	Confident	23 Å²	23	53.5 Å²	53.5	12%	0.123	27%	0.274	C	S	.	.			trans	-125.8	152.6	167.6	-146.7	-19.1	0	0	0	107.6	S126 P127 L163	S126-D155 VanDerWaalsContact C-OD1 3.29Å; S126-D155 PolarHBondContact N-OD1 2.87Å; P127-D155 WeakPolarHBondContact CD-OD2 3.5Å; P127-D155 VanDerWaalsContact CG-OD2 3.24Å; P127-D155 WeakPolarHBondContact CG-OD2 3.4Å; P127-D155 VanDerWaalsContact N-OD2 3.17Å; D155-L163 HydrophobicContact CB-CB 4.15Å; D155-L163 PolarHBondContact OD2-N 3.17Å
156	L	87	Confident	88.6	Confident	81 Å²	81	43.9 Å²	43.9	42%	0.424	24%	0.238	S	C	.	.			trans	-104.1	-31.2	-176.8	-57.1	-174.4	0	0	0	112	R86 E87 H125 V154	R86-L156 PolarHBondContact NH2-O 2.96Å; R86-L156 VanDerWaalsContact NH2-O 3.11Å; E87-L156 HydrophobicContact CB-CB 4.45Å; E87-L156 HydrophobicContact CG-CB 3.59Å; H125-L156 HydrophobicContact CB-CB 4.41Å; V154-L156 HydrophobicContact CG1-CD2 4.18Å
157	D	87.9	Confident	88.6	Confident	8 Å²	8	42.6 Å²	42.6	4%	0.043	24%	0.236	C	C	.	.	S	Bend	trans	-60	153.3	171.9	-54.7	1.3	0	0	0	109.9	N123 D124 H125 N161 G162	N123-D157 VanDerWaalsContact CA-OD2 3.29Å; N123-D157 WeakPolarHBondContact CA-OD2 3.4Å; N123-D157 PolarHBondContact OD1-OD2 3.29Å; D124-D157 PolarHBondContact N-OD2 2.83Å; H125-D157 WeakPolarHBondContact CB-OD1 3.36Å; H125-D157 IonicContact CG-OD1 3.64Å; H125-D157 PolarHBondContact N-OD1 3.08Å; H125-D157 PolarHBondContact N-OD2 2.85Å; H125-D157 VanDerWaalsContact N-OD2 3.1Å; H125-D157 IonicContact ND1-OD1 2.62Å; H125-D157 PolarHBondContact ND1-OD1 2.82Å; D157-N161 HydrophobicContact CB-CB 3.83Å; D157-G162 WeakPolarHBondContact O-CA 3.32Å; D157-G162 PolarHBondContact O-N 3.37Å
158	A	83.5	Confident	88.7	Confident	8 Å²	8	37.9 Å²	37.9	7%	0.066	22%	0.22	C	C	.	.			trans	-117.1	172.3	-171	0	0	0	0	0	113.5	D121 P160 N161 G162	D121-A158 WeakPolarHBondContact OD1-CA 3.47Å; D121-A158 WeakPolarHBondContact OD1-CB 3.44Å; D121-A158 PolarHBondContact OD1-N 2.84Å; A158-P160 WeakPolarHBondContact O-CD 3.32Å; A158-P160 VanDerWaalsContact O-N 3.16Å; A158-N161 PolarHBondContact O-N 2.95Å; A158-N161 VanDerWaalsContact O-N 3.08Å; A158-G162 PolarHBondContact O-N 2.76Å
159	G	81.8	Confident	88.8	Confident	36 Å²	36	38.6 Å²	38.6	37%	0.371	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-120.1	179.6	0	0	0	0	0	112.6	Q164	G159-Q164 PolarHBondContact O-NE2 2.91Å
160	P	83.3	Confident	88.7	Confident	77 Å²	77	41.9 Å²	41.9	50%	0.5	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-19.7	-178.9	34.3	-35.8	0	0	0	114.6	A158 Q164 K213	A158-P160 WeakPolarHBondContact O-CD 3.32Å; A158-P160 VanDerWaalsContact O-N 3.16Å; P160-Q164 WeakPolarHBondContact O-CG 3.37Å; P160-K213 CarbonylContact O-C 3.6Å; P160-K213 WeakPolarHBondContact O-CA 3.35Å; P160-K213 WeakPolarHBondContact O-CB 3.28Å; P160-K213 PolarHBondContact O-N 3.27Å
161	N	85.5	Confident	88.7	Confident	22 Å²	22	43.8 Å²	43.8	12%	0.118	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-27.7	-178.1	-63.8	-18.7	0	0	0	111.6	D121 N123 D157 A158 D212 G214	D121-N161 PolarHBondContact O-ND2 3.36Å; D121-N161 VanDerWaalsContact OD2-CB 3.24Å; D121-N161 WeakPolarHBondContact OD2-CB 3.42Å; D121-N161 PolarHBondContact OD2-ND2 3.29Å; N123-N161 HydrophobicContact CB-CB 4Å; N123-N161 PolarHBondContact N-ND2 2.98Å; N123-N161 WeakPolarHBondContact OD1-CB 3.33Å; N123-N161 PolarHBondContact OD1-O 2.91Å; N123-N161 VanDerWaalsContact OD1-O 3.06Å; D157-N161 HydrophobicContact CB-CB 3.83Å; A158-N161 PolarHBondContact O-N 2.95Å; A158-N161 VanDerWaalsContact O-N 3.08Å; N161-D212 WeakPolarHBondContact O-CB 3.09Å; N161-G214 WeakPolarHBondContact OD1-CA 3.36Å
162	G	85	Confident	88.8	Confident	6 Å²	6	48.4 Å²	48.4	6%	0.062	28%	0.275	C	S	.	.	S	Bend	trans	-67.4	178.9	168.3	0	0	0	0	0	113.8	D157 A158 Q164	D157-G162 WeakPolarHBondContact O-CA 3.32Å; D157-G162 PolarHBondContact O-N 3.37Å; A158-G162 PolarHBondContact O-N 2.76Å; G162-Q164 WeakPolarHBondContact O-CG 3.47Å; G162-Q164 PolarHBondContact O-N 3.27Å; G162-Q164 VanDerWaalsContact O-N 3.12Å
163	L	88.6	Confident	88.9	Confident	22 Å²	22	45 Å²	45	12%	0.115	26%	0.264	C	S	.	.			trans	-49.8	115	178.8	176	68.4	0	0	0	113.4	P127 A153 D155 Y166 K186 A210	P127-L163 HydrophobicContact CB-CD1 4.45Å; A153-L163 HydrophobicContact CB-CD1 4.19Å; A153-L163 HydrophobicContact CB-CD2 4.43Å; A153-L163 WeakPolarHBondContact O-CD2 3.38Å; D155-L163 HydrophobicContact CB-CB 4.15Å; D155-L163 PolarHBondContact OD2-N 3.17Å; L163-Y166 HydrophobicContact CD1-CE1 4.35Å; L163-Y166 HydrophobicContact CD1-CE2 4.47Å; L163-Y166 HydrophobicContact CD2-CE2 4.08Å; L163-Y166 WeakPolarHBondContact CD2-OH 3.44Å; L163-K186 HydrophobicContact CD2-CB 4.18Å; L163-A210 HydrophobicContact CD1-CB 3.8Å
164	Q	86.8	Confident	89.2	Confident	43 Å²	43	45.1 Å²	45.1	20%	0.201	26%	0.264	C	S	.	.			trans	-113.3	-28.4	-175.3	-81.9	-65.6	-41.9	0	0	115.2	G159 P160 G162 K186 Y211 K213	G159-Q164 PolarHBondContact O-NE2 2.91Å; P160-Q164 WeakPolarHBondContact O-CG 3.37Å; G162-Q164 WeakPolarHBondContact O-CG 3.47Å; G162-Q164 PolarHBondContact O-N 3.27Å; G162-Q164 VanDerWaalsContact O-N 3.12Å; Q164-K186 WeakPolarHBondContact O-CD 3.39Å; Q164-K186 WeakPolarHBondContact O-CE 3.44Å; Q164-Y211 PolarHBondContact N-O 3.31Å; Q164-K213 HydrophobicContact CB-CB 4.41Å; Q164-K213 HydrophobicContact CB-CD 3.87Å; Q164-K213 HydrophobicContact CB-CG 3.7Å; Q164-K213 HydrophobicContact CG-CB 4.01Å; Q164-K213 HydrophobicContact CG-CD 3.79Å; Q164-K213 HydrophobicContact CG-CG 3.77Å
165	T	88.7	Confident	89.5	Confident	57 Å²	57	43.4 Å²	43.4	35%	0.35	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	166.7	173.3	-165.6	0	0	0	0	111.9	Y211	T165-Y211 HydrophobicContact CG2-CD2 4.29Å; T165-Y211 PolarHBondContact N-O 3.4Å; T165-Y211 VanDerWaalsContact N-O 3.11Å; T165-Y211 PolarHBondContact O-N 3.09Å
166	Y	92.6	Very high	89.7	Confident	9 Å²	9	44.4 Å²	44.4	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	163.4	163.3	-59.6	-91.7	0	0	0	110.4	F129 A153 L163 V178 K186 A188 L208 V209 A210	F129-Y166 HydrophobicContact CE1-CD1 4.45Å; F129-Y166 AromaticContact CE1-CE1 3.92Å; F129-Y166 HydrophobicContact CE1-CE1 3.92Å; F129-Y166 HydrophobicContact CZ-CD1 4.12Å; F129-Y166 AromaticContact CZ-CE1 3.95Å; F129-Y166 HydrophobicContact CZ-CE1 3.95Å; A153-Y166 HydrophobicContact CB-CE1 3.8Å; A153-Y166 PolarHBondContact N-OH 2.85Å; L163-Y166 HydrophobicContact CD1-CE1 4.35Å; L163-Y166 HydrophobicContact CD1-CE2 4.47Å; L163-Y166 HydrophobicContact CD2-CE2 4.08Å; L163-Y166 WeakPolarHBondContact CD2-OH 3.44Å; Y166-V178 HydrophobicContact CD2-CG1 4.02Å; Y166-V178 HydrophobicContact CD2-CG2 4.22Å; Y166-K186 HydrophobicContact CE2-CB 4.09Å; Y166-K186 WeakPolarHBondContact CE2-O 3.46Å; Y166-K186 PolarHBondContact OH-O 3.09Å; Y166-A188 HydrophobicContact CD1-CB 4.29Å; Y166-A188 HydrophobicContact CD2-CB 3.9Å; Y166-A188 HydrophobicContact CE1-CB 4.34Å; Y166-A188 HydrophobicContact CE2-CB 3.96Å; Y166-A188 HydrophobicContact CG-CB 4.06Å; Y166-L208 HydrophobicContact CD1-CD1 4.34Å; Y166-L208 HydrophobicContact CD1-CD2 4.17Å; Y166-L208 HydrophobicContact CD1-CG 4.23Å; Y166-L208 HydrophobicContact CE1-CD2 4.46Å; Y166-V209 CarbonylContact C-O 3.54Å; Y166-V209 VanDerWaalsContact CA-O 3.26Å; Y166-V209 WeakPolarHBondContact CA-O 3.3Å; Y166-A210 HydrophobicContact CD1-CB 3.79Å; Y166-A210 HydrophobicContact CE1-CB 3.87Å
167	S	92.4	Very high	89.9	Confident	45 Å²	45	43.1 Å²	43.1	32%	0.315	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	156.7	162.2	87.4	0	0	0	0	109.9	V209	S167-V209 PolarHBondContact N-O 2.78Å; S167-V209 PolarHBondContact O-N 2.87Å
168	L	94.8	Very high	90.1	Very high	28 Å²	28	44.9 Å²	44.9	15%	0.147	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	145.7	178.7	-173.9	71.3	0	0	0	109.7	F174 L176 L190 L206 L208	L168-F174 HydrophobicContact CD2-CB 4.37Å; L168-L176 HydrophobicContact CB-CB 3.91Å; L168-L176 HydrophobicContact CB-CD2 4.17Å; L168-L176 HydrophobicContact CB-CG 4.46Å; L168-L176 HydrophobicContact CD2-CB 4.32Å; L168-L190 HydrophobicContact CD1-CD1 4.24Å; L168-L190 HydrophobicContact CD2-CD1 3.58Å; L168-L206 HydrophobicContact CD1-CB 4.06Å; L168-L206 HydrophobicContact CD1-CD1 4.36Å; L168-L206 HydrophobicContact CD2-CD1 4.46Å; L168-L208 HydrophobicContact CD1-CD1 4.39Å
169	S	93.9	Very high	90.2	Very high	36 Å²	36	46.8 Å²	46.8	25%	0.252	28%	0.278	S	S	.	.			trans	-52.7	137.1	171.8	53.2	0	0	0	0	112.7	N171 L206 I207	S169-N171 PolarHBondContact O-N 2.91Å; S169-N171 PolarHBondContact O-ND2 2.97Å; S169-L206 WeakPolarHBondContact OG-CA 3.39Å; S169-I207 PolarHBondContact N-O 2.9Å; S169-I207 PolarHBondContact OG-N 2.91Å
170	V	90.4	Very high	90.2	Very high	156 Å²	156	50.3 Å²	50.3	95%	0.945	29%	0.289	S	S	*	.			trans	-58.5	119.2	-179.9	-177.6	0	0	0	0	110.5
171	N	92.2	Very high	89.6	Confident	44 Å²	44	48.8 Å²	48.8	24%	0.235	28%	0.282	C	S	.	.			trans	-148.6	179.1	179.6	78.1	88.9	0	0	0	109.6	S169 H173 F174 L206	S169-N171 PolarHBondContact O-N 2.91Å; S169-N171 PolarHBondContact O-ND2 2.97Å; N171-H173 PolarHBondContact OD1-N 2.92Å; N171-F174 PolarHBondContact ND2-O 3.44Å; N171-F174 PolarHBondContact OD1-N 3.26Å; N171-F174 PolarHBondContact OD1-O 3.34Å; N171-L206 HydrophobicContact CB-CD2 3.81Å
172	Q	92.5	Very high	88.3	Confident	144 Å²	144	54.5 Å²	54.5	67%	0.673	32%	0.324	S	S	*	.	S	Bend	trans	-109.7	-10.4	-174.7	-62.1	-174.7	15.6	0	0	115.2
173	H	93.4	Very high	87.1	Confident	27 Å²	27	57.5 Å²	57.5	13%	0.125	36%	0.355	C	S	.	.	S	Bend	trans	-117.7	-21.2	-166.9	-58.8	80.3	0	0	0	113.8	N171 I193 K194 E195 L196 F204	N171-H173 PolarHBondContact OD1-N 2.92Å; H173-I193 VanDerWaalsContact C-CG1 3.42Å; H173-I193 VanDerWaalsContact O-CG1 3.26Å; H173-I193 WeakPolarHBondContact O-CG1 3.12Å; H173-I193 PolarHBondContact O-N 2.78Å; H173-K194 PolarHBondContact CD2-NZ 2.63Å; H173-K194 PolarHBondContact NE2-NZ 2.66Å; H173-K194 PolarHBondContact O-N 3.35Å; H173-E195 PolarHBondContact CD2-O 3.22Å; H173-L196 HydrophobicContact CB-CD2 3.9Å; H173-F204 HydrophobicContact CB-CE1 4.42Å; H173-F204 HydrophobicContact CB-CZ 4.49Å; H173-F204 AromaticContact CE1-CE1 3.82Å; H173-F204 AromaticContact CG-CE1 3.98Å; H173-F204 AromaticContact ND1-CE1 3.5Å; H173-F204 AromaticContact ND1-CZ 3.93Å
174	F	95.4	Very high	86	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.018	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126	-178.6	-51.3	-81	0	0	0	111.8	I138 L168 N171 L190 V191 V192 L196 F204 L206 V226	I138-F174 HydrophobicContact CD1-CE1 3.61Å; I138-F174 HydrophobicContact CD1-CZ 4.11Å; L168-F174 HydrophobicContact CD2-CB 4.37Å; N171-F174 PolarHBondContact ND2-O 3.44Å; N171-F174 PolarHBondContact OD1-N 3.26Å; N171-F174 PolarHBondContact OD1-O 3.34Å; F174-L190 HydrophobicContact CB-CD1 3.67Å; F174-L190 HydrophobicContact CB-CG 4.03Å; F174-L190 HydrophobicContact CD1-CD1 4.46Å; F174-L190 HydrophobicContact CD1-CD2 3.85Å; F174-L190 HydrophobicContact CD1-CG 3.94Å; F174-L190 HydrophobicContact CE1-CD2 4.33Å; F174-L190 HydrophobicContact CG-CD1 4.22Å; F174-L190 HydrophobicContact CG-CD2 4.22Å; F174-L190 HydrophobicContact CG-CG 4.2Å; F174-V191 CarbonylContact C-O 3.51Å; F174-V191 WeakPolarHBondContact CA-O 3.17Å; F174-V192 HydrophobicContact CD1-CG2 4.31Å; F174-V192 HydrophobicContact CE1-CG2 4.13Å; F174-L196 HydrophobicContact CE1-CD1 4.18Å; F174-L196 HydrophobicContact CE1-CD2 4.17Å; F174-L196 HydrophobicContact CE2-CD2 4.18Å; F174-L196 HydrophobicContact CZ-CD1 4.16Å; F174-L196 HydrophobicContact CZ-CD2 3.59Å; F174-F204 HydrophobicContact CE2-CB 4.13Å; F174-F204 HydrophobicContact CE2-CD1 4.17Å; F174-F204 AromaticContact CE2-CD2 3.79Å; F174-F204 HydrophobicContact CE2-CD2 3.79Å; F174-F204 HydrophobicContact CE2-CE2 4.23Å; F174-F204 AromaticContact CE2-CG 3.78Å; F174-F204 HydrophobicContact CE2-CG 3.78Å; F174-F204 HydrophobicContact CZ-CD2 4.25Å; F174-L206 HydrophobicContact CB-CD1 4.24Å; F174-L206 HydrophobicContact CD2-CD1 3.82Å; F174-L206 HydrophobicContact CG-CD1 4.16Å; F174-V226 HydrophobicContact CE1-CG1 4.45Å; F174-V226 HydrophobicContact CE2-CG1 4.46Å; F174-V226 HydrophobicContact CZ-CG1 3.88Å
175	A	93.6	Very high	85.2	Confident	36 Å²	36	59.4 Å²	59.4	30%	0.298	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	169.5	161.6	0	0	0	0	0	110.5	V191 I193	A175-V191 PolarHBondContact N-O 3.25Å; A175-V191 PolarHBondContact O-N 3.19Å; A175-I193 HydrophobicContact CB-CD1 4.23Å; A175-I193 HydrophobicContact CB-CG2 3.51Å
176	L	94.5	Very high	84.9	Confident	43 Å²	43	58.5 Å²	58.5	23%	0.225	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.2	168.4	-169.9	70.6	0	0	0	108.6	L150 L168 V178 A188 L208	L150-L176 HydrophobicContact CD1-CD1 3.94Å; L168-L176 HydrophobicContact CB-CB 3.91Å; L168-L176 HydrophobicContact CB-CD2 4.17Å; L168-L176 HydrophobicContact CB-CG 4.46Å; L168-L176 HydrophobicContact CD2-CB 4.32Å; L176-V178 HydrophobicContact CD2-CG2 4.01Å; L176-V178 HydrophobicContact CG-CG2 4.07Å; L176-A188 HydrophobicContact CD1-CB 4.24Å; L176-L208 HydrophobicContact CD1-CD1 3.71Å; L176-L208 HydrophobicContact CD2-CD1 3.89Å; L176-L208 HydrophobicContact CG-CD1 4.49Å
177	D	92.1	Very high	84.6	Confident	55 Å²	55	60.3 Å²	60.3	29%	0.294	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	144.9	162.7	-164.6	8.7	0	0	0	108.9	R147 E189 V191	R147-D177 IonicContact CZ-OD2 2.78Å; R147-D177 IonicContact NH1-OD2 3.69Å; R147-D177 PolarHBondContact NH1-OD2 2.83Å; R147-D177 IonicContact NH2-OD2 3.51Å; R147-D177 PolarHBondContact NH2-OD2 3.42Å; D177-E189 PolarHBondContact N-O 2.79Å; D177-E189 PolarHBondContact O-N 3.12Å; D177-V191 HydrophobicContact CB-CG2 3.72Å
178	V	91	Very high	84.5	Confident	44 Å²	44	58.2 Å²	58.2	27%	0.267	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	106.7	-176.6	-179.2	0	0	0	0	108.3	Y166 L176 K186 Q187	Y166-V178 HydrophobicContact CD2-CG1 4.02Å; Y166-V178 HydrophobicContact CD2-CG2 4.22Å; L176-V178 HydrophobicContact CD2-CG2 4.01Å; L176-V178 HydrophobicContact CG-CG2 4.07Å; V178-K186 HydrophobicContact CG1-CB 4.37Å; V178-Q187 WeakPolarHBondContact CA-O 3.45Å
179	T	85.3	Confident	84.5	Confident	48 Å²	48	58.8 Å²	58.8	29%	0.294	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	138.2	-175.5	57.8	0	0	0	0	110.9	A181 Q187	T179-A181 PolarHBondContact O-N 2.82Å; T179-Q187 PolarHBondContact N-O 3.08Å; T179-Q187 PolarHBondContact O-N 2.94Å
180	D	82.2	Confident	84.5	Confident	111 Å²	111	57.1 Å²	57.1	59%	0.594	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	104.8	171.3	-72.2	-41.9	0	0	0	108.8	K186	D180-K186 WeakPolarHBondContact OD1-CG 3.29Å; D180-K186 IonicContact OD1-NZ 3.01Å; D180-K186 PolarHBondContact OD1-NZ 2.65Å; D180-K186 IonicContact OD2-NZ 3.91Å
181	A	69.6	Low	84.7	Confident	44 Å²	44	50.3 Å²	50.3	36%	0.364	32%	0.32	S	S	.	.			trans	-68.4	161	176.6	0	0	0	0	0	111.4	T179 G183 G184 S185	T179-A181 PolarHBondContact O-N 2.82Å; A181-G183 PolarHBondContact O-N 3.4Å; A181-G184 PolarHBondContact O-N 3.33Å; A181-G184 VanDerWaalsContact O-N 3.12Å; A181-S185 VanDerWaalsContact CB-O 3.26Å; A181-S185 WeakPolarHBondContact CB-O 3.39Å; A181-S185 PolarHBondContact N-O 3.31Å
182	S	58.7	Low	84.8	Confident	142 Å²	142	48.3 Å²	48.3	99%	0.993	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	73.4	-176.3	31.6	0	0	0	0	113.3
183	G	59.9	Low	84.9	Confident	69 Å²	69	45.8 Å²	45.8	71%	0.711	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	155.2	19.1	-175.2	0	0	0	0	0	114	A181 S185	A181-G183 PolarHBondContact O-N 3.4Å; G183-S185 PolarHBondContact O-N 3.19Å; G183-S185 VanDerWaalsContact O-N 3.15Å
184	G	65.8	Low	84.9	Confident	66 Å²	66	48.6 Å²	48.6	68%	0.68	31%	0.311	S	S	*	.	S	Bend	trans	73.9	-1.1	179.6	0	0	0	0	0	115.1	A181	A181-G184 PolarHBondContact O-N 3.33Å; A181-G184 VanDerWaalsContact O-N 3.12Å
185	S	71.2	Confident	84.8	Confident	39 Å²	39	55 Å²	55	27%	0.273	34%	0.341	S	S	.	.			trans	-78.9	127.1	-180	-74	0	0	0	0	111.6	R152 A181 G183	R152-S185 PolarHBondContact NH1-OG 2.95Å; R152-S185 PolarHBondContact NH2-OG 2.86Å; A181-S185 VanDerWaalsContact CB-O 3.26Å; A181-S185 WeakPolarHBondContact CB-O 3.39Å; A181-S185 PolarHBondContact N-O 3.31Å; G183-S185 PolarHBondContact O-N 3.19Å; G183-S185 VanDerWaalsContact O-N 3.15Å
186	K	81.4	Confident	84.9	Confident	38 Å²	38	53.9 Å²	53.9	17%	0.165	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	121.2	179.8	-71.2	176.6	-177.6	-61.1	0	111.9	L163 Q164 Y166 V178 D180	L163-K186 HydrophobicContact CD2-CB 4.18Å; Q164-K186 WeakPolarHBondContact O-CD 3.39Å; Q164-K186 WeakPolarHBondContact O-CE 3.44Å; Y166-K186 HydrophobicContact CE2-CB 4.09Å; Y166-K186 WeakPolarHBondContact CE2-O 3.46Å; Y166-K186 PolarHBondContact OH-O 3.09Å; V178-K186 HydrophobicContact CG1-CB 4.37Å; D180-K186 WeakPolarHBondContact OD1-CG 3.29Å; D180-K186 IonicContact OD1-NZ 3.01Å; D180-K186 PolarHBondContact OD1-NZ 2.65Å; D180-K186 IonicContact OD2-NZ 3.91Å
187	Q	86.5	Confident	84.9	Confident	48 Å²	48	54.8 Å²	54.8	22%	0.224	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.8	175.3	-176.1	54.5	49.1	0	0	110.1	L150 V178 T179	L150-Q187 PolarHBondContact O-NE2 2.97Å; V178-Q187 WeakPolarHBondContact CA-O 3.45Å; T179-Q187 PolarHBondContact N-O 3.08Å; T179-Q187 PolarHBondContact O-N 2.94Å
188	A	90.8	Very high	85	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136.1	174.4	0	0	0	0	0	110.3	L150 Y166 L176 L208	L150-A188 HydrophobicContact CB-CB 4.11Å; L150-A188 PolarHBondContact N-O 3.2Å; Y166-A188 HydrophobicContact CD1-CB 4.29Å; Y166-A188 HydrophobicContact CD2-CB 3.9Å; Y166-A188 HydrophobicContact CE1-CB 4.34Å; Y166-A188 HydrophobicContact CE2-CB 3.96Å; Y166-A188 HydrophobicContact CG-CB 4.06Å; L176-A188 HydrophobicContact CD1-CB 4.24Å; A188-L208 HydrophobicContact CB-CD2 4.42Å
189	E	93.3	Very high	85.2	Confident	40 Å²	40	54.8 Å²	54.8	19%	0.187	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.8	172.4	-66.1	-177.3	176.1	0	0	110	R147 I148 D177	R147-E189 VanDerWaalsContact CD-OE2 3.25Å; R147-E189 WeakPolarHBondContact CD-OE2 3.33Å; R147-E189 WeakPolarHBondContact CG-OE2 3.48Å; R147-E189 IonicContact CZ-OE2 2.72Å; R147-E189 IonicContact NE-OE2 2.69Å; R147-E189 IonicContact NH1-OE2 3.12Å; R147-E189 PolarHBondContact NH1-OE2 3.48Å; I148-E189 CarbonylContact O-C 3.57Å; I148-E189 VanDerWaalsContact O-CA 3.31Å; I148-E189 WeakPolarHBondContact O-CA 3.45Å; D177-E189 PolarHBondContact N-O 2.79Å; D177-E189 PolarHBondContact O-N 3.12Å
190	L	94.6	Very high	85.6	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.4	168.6	-165.3	70.3	0	0	0	108.4	R147 I148 L150 L168 F174 L206 V226	R147-L190 CarbonylContact C-O 3.49Å; R147-L190 WeakPolarHBondContact CA-O 3.33Å; I148-L190 HydrophobicContact CB-CB 4.37Å; I148-L190 PolarHBondContact N-O 2.71Å; I148-L190 PolarHBondContact O-N 2.61Å; L150-L190 HydrophobicContact CD1-CB 4.08Å; L150-L190 HydrophobicContact CD1-CD1 4.43Å; L150-L190 HydrophobicContact CD2-CB 4.06Å; L150-L190 HydrophobicContact CG-CB 4.09Å; L168-L190 HydrophobicContact CD1-CD1 4.24Å; L168-L190 HydrophobicContact CD2-CD1 3.58Å; F174-L190 HydrophobicContact CB-CD1 3.67Å; F174-L190 HydrophobicContact CB-CG 4.03Å; F174-L190 HydrophobicContact CD1-CD1 4.46Å; F174-L190 HydrophobicContact CD1-CD2 3.85Å; F174-L190 HydrophobicContact CD1-CG 3.94Å; F174-L190 HydrophobicContact CE1-CD2 4.33Å; F174-L190 HydrophobicContact CG-CD1 4.22Å; F174-L190 HydrophobicContact CG-CD2 4.22Å; F174-L190 HydrophobicContact CG-CG 4.2Å; L190-L206 HydrophobicContact CD1-CD1 3.97Å; L190-L206 HydrophobicContact CD2-CD1 4.39Å; L190-V226 HydrophobicContact CD2-CG2 4.06Å
191	V	94.2	Very high	86.1	Confident	14 Å²	14	56 Å²	56	9%	0.085	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.2	-175.3	-174	0	0	0	0	110.7	M146 R147 F174 A175 D177 I193	M146-V191 WeakPolarHBondContact O-CA 3.04Å; R147-V191 HydrophobicContact CG-CG2 4.1Å; F174-V191 CarbonylContact C-O 3.51Å; F174-V191 WeakPolarHBondContact CA-O 3.17Å; A175-V191 PolarHBondContact N-O 3.25Å; A175-V191 PolarHBondContact O-N 3.19Å; D177-V191 HydrophobicContact CB-CG2 3.72Å; V191-I193 PolarHBondContact O-N 2.72Å
192	V	95.2	Very high	87.3	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.006	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	118	175.2	-175.5	0	0	0	0	109.4	L144 R145 M146 F174 K194 L196	L144-V192 HydrophobicContact CD2-CG1 4.49Å; R145-V192 WeakPolarHBondContact CA-O 3.22Å; R145-V192 PolarHBondContact N-O 2.78Å; M146-V192 HydrophobicContact CB-CB 4.5Å; M146-V192 HydrophobicContact CB-CG2 4.13Å; M146-V192 PolarHBondContact O-N 2.93Å; F174-V192 HydrophobicContact CD1-CG2 4.31Å; F174-V192 HydrophobicContact CE1-CG2 4.13Å; V192-K194 VanDerWaalsContact CG1-O 3.3Å; V192-K194 WeakPolarHBondContact CG1-O 3.18Å; V192-L196 HydrophobicContact CG1-CD1 4.22Å; V192-L196 HydrophobicContact CG1-CG 4.33Å; V192-L196 HydrophobicContact CG2-CD1 4.41Å
193	I	94.4	Very high	89	Confident	91 Å²	91	53.1 Å²	53.1	47%	0.467	31%	0.305	S	S	.	.			trans	-112.7	-13.2	-178.3	55.4	164.2	0	0	0	114.3	H173 A175 V191	H173-I193 VanDerWaalsContact C-CG1 3.42Å; H173-I193 VanDerWaalsContact O-CG1 3.26Å; H173-I193 WeakPolarHBondContact O-CG1 3.12Å; H173-I193 PolarHBondContact O-N 2.78Å; A175-I193 HydrophobicContact CB-CD1 4.23Å; A175-I193 HydrophobicContact CB-CG2 3.51Å; V191-I193 PolarHBondContact O-N 2.72Å
194	K	93.9	Very high	90.7	Very high	86 Å²	86	50.6 Å²	50.6	37%	0.374	27%	0.274	S	S	.	.	S	Bend	trans	-139	150.4	174.5	-173.4	-172.4	156.1	-67.1	0	108.5	L144 H173 V192	L144-K194 VanDerWaalsContact CD2-C 3.43Å; H173-K194 PolarHBondContact CD2-NZ 2.63Å; H173-K194 PolarHBondContact NE2-NZ 2.66Å; H173-K194 PolarHBondContact O-N 3.35Å; V192-K194 VanDerWaalsContact CG1-O 3.3Å; V192-K194 WeakPolarHBondContact CG1-O 3.18Å
195	E	92.9	Very high	92	Very high	138 Å²	138	53.5 Å²	53.5	65%	0.645	27%	0.274	S	S	*	.			trans	-54.4	140	172.3	-70.8	143.9	-174.8	0	0	111.2	L144 H173	L144-E195 HydrophobicContact CD2-CG 4.3Å; H173-E195 PolarHBondContact CD2-O 3.22Å
196	L	94.7	Very high	93.2	Very high	13 Å²	13	51.9 Å²	51.9	7%	0.068	26%	0.263	C	S	.	.			trans	-101.1	154.4	178.7	-59.4	169.8	0	0	0	108.5	I138 E140 H173 F174 V192 F204 I228	I138-L196 HydrophobicContact CG2-CD1 3.89Å; E140-L196 HydrophobicContact CB-CB 4.17Å; H173-L196 HydrophobicContact CB-CD2 3.9Å; F174-L196 HydrophobicContact CE1-CD1 4.18Å; F174-L196 HydrophobicContact CE1-CD2 4.17Å; F174-L196 HydrophobicContact CE2-CD2 4.18Å; F174-L196 HydrophobicContact CZ-CD1 4.16Å; F174-L196 HydrophobicContact CZ-CD2 3.59Å; V192-L196 HydrophobicContact CG1-CD1 4.22Å; V192-L196 HydrophobicContact CG1-CG 4.33Å; V192-L196 HydrophobicContact CG2-CD1 4.41Å; L196-F204 HydrophobicContact CD2-CE2 4.15Å; L196-F204 HydrophobicContact CD2-CZ 4.4Å; L196-I228 HydrophobicContact CD1-CD1 4.1Å; L196-I228 HydrophobicContact CD2-CD1 4.29Å
197	D	94.6	Very high	93.8	Very high	63 Å²	63	54.1 Å²	54.1	34%	0.337	28%	0.275	S	S	.	.			trans	-162.8	107.8	-166.6	170.2	-27.9	0	0	0	105.8	E199 V200 Q201	D197-E199 PolarHBondContact OD1-N 2.98Å; D197-V200 HydrophobicContact CB-CB 4.32Å; D197-V200 VanDerWaalsContact CG-CG2 3.5Å; D197-V200 VanDerWaalsContact OD1-CB 3.23Å; D197-V200 WeakPolarHBondContact OD1-CB 3.45Å; D197-V200 VanDerWaalsContact OD1-CG2 3.26Å; D197-V200 WeakPolarHBondContact OD1-CG2 3.46Å; D197-V200 PolarHBondContact OD1-N 2.8Å; D197-V200 VanDerWaalsContact OD2-CG2 3.25Å; D197-V200 WeakPolarHBondContact OD2-CG2 3.45Å; D197-Q201 PolarHBondContact O-N 2.97Å
198	R	95	Very high	94.2	Very high	35 Å²	35	51.8 Å²	51.8	13%	0.132	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-33	-171.9	-169.6	-158.3	63.6	67.9	-2.5	111.4	E140 V200 Q201 D202 I228 D230 P265	E140-R198 WeakPolarHBondContact OE2-CB 3.33Å; E140-R198 PolarHBondContact OE2-N 3.08Å; R198-V200 PolarHBondContact O-N 2.9Å; R198-Q201 CarbonylContact O-C 3.57Å; R198-Q201 PolarHBondContact O-N 2.73Å; R198-D202 HydrophobicContact CG-CB 3.96Å; R198-D202 PolarHBondContact O-N 3.05Å; R198-I228 HydrophobicContact CB-CB 4.4Å; R198-I228 HydrophobicContact CB-CG2 3.82Å; R198-I228 HydrophobicContact CG-CB 4.26Å; R198-I228 HydrophobicContact CG-CG2 4.16Å; R198-D230 IonicContact CZ-OD1 3.15Å; R198-D230 IonicContact NE-OD1 2.81Å; R198-D230 PolarHBondContact NE-OD1 2.91Å; R198-D230 IonicContact NH2-OD1 2.82Å; R198-D230 PolarHBondContact NH2-OD1 2.96Å; R198-P265 PolarHBondContact NH2-O 3.45Å
199	E	94.7	Very high	94.4	Very high	64 Å²	64	53 Å²	53	30%	0.299	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-31.2	177.9	-70.1	59.8	-125.7	0	0	111.3	D197 P265	D197-E199 PolarHBondContact OD1-N 2.98Å; E199-P265 HydrophobicContact CG-CB 3.79Å; E199-P265 HydrophobicContact CG-CG 4.06Å
200	V	93.9	Very high	94.3	Very high	108 Å²	108	51 Å²	51	66%	0.655	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-43.9	170.2	172.3	0	0	0	0	112.3	D197 R198	D197-V200 HydrophobicContact CB-CB 4.32Å; D197-V200 VanDerWaalsContact CG-CG2 3.5Å; D197-V200 VanDerWaalsContact OD1-CB 3.23Å; D197-V200 WeakPolarHBondContact OD1-CB 3.45Å; D197-V200 VanDerWaalsContact OD1-CG2 3.26Å; D197-V200 WeakPolarHBondContact OD1-CG2 3.46Å; D197-V200 PolarHBondContact OD1-N 2.8Å; D197-V200 VanDerWaalsContact OD2-CG2 3.25Å; D197-V200 WeakPolarHBondContact OD2-CG2 3.45Å; R198-V200 PolarHBondContact O-N 2.9Å
201	Q	93.8	Very high	94.2	Very high	75 Å²	75	55.1 Å²	55.1	35%	0.35	28%	0.278	S	S	.	.			trans	-153.8	105.3	178.7	-175.3	166.3	-4.7	0	0	113.5	D197 R198 S203 F204	D197-Q201 PolarHBondContact O-N 2.97Å; R198-Q201 CarbonylContact O-C 3.57Å; R198-Q201 PolarHBondContact O-N 2.73Å; Q201-S203 VanDerWaalsContact C-N 3.33Å; Q201-S203 VanDerWaalsContact CG-O 3.32Å; Q201-S203 WeakPolarHBondContact CG-O 3.38Å; Q201-S203 PolarHBondContact NE2-O 2.73Å; Q201-S203 PolarHBondContact O-N 3.39Å; Q201-F204 HydrophobicContact CB-CE2 4.46Å; Q201-F204 HydrophobicContact CB-CZ 4.07Å; Q201-F204 HydrophobicContact CG-CE1 4.07Å; Q201-F204 HydrophobicContact CG-CE2 4.03Å; Q201-F204 HydrophobicContact CG-CZ 3.78Å; Q201-F204 VanDerWaalsContact NE2-CD1 3.31Å
202	D	93.7	Very high	94	Very high	91 Å²	91	54.7 Å²	54.7	49%	0.487	28%	0.276	S	S	.	.	S	Bend	trans	-70.5	-17	-178	63.7	14.1	0	0	0	116.1	R198 I228	R198-D202 HydrophobicContact CG-CB 3.96Å; R198-D202 PolarHBondContact O-N 3.05Å; D202-I228 WeakPolarHBondContact O-CB 3.11Å; D202-I228 WeakPolarHBondContact O-CG1 3.19Å; D202-I228 PolarHBondContact O-N 2.87Å
203	S	95.1	Very high	93.5	Very high	36 Å²	36	60.2 Å²	60.2	25%	0.252	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	150.4	-169.6	56	0	0	0	0	113.8	Q201 V226	Q201-S203 VanDerWaalsContact C-N 3.33Å; Q201-S203 VanDerWaalsContact CG-O 3.32Å; Q201-S203 WeakPolarHBondContact CG-O 3.38Å; Q201-S203 PolarHBondContact NE2-O 2.73Å; Q201-S203 PolarHBondContact O-N 3.39Å; S203-V226 CarbonylContact C-O 3.43Å; S203-V226 VanDerWaalsContact CA-O 3.24Å; S203-V226 WeakPolarHBondContact CA-O 3.12Å
204	F	94.6	Very high	93	Very high	15 Å²	15	56 Å²	56	7%	0.066	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	116.8	176.7	-59.3	-101.1	0	0	0	111.5	H173 F174 L196 Q201 L206 V226 I228	H173-F204 HydrophobicContact CB-CE1 4.42Å; H173-F204 HydrophobicContact CB-CZ 4.49Å; H173-F204 AromaticContact CE1-CE1 3.82Å; H173-F204 AromaticContact CG-CE1 3.98Å; H173-F204 AromaticContact ND1-CE1 3.5Å; H173-F204 AromaticContact ND1-CZ 3.93Å; F174-F204 HydrophobicContact CE2-CB 4.13Å; F174-F204 HydrophobicContact CE2-CD1 4.17Å; F174-F204 AromaticContact CE2-CD2 3.79Å; F174-F204 HydrophobicContact CE2-CD2 3.79Å; F174-F204 HydrophobicContact CE2-CE2 4.23Å; F174-F204 AromaticContact CE2-CG 3.78Å; F174-F204 HydrophobicContact CE2-CG 3.78Å; F174-F204 HydrophobicContact CZ-CD2 4.25Å; L196-F204 HydrophobicContact CD2-CE2 4.15Å; L196-F204 HydrophobicContact CD2-CZ 4.4Å; Q201-F204 HydrophobicContact CB-CE2 4.46Å; Q201-F204 HydrophobicContact CB-CZ 4.07Å; Q201-F204 HydrophobicContact CG-CE1 4.07Å; Q201-F204 HydrophobicContact CG-CE2 4.03Å; Q201-F204 HydrophobicContact CG-CZ 3.78Å; Q201-F204 VanDerWaalsContact NE2-CD1 3.31Å; F204-L206 HydrophobicContact CB-CG 4.48Å; F204-V226 HydrophobicContact CB-CB 4.17Å; F204-V226 PolarHBondContact N-O 3.32Å; F204-V226 PolarHBondContact O-N 2.94Å; F204-I228 HydrophobicContact CD2-CD1 4.08Å; F204-I228 HydrophobicContact CD2-CG1 4.22Å; F204-I228 HydrophobicContact CE2-CD1 3.97Å; F204-I228 HydrophobicContact CE2-CG1 3.98Å
205	D	94.4	Very high	92.4	Very high	128 Å²	128	59 Å²	59	68%	0.684	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.8	167.1	-72.1	-42	0	0	0	110.4	H225	D205-H225 IonicContact OD1-CE1 2.86Å; D205-H225 IonicContact OD1-CG 3.66Å; D205-H225 IonicContact OD1-ND1 3.52Å; D205-H225 PolarHBondContact OD1-ND1 3.1Å
206	L	95.1	Very high	92.1	Very high	5 Å²	5	57 Å²	57	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	157	176.1	-55.9	175.3	0	0	0	110.5	L168 S169 N171 F174 L190 F204 S223 V224 V226	L168-L206 HydrophobicContact CD1-CB 4.06Å; L168-L206 HydrophobicContact CD1-CD1 4.36Å; L168-L206 HydrophobicContact CD2-CD1 4.46Å; S169-L206 WeakPolarHBondContact OG-CA 3.39Å; N171-L206 HydrophobicContact CB-CD2 3.81Å; F174-L206 HydrophobicContact CB-CD1 4.24Å; F174-L206 HydrophobicContact CD2-CD1 3.82Å; F174-L206 HydrophobicContact CG-CD1 4.16Å; L190-L206 HydrophobicContact CD1-CD1 3.97Å; L190-L206 HydrophobicContact CD2-CD1 4.39Å; F204-L206 HydrophobicContact CB-CG 4.48Å; L206-S223 CarbonylContact O-C 3.52Å; L206-S223 WeakPolarHBondContact O-CA 3.02Å; L206-V224 HydrophobicContact CB-CB 4.29Å; L206-V224 PolarHBondContact N-O 2.97Å; L206-V224 PolarHBondContact O-N 3.12Å; L206-V226 HydrophobicContact CD1-CG2 3.98Å
207	I	94.8	Very high	91.8	Very high	84 Å²	84	60.7 Å²	60.7	43%	0.431	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	118.4	173.9	-53.7	176.9	0	0	0	108.2	S169 V209	S169-I207 PolarHBondContact N-O 2.9Å; S169-I207 PolarHBondContact OG-N 2.91Å; I207-V209 HydrophobicContact CG2-CG2 3.94Å
208	L	94.9	Very high	91.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.2	169.6	-174.2	72.9	0	0	0	108.5	F129 L150 Y166 L168 L176 A188 S221 M222 V224	F129-L208 HydrophobicContact CE1-CD2 3.56Å; F129-L208 HydrophobicContact CE1-CG 4.33Å; F129-L208 HydrophobicContact CZ-CB 4.49Å; F129-L208 HydrophobicContact CZ-CD2 3.67Å; F129-L208 HydrophobicContact CZ-CG 3.93Å; L150-L208 HydrophobicContact CB-CD2 4.1Å; L150-L208 HydrophobicContact CD1-CD1 3.96Å; L150-L208 HydrophobicContact CD1-CD2 3.95Å; L150-L208 HydrophobicContact CD1-CG 4.47Å; Y166-L208 HydrophobicContact CD1-CD1 4.34Å; Y166-L208 HydrophobicContact CD1-CD2 4.17Å; Y166-L208 HydrophobicContact CD1-CG 4.23Å; Y166-L208 HydrophobicContact CE1-CD2 4.46Å; L168-L208 HydrophobicContact CD1-CD1 4.39Å; L176-L208 HydrophobicContact CD1-CD1 3.71Å; L176-L208 HydrophobicContact CD2-CD1 3.89Å; L176-L208 HydrophobicContact CG-CD1 4.49Å; A188-L208 HydrophobicContact CB-CD2 4.42Å; L208-S221 CarbonylContact O-C 3.59Å; L208-S221 VanDerWaalsContact O-CA 3.3Å; L208-S221 WeakPolarHBondContact O-CA 3.44Å; L208-M222 HydrophobicContact CD2-CE 3.96Å; L208-M222 PolarHBondContact N-O 3.16Å; L208-M222 PolarHBondContact O-N 2.85Å; L208-V224 HydrophobicContact CB-CG2 4.14Å
209	V	93.7	Very high	91.5	Very high	24 Å²	24	61.8 Å²	61.8	15%	0.145	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.4	177.9	-170.6	0	0	0	0	109.3	Y166 S167 I207 Y211 G220	Y166-V209 CarbonylContact C-O 3.54Å; Y166-V209 VanDerWaalsContact CA-O 3.26Å; Y166-V209 WeakPolarHBondContact CA-O 3.3Å; S167-V209 PolarHBondContact N-O 2.78Å; S167-V209 PolarHBondContact O-N 2.87Å; I207-V209 HydrophobicContact CG2-CG2 3.94Å; V209-Y211 HydrophobicContact CB-CE2 3.79Å; V209-Y211 HydrophobicContact CG1-CD2 4.21Å; V209-Y211 HydrophobicContact CG1-CE1 4.04Å; V209-Y211 HydrophobicContact CG1-CE2 3.55Å; V209-Y211 VanDerWaalsContact CG1-CZ 3.44Å; V209-G220 CarbonylContact C-O 3.57Å; V209-G220 WeakPolarHBondContact CA-O 3.5Å; V209-G220 WeakPolarHBondContact CG1-O 3.48Å
210	A	92.8	Very high	91.4	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	140.4	174.5	0	0	0	0	0	110	P127 F129 A153 L163 Y166 S219 G220	P127-A210 HydrophobicContact CB-CB 3.66Å; F129-A210 HydrophobicContact CE2-CB 3.88Å; F129-A210 HydrophobicContact CZ-CB 3.75Å; A153-A210 HydrophobicContact CB-CB 3.48Å; A153-A210 VanDerWaalsContact CB-CB 3.48Å; L163-A210 HydrophobicContact CD1-CB 3.8Å; Y166-A210 HydrophobicContact CD1-CB 3.79Å; Y166-A210 HydrophobicContact CE1-CB 3.87Å; A210-S219 CarbonylContact O-C 3.59Å; A210-S219 WeakPolarHBondContact O-CA 3.38Å; A210-S219 WeakPolarHBondContact O-CB 3.34Å; A210-G220 PolarHBondContact N-O 2.88Å; A210-G220 PolarHBondContact O-N 3.09Å; A210-G220 VanDerWaalsContact O-N 3.11Å
211	Y	90.9	Very high	91.4	Very high	86 Å²	86	58.1 Å²	58.1	34%	0.337	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.4	-177.5	-62.3	-91.4	0	0	0	112.1	Q164 T165 V209	Q164-Y211 PolarHBondContact N-O 3.31Å; T165-Y211 HydrophobicContact CG2-CD2 4.29Å; T165-Y211 PolarHBondContact N-O 3.4Å; T165-Y211 VanDerWaalsContact N-O 3.11Å; T165-Y211 PolarHBondContact O-N 3.09Å; V209-Y211 HydrophobicContact CB-CE2 3.79Å; V209-Y211 HydrophobicContact CG1-CD2 4.21Å; V209-Y211 HydrophobicContact CG1-CE1 4.04Å; V209-Y211 HydrophobicContact CG1-CE2 3.55Å; V209-Y211 VanDerWaalsContact CG1-CZ 3.44Å
212	D	90.1	Very high	91.5	Very high	6 Å²	6	54.6 Å²	54.6	3%	0.032	31%	0.305	C	S	.	.			trans	-81.9	-170.5	160.9	65.4	45.9	0	0	0	111.9	N123 P127 N161 G214 P217 K218	N123-D212 PolarHBondContact ND2-OD2 3.24Å; N123-D212 PolarHBondContact OD1-OD2 2.66Å; P127-D212 HydrophobicContact CG-CB 4.43Å; N161-D212 WeakPolarHBondContact O-CB 3.09Å; D212-G214 PolarHBondContact OD1-N 2.68Å; D212-P217 WeakPolarHBondContact OD1-CA 3.05Å; D212-P217 VanDerWaalsContact OD1-CB 3.31Å; D212-P217 WeakPolarHBondContact OD1-CB 3.29Å; D212-K218 VanDerWaalsContact CG-N 3.29Å; D212-K218 PolarHBondContact N-O 3.28Å; D212-K218 PolarHBondContact OD1-N 3.12Å; D212-K218 VanDerWaalsContact OD1-N 3.15Å; D212-K218 VanDerWaalsContact OD2-CA 3.31Å; D212-K218 WeakPolarHBondContact OD2-CA 3.33Å; D212-K218 VanDerWaalsContact OD2-CB 3.23Å; D212-K218 WeakPolarHBondContact OD2-CB 3.46Å; D212-K218 PolarHBondContact OD2-N 3.38Å
213	K	85.7	Confident	91.6	Very high	116 Å²	116	52.9 Å²	52.9	50%	0.504	30%	0.3	S	S	.	.			trans	-127.9	33.1	159.2	-66.7	168.6	-172.1	145.9	0	111.4	P160 Q164	P160-K213 CarbonylContact O-C 3.6Å; P160-K213 WeakPolarHBondContact O-CA 3.35Å; P160-K213 WeakPolarHBondContact O-CB 3.28Å; P160-K213 PolarHBondContact O-N 3.27Å; Q164-K213 HydrophobicContact CB-CB 4.41Å; Q164-K213 HydrophobicContact CB-CD 3.87Å; Q164-K213 HydrophobicContact CB-CG 3.7Å; Q164-K213 HydrophobicContact CG-CB 4.01Å; Q164-K213 HydrophobicContact CG-CD 3.79Å; Q164-K213 HydrophobicContact CG-CG 3.77Å
214	G	84.1	Confident	91.6	Very high	2 Å²	2	51.2 Å²	51.2	2%	0.021	29%	0.288	C	S	.	.			trans	-69.1	176.2	175.6	0	0	0	0	0	112.8	N161 D212 P216 P217	N161-G214 WeakPolarHBondContact OD1-CA 3.36Å; D212-G214 PolarHBondContact OD1-N 2.68Å; G214-P216 VanDerWaalsContact C-C 3.48Å; G214-P216 CarbonylContact C-O 3.58Å; G214-P216 CarbonylContact O-C 3.59Å; G214-P217 WeakPolarHBondContact O-CA 3.17Å; G214-P217 WeakPolarHBondContact O-CD 3.06Å; G214-P217 VanDerWaalsContact O-N 3.13Å
215	N	81.7	Confident	91.6	Very high	149 Å²	149	52.9 Å²	52.9	80%	0.797	30%	0.297	S	S	*	.	S	Bend	trans	-134.7	100.9	179.3	-75	-89.1	0	0	0	110.3
216	P	86.3	Confident	91.6	Very high	98 Å²	98	46.8 Å²	46.8	64%	0.636	26%	0.264	S	S	*	.	S	Bend	cis	-68.8	152.6	0.5	31.5	-36.6	0	0	0	112.4	N123 G214	N123-P216 PolarHBondContact ND2-O 2.74Å; G214-P216 VanDerWaalsContact C-C 3.48Å; G214-P216 CarbonylContact C-O 3.58Å; G214-P216 CarbonylContact O-C 3.59Å
217	P	88.1	Confident	91.6	Very high	90 Å²	90	49.6 Å²	49.6	58%	0.584	28%	0.278	S	S	*	.			trans	-77	146.2	174.1	32	-34.8	0	0	0	111.1	D212 G214	D212-P217 WeakPolarHBondContact OD1-CA 3.05Å; D212-P217 VanDerWaalsContact OD1-CB 3.31Å; D212-P217 WeakPolarHBondContact OD1-CB 3.29Å; G214-P217 WeakPolarHBondContact O-CA 3.17Å; G214-P217 WeakPolarHBondContact O-CD 3.06Å; G214-P217 VanDerWaalsContact O-N 3.13Å
218	K	91	Very high	91.7	Very high	57 Å²	57	46.2 Å²	46.2	25%	0.248	26%	0.261	C	S	.	.			trans	-123.4	171.9	178.1	-53.3	168.6	-171.5	168.5	0	110.3	N123 D124 H125 D212	N123-K218 VanDerWaalsContact O-CE 3.28Å; N123-K218 WeakPolarHBondContact O-CE 3.15Å; N123-K218 PolarHBondContact O-NZ 2.6Å; D124-K218 PolarHBondContact O-NZ 2.75Å; H125-K218 WeakPolarHBondContact O-CD 3.43Å; H125-K218 WeakPolarHBondContact O-CE 3.3Å; H125-K218 PolarHBondContact O-NZ 2.74Å; D212-K218 VanDerWaalsContact CG-N 3.29Å; D212-K218 PolarHBondContact N-O 3.28Å; D212-K218 PolarHBondContact OD1-N 3.12Å; D212-K218 VanDerWaalsContact OD1-N 3.15Å; D212-K218 VanDerWaalsContact OD2-CA 3.31Å; D212-K218 WeakPolarHBondContact OD2-CA 3.33Å; D212-K218 VanDerWaalsContact OD2-CB 3.23Å; D212-K218 WeakPolarHBondContact OD2-CB 3.46Å; D212-K218 PolarHBondContact OD2-N 3.38Å
219	S	92.9	Very high	91.7	Very high	64 Å²	64	50.5 Å²	50.5	45%	0.448	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	145.5	-176.6	58.9	0	0	0	0	112.4	A210	A210-S219 CarbonylContact O-C 3.59Å; A210-S219 WeakPolarHBondContact O-CA 3.38Å; A210-S219 WeakPolarHBondContact O-CB 3.34Å
220	G	92.7	Very high	91.7	Very high	13 Å²	13	51.2 Å²	51.2	13%	0.134	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	158.3	164.8	0	0	0	0	0	111.5	P127 V209 A210	P127-G220 WeakPolarHBondContact O-CA 3.28Å; P127-G220 PolarHBondContact O-N 2.67Å; V209-G220 CarbonylContact C-O 3.57Å; V209-G220 WeakPolarHBondContact CA-O 3.5Å; V209-G220 WeakPolarHBondContact CG1-O 3.48Å; A210-G220 PolarHBondContact N-O 2.88Å; A210-G220 PolarHBondContact O-N 3.09Å; A210-G220 VanDerWaalsContact O-N 3.11Å
221	S	94.1	Very high	91.7	Very high	82 Å²	82	52 Å²	52	57%	0.573	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.3	-179.6	60.1	0	0	0	0	112.3	L208	L208-S221 CarbonylContact O-C 3.59Å; L208-S221 VanDerWaalsContact O-CA 3.3Å; L208-S221 WeakPolarHBondContact O-CA 3.44Å
222	M	94.5	Very high	91.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.1	173.8	175.6	-177.7	73.4	0	0	108.9	F129 N131 Q134 D151 L208 V224	F129-M222 HydrophobicContact CB-CB 3.97Å; F129-M222 HydrophobicContact CB-CG 4.46Å; F129-M222 HydrophobicContact CB-SD 4.13Å; F129-M222 HydrophobicContact CD1-CB 4.03Å; F129-M222 HydrophobicContact CD1-CE 4.02Å; F129-M222 HydrophobicContact CD1-SD 3.94Å; F129-M222 HydrophobicContact CD2-CB 3.6Å; F129-M222 HydrophobicContact CE1-CB 4.42Å; F129-M222 HydrophobicContact CE1-CE 4.18Å; F129-M222 HydrophobicContact CE2-CB 4.02Å; F129-M222 HydrophobicContact CG-CB 3.6Å; F129-M222 HydrophobicContact CG-CG 4.42Å; F129-M222 HydrophobicContact CG-SD 4.15Å; F129-M222 HydrophobicContact CZ-CB 4.41Å; N131-M222 WeakPolarHBondContact O-CG 3.42Å; Q134-M222 HydrophobicContact CB-CE 3.9Å; Q134-M222 HydrophobicContact CB-SD 3.95Å; D151-M222 HydrophobicContact CB-CE 3.92Å; D151-M222 HydrophobicContact CB-SD 3.92Å; L208-M222 HydrophobicContact CD2-CE 3.96Å; L208-M222 PolarHBondContact N-O 3.16Å; L208-M222 PolarHBondContact O-N 2.85Å; M222-V224 HydrophobicContact CE-CG2 3.97Å
223	S	95.3	Very high	91.9	Very high	55 Å²	55	53.6 Å²	53.6	39%	0.385	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133.9	171.1	-61.9	0	0	0	0	109.9	T132 T133 Q134 L206	T132-S223 PolarHBondContact O-N 2.97Å; T133-S223 CarbonylContact C-O 3.46Å; T133-S223 VanDerWaalsContact CA-O 3.29Å; T133-S223 WeakPolarHBondContact CA-O 3.2Å; Q134-S223 PolarHBondContact N-O 2.76Å; L206-S223 CarbonylContact O-C 3.52Å; L206-S223 WeakPolarHBondContact O-CA 3.02Å
224	V	95.1	Very high	92.1	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	107.7	171.6	-179.6	0	0	0	0	106.9	Q134 V136 L150 L206 L208 M222 V226	Q134-V224 CarbonylContact O-C 3.37Å; Q134-V224 WeakPolarHBondContact O-CA 3.44Å; V136-V224 HydrophobicContact CG2-CG1 3.86Å; L150-V224 HydrophobicContact CD1-CG2 4.46Å; L150-V224 HydrophobicContact CD2-CG1 3.97Å; L150-V224 HydrophobicContact CD2-CG2 4.13Å; L206-V224 HydrophobicContact CB-CB 4.29Å; L206-V224 PolarHBondContact N-O 2.97Å; L206-V224 PolarHBondContact O-N 3.12Å; L208-V224 HydrophobicContact CB-CG2 4.14Å; M222-V224 HydrophobicContact CE-CG2 3.97Å; V224-V226 HydrophobicContact CG1-CG2 4.09Å
225	H	95.3	Very high	92.5	Very high	51 Å²	51	53.3 Å²	53.3	24%	0.236	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	108	178.2	-175.9	68.6	0	0	0	108.5	Q134 E135 V136 D205 L227	Q134-H225 PolarHBondContact O-N 2.97Å; E135-H225 WeakPolarHBondContact CA-O 3.1Å; E135-H225 HydrophobicContact CG-CB 4.32Å; V136-H225 PolarHBondContact N-O 2.86Å; D205-H225 IonicContact OD1-CE1 2.86Å; D205-H225 IonicContact OD1-CG 3.66Å; D205-H225 IonicContact OD1-ND1 3.52Å; D205-H225 PolarHBondContact OD1-ND1 3.1Å; H225-L227 WeakPolarHBondContact NE2-CD2 3.37Å
226	V	95.3	Very high	93.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.1	-179.2	-175.3	0	0	0	0	109	V136 I138 F174 L190 S203 F204 L206 V224 I228	V136-V226 CarbonylContact O-C 3.57Å; V136-V226 WeakPolarHBondContact O-CA 3.46Å; I138-V226 HydrophobicContact CD1-CG1 3.41Å; I138-V226 VanDerWaalsContact CD1-CG1 3.41Å; I138-V226 HydrophobicContact CG1-CG1 3.83Å; F174-V226 HydrophobicContact CE1-CG1 4.45Å; F174-V226 HydrophobicContact CE2-CG1 4.46Å; F174-V226 HydrophobicContact CZ-CG1 3.88Å; L190-V226 HydrophobicContact CD2-CG2 4.06Å; S203-V226 CarbonylContact C-O 3.43Å; S203-V226 VanDerWaalsContact CA-O 3.24Å; S203-V226 WeakPolarHBondContact CA-O 3.12Å; F204-V226 HydrophobicContact CB-CB 4.17Å; F204-V226 PolarHBondContact N-O 3.32Å; F204-V226 PolarHBondContact O-N 2.94Å; L206-V226 HydrophobicContact CD1-CG2 3.98Å; V224-V226 HydrophobicContact CG1-CG2 4.09Å; V226-I228 HydrophobicContact CG1-CD1 4.1Å
227	L	95.1	Very high	93.5	Very high	63 Å²	63	44.2 Å²	44.2	33%	0.33	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.2	173.4	-72.1	169.8	0	0	0	109.3	V136 E137 I138 H225	V136-L227 PolarHBondContact O-N 2.93Å; E137-L227 WeakPolarHBondContact CA-O 3.29Å; E137-L227 HydrophobicContact CG-CB 4.38Å; I138-L227 PolarHBondContact N-O 2.85Å; H225-L227 WeakPolarHBondContact NE2-CD2 3.37Å
228	I	95.8	Very high	93.9	Very high	14 Å²	14	41.4 Å²	41.4	7%	0.072	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.2	176.5	-53.4	-55.2	0	0	0	109.2	I138 E140 L196 R198 D202 F204 V226	I138-I228 CarbonylContact O-C 3.33Å; I138-I228 VanDerWaalsContact O-CA 3.32Å; I138-I228 WeakPolarHBondContact O-CA 3.34Å; E140-I228 HydrophobicContact CB-CG2 3.66Å; L196-I228 HydrophobicContact CD1-CD1 4.1Å; L196-I228 HydrophobicContact CD2-CD1 4.29Å; R198-I228 HydrophobicContact CB-CB 4.4Å; R198-I228 HydrophobicContact CB-CG2 3.82Å; R198-I228 HydrophobicContact CG-CB 4.26Å; R198-I228 HydrophobicContact CG-CG2 4.16Å; D202-I228 WeakPolarHBondContact O-CB 3.11Å; D202-I228 WeakPolarHBondContact O-CG1 3.19Å; D202-I228 PolarHBondContact O-N 2.87Å; F204-I228 HydrophobicContact CD2-CD1 4.08Å; F204-I228 HydrophobicContact CD2-CG1 4.22Å; F204-I228 HydrophobicContact CE2-CD1 3.97Å; F204-I228 HydrophobicContact CE2-CG1 3.98Å; V226-I228 HydrophobicContact CG1-CD1 4.1Å
229	Q	94.6	Very high	93.9	Very high	90 Å²	90	45.5 Å²	45.5	42%	0.421	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	129.8	174.2	-73.4	-175.8	-16.9	0	0	110.3	E137 I138 S139 E140	E137-Q229 HydrophobicContact CB-CG 4.07Å; E137-Q229 PolarHBondContact OE2-NE2 2.64Å; I138-Q229 PolarHBondContact O-N 2.87Å; S139-Q229 WeakPolarHBondContact CA-O 3.14Å; E140-Q229 PolarHBondContact N-O 2.79Å
230	D	94.3	Very high	93.7	Very high	39 Å²	39	47.6 Å²	47.6	21%	0.209	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-64.6	134.1	180	-171.4	87.6	0	0	0	113.4	E140 R198 L267 N270	E140-D230 VanDerWaalsContact OE1-CA 3.28Å; E140-D230 WeakPolarHBondContact OE1-CA 3.26Å; R198-D230 IonicContact CZ-OD1 3.15Å; R198-D230 IonicContact NE-OD1 2.81Å; R198-D230 PolarHBondContact NE-OD1 2.91Å; R198-D230 IonicContact NH2-OD1 2.82Å; R198-D230 PolarHBondContact NH2-OD1 2.96Å; D230-L267 HydrophobicContact CB-CB 3.8Å; D230-L267 VanDerWaalsContact CG-N 3.26Å; D230-L267 WeakPolarHBondContact OD1-CB 3.05Å; D230-L267 PolarHBondContact OD1-N 2.92Å; D230-L267 PolarHBondContact OD2-N 3.36Å; D230-N270 PolarHBondContact OD2-ND2 2.98Å
231	S	92.8	Very high	93.4	Very high	15 Å²	15	51 Å²	51	11%	0.105	29%	0.289	C	S	.	.			trans	-120.9	138.1	175.4	-60.2	0	0	0	0	109.5	S139 E140 T141 D233	S139-S231 PolarHBondContact OG-OG 2.87Å; S139-S231 VanDerWaalsContact OG-OG 3.08Å; E140-S231 PolarHBondContact OE1-N 3.14Å; T141-S231 PolarHBondContact OG1-OG 2.95Å; S231-D233 VanDerWaalsContact C-N 3.27Å; S231-D233 PolarHBondContact O-N 2.88Å
232	N	93.4	Very high	93.4	Very high	24 Å²	24	50.4 Å²	50.4	13%	0.128	28%	0.284	C	S	.	.	S	Bend	trans	-75.1	79.4	176.9	-160.3	63.5	0	0	0	110.1	D266 N270 D320 P323	N232-D266 WeakPolarHBondContact CA-OD2 3.19Å; N232-N270 HydrophobicContact CB-CB 4.12Å; N232-N270 PolarHBondContact N-ND2 2.92Å; N232-N270 VanDerWaalsContact OD1-CA 3.24Å; N232-N270 WeakPolarHBondContact OD1-CA 3.12Å; N232-N270 WeakPolarHBondContact OD1-CB 3.49Å; N232-D320 PolarHBondContact ND2-OD1 3.41Å; N232-D320 PolarHBondContact OD1-OD1 3.12Å; N232-P323 HydrophobicContact CB-CG 4.39Å; N232-P323 WeakPolarHBondContact CB-O 3.35Å; N232-P323 PolarHBondContact ND2-O 2.74Å
233	D	91.3	Very high	93.4	Very high	102 Å²	102	50.5 Å²	50.5	55%	0.545	29%	0.285	S	S	.	.			trans	-119.1	-18.8	-171.4	112.4	-37.7	0	0	0	113.5	S231 D266	S231-D233 VanDerWaalsContact C-N 3.27Å; S231-D233 PolarHBondContact O-N 2.88Å; D233-D266 PolarHBondContact N-OD2 3.28Å
234	N	91.6	Very high	93.5	Very high	63 Å²	63	51.7 Å²	51.7	34%	0.337	29%	0.29	S	S	.	.	S	Bend	trans	-84.3	-170.9	163.9	-65.6	-80.6	0	0	0	111.1	P265 D266	N234-P265 HydrophobicContact CB-CG 3.69Å; N234-D266 VanDerWaalsContact CB-OD1 3.26Å; N234-D266 WeakPolarHBondContact CB-OD1 3.46Å; N234-D266 PolarHBondContact N-OD2 3.04Å; N234-D266 PolarHBondContact ND2-OD1 3.19Å
235	S	92.6	Very high	93.5	Very high	50 Å²	50	52.7 Å²	52.7	35%	0.35	30%	0.296	S	S	.	.			trans	-159.8	154.9	172.6	53.2	0	0	0	0	111.4	A237 D264	S235-A237 PolarHBondContact O-N 3.14Å; S235-D264 WeakPolarHBondContact CA-OD2 3.46Å
236	P	95.2	Very high	93.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	32%	0.315	C	S	.	.			trans	-66.5	109.4	-161.8	-28	36.7	0	0	0	114.6	F238 A262 D264 V273 A318 D320 T328	P236-F238 PolarHBondContact O-N 3.08Å; P236-A262 HydrophobicContact CB-CB 4.28Å; P236-D264 WeakPolarHBondContact CA-OD2 3.24Å; P236-D264 HydrophobicContact CB-CB 4.37Å; P236-D264 WeakPolarHBondContact CD-OD2 3.37Å; P236-D264 HydrophobicContact CG-CB 4.24Å; P236-D264 WeakPolarHBondContact CG-OD2 2.96Å; P236-V273 HydrophobicContact CB-CB 4.37Å; P236-V273 HydrophobicContact CB-CG1 3.7Å; P236-V273 HydrophobicContact CB-CG2 3.77Å; P236-V273 HydrophobicContact CG-CB 4.49Å; P236-V273 HydrophobicContact CG-CG1 4.06Å; P236-V273 HydrophobicContact CG-CG2 3.93Å; P236-A318 HydrophobicContact CB-CB 3.9Å; P236-D320 HydrophobicContact CG-CB 4.13Å; P236-T328 VanDerWaalsContact O-CB 3.3Å; P236-T328 WeakPolarHBondContact O-CB 3.36Å; P236-T328 WeakPolarHBondContact O-CG2 3.45Å; P236-T328 PolarHBondContact O-OG1 2.96Å
237	A	93.8	Very high	93.6	Very high	56 Å²	56	56 Å²	56	46%	0.463	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114.5	-177.6	0	0	0	0	0	111.8	S235 A262 T263	S235-A237 PolarHBondContact O-N 3.14Å; A237-A262 CarbonylContact O-C 3.52Å; A237-A262 VanDerWaalsContact O-CA 3.24Å; A237-A262 WeakPolarHBondContact O-CA 3.5Å; A237-T263 PolarHBondContact N-O 3.23Å; A237-T263 PolarHBondContact O-N 2.69Å
238	F	94.5	Very high	93.6	Very high	31 Å²	31	55 Å²	55	14%	0.136	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	132.9	170.8	-77.9	-83.7	0	0	0	111.7	P236 E240 L260 A262 Y275 A318 T328 C330	P236-F238 PolarHBondContact O-N 3.08Å; F238-E240 VanDerWaalsContact C-N 3.28Å; F238-E240 PolarHBondContact O-N 2.58Å; F238-L260 HydrophobicContact CD1-CD2 4.46Å; F238-L260 HydrophobicContact CE1-CB 4.28Å; F238-L260 HydrophobicContact CE1-CD1 4.37Å; F238-L260 HydrophobicContact CE1-CD2 4.17Å; F238-A262 HydrophobicContact CD1-CB 3.9Å; F238-A262 HydrophobicContact CD2-CB 4.44Å; F238-A262 HydrophobicContact CE1-CB 4.17Å; F238-A262 HydrophobicContact CG-CB 4.05Å; F238-Y275 HydrophobicContact CE1-CD1 4.22Å; F238-Y275 HydrophobicContact CE1-CE1 4.06Å; F238-Y275 HydrophobicContact CZ-CD1 4.46Å; F238-A318 HydrophobicContact CD2-CB 4.35Å; F238-A318 HydrophobicContact CE1-CB 4.22Å; F238-A318 HydrophobicContact CE2-CB 3.53Å; F238-A318 HydrophobicContact CZ-CB 3.45Å; F238-A318 VanDerWaalsContact CZ-CB 3.45Å; F238-T328 WeakPolarHBondContact CD2-OG1 3.19Å; F238-T328 WeakPolarHBondContact CE2-OG1 3.4Å; F238-C330 HydrophobicContact CB-CB 4.44Å; F238-C330 HydrophobicContact CD1-CB 3.61Å; F238-C330 HydrophobicContact CD2-CB 3.73Å; F238-C330 HydrophobicContact CE1-CB 3.6Å; F238-C330 HydrophobicContact CE2-CB 3.71Å; F238-C330 HydrophobicContact CG-CB 3.67Å; F238-C330 HydrophobicContact CZ-CB 3.64Å
239	Q	91.9	Very high	93.6	Very high	143 Å²	143	54.7 Å²	54.7	67%	0.668	32%	0.316	S	S	*	.	S	Bend	trans	-61.7	-35.1	175.9	-176.9	-177.2	-20.7	0	0	112.7	T261	Q239-T261 PolarHBondContact N-O 2.81Å
240	E	89.4	Confident	93.5	Very high	107 Å²	107	55.4 Å²	55.4	50%	0.5	32%	0.322	S	S	.	.			trans	-131.7	127.1	172.3	-70.4	-177.1	-142.4	0	0	109.3	F238 P243 C330	F238-E240 VanDerWaalsContact C-N 3.28Å; F238-E240 PolarHBondContact O-N 2.58Å; E240-P243 HydrophobicContact CB-CB 4.31Å; E240-P243 HydrophobicContact CB-CG 4.49Å; E240-C330 PolarHBondContact O-SG 2.82Å
241	S	85.8	Confident	93.6	Very high	86 Å²	86	54.3 Å²	54.3	60%	0.601	32%	0.317	S	S	*	.	S	Bend	trans	-85	-21.9	-176.7	55.2	0	0	0	0	114.1	K331	S241-K331 PolarHBondContact O-N 3.05Å
242	S	93.7	Very high	93.7	Very high	69 Å²	69	57.9 Å²	57.9	48%	0.483	34%	0.34	S	S	.	.	S	Bend	trans	-145.3	60.6	177.2	67	0	0	0	0	113.5	K331	S242-K331 CarbonylContact C-O 3.59Å; S242-K331 VanDerWaalsContact CA-O 3.27Å; S242-K331 WeakPolarHBondContact CA-O 3.34Å
243	P	95.6	Very high	93.8	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.013	36%	0.36	C	S	.	.			trans	-61.1	148.3	177.6	26.3	-33.8	0	0	0	111.4	E240 F258 C330 L332 H333	E240-P243 HydrophobicContact CB-CB 4.31Å; E240-P243 HydrophobicContact CB-CG 4.49Å; P243-F258 HydrophobicContact CB-CE1 3.83Å; P243-F258 HydrophobicContact CB-CE2 4.16Å; P243-F258 HydrophobicContact CB-CZ 3.5Å; P243-F258 HydrophobicContact CG-CD1 4.49Å; P243-F258 HydrophobicContact CG-CE1 3.76Å; P243-F258 HydrophobicContact CG-CZ 4Å; P243-C330 VanDerWaalsContact CD-SG 3.52Å; P243-L332 HydrophobicContact CB-CD1 4.29Å; P243-L332 HydrophobicContact CG-CB 4.45Å; P243-L332 HydrophobicContact CG-CD1 3.98Å; P243-H333 PolarHBondContact O-N 2.8Å
244	T	96.4	Very high	94	Very high	80 Å²	80	59.3 Å²	59.3	49%	0.491	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.7	175.8	-59.3	0	0	0	0	111	H333 K335	T244-H333 CarbonylContact C-O 3.56Å; T244-H333 VanDerWaalsContact CA-O 3.28Å; T244-H333 WeakPolarHBondContact CA-O 3.44Å; T244-H333 HydrophobicContact CG2-CB 4.25Å; T244-K335 HydrophobicContact CG2-CD 4.16Å; T244-K335 HydrophobicContact CG2-CG 4.35Å
245	V	95.7	Very high	94.2	Very high	22 Å²	22	58.6 Å²	58.6	13%	0.133	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135	178.5	176.5	0	0	0	0	109.8	F258 L332 H333 I334 K335	V245-F258 HydrophobicContact CG2-CB 4.14Å; V245-F258 HydrophobicContact CG2-CD2 3.36Å; V245-F258 HydrophobicContact CG2-CE2 4.02Å; V245-F258 HydrophobicContact CG2-CG 3.98Å; V245-L332 HydrophobicContact CG2-CD1 3.88Å; V245-H333 PolarHBondContact N-O 2.97Å; V245-I334 CarbonylContact O-C 3.54Å; V245-I334 WeakPolarHBondContact O-CA 3.41Å; V245-K335 PolarHBondContact O-N 3.41Å
246	T	96.4	Very high	94.4	Very high	104 Å²	104	59.6 Å²	59.6	64%	0.638	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	130.7	169	50.4	0	0	0	0	109.8	K335	T246-K335 CarbonylContact C-O 3.53Å; T246-K335 WeakPolarHBondContact CA-O 3.39Å
247	L	95.8	Very high	94.4	Very high	17 Å²	17	60.7 Å²	60.7	9%	0.089	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	134.2	-170.6	-171.3	65.1	0	0	0	111.3	T251 I257 V300 L304 I334 K335 L336 V337	L247-T251 HydrophobicContact CD1-CG2 4.06Å; L247-T251 VanDerWaalsContact CD1-OG1 3.29Å; L247-T251 WeakPolarHBondContact CD1-OG1 3.45Å; L247-I257 HydrophobicContact CD1-CB 4.22Å; L247-I257 HydrophobicContact CD1-CG2 3.47Å; L247-I257 VanDerWaalsContact CD1-CG2 3.47Å; L247-I257 HydrophobicContact CD2-CB 4.4Å; L247-I257 HydrophobicContact CD2-CD1 3.98Å; L247-I257 HydrophobicContact CD2-CG2 3.77Å; L247-I257 HydrophobicContact CG-CG2 4.28Å; L247-V300 HydrophobicContact CD2-CG2 4.12Å; L247-L304 HydrophobicContact CD2-CD1 3.49Å; L247-L304 VanDerWaalsContact CD2-CD1 3.49Å; L247-L304 HydrophobicContact CG-CD1 4.45Å; L247-I334 HydrophobicContact CB-CG2 4.05Å; L247-I334 HydrophobicContact CD2-CG2 4.11Å; L247-K335 PolarHBondContact N-O 2.94Å; L247-L336 HydrophobicContact CB-CD2 4.36Å; L247-L336 CarbonylContact O-C 3.56Å; L247-L336 VanDerWaalsContact O-CA 3.24Å; L247-L336 WeakPolarHBondContact O-CA 3.45Å; L247-V337 PolarHBondContact O-N 2.92Å
248	S	95	Very high	94.4	Very high	42 Å²	42	60.5 Å²	60.5	29%	0.294	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	135.9	172.3	-159.3	0	0	0	0	109.7	N250 T251 V339	S248-N250 VanDerWaalsContact C-N 3.32Å; S248-N250 WeakPolarHBondContact CB-OD1 3.34Å; S248-N250 PolarHBondContact O-N 3.41Å; S248-N250 PolarHBondContact OG-OD1 2.81Å; S248-T251 VanDerWaalsContact O-CB 3.23Å; S248-T251 WeakPolarHBondContact O-CB 3.49Å; S248-T251 PolarHBondContact O-N 3Å; S248-T251 VanDerWaalsContact O-N 3.12Å; S248-T251 PolarHBondContact O-OG1 2.82Å; S248-V339 VanDerWaalsContact OG-CG2 3.23Å; S248-V339 WeakPolarHBondContact OG-CG2 3.45Å
249	E	95.3	Very high	94.4	Very high	7 Å²	7	64.2 Å²	64.2	3%	0.033	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-37.4	-178	71.9	-161.9	106.4	0	0	113.1	T251 L304 Y306 L336 V337 D338 V339	E249-T251 PolarHBondContact O-N 2.88Å; E249-L304 HydrophobicContact CB-CB 4.41Å; E249-Y306 WeakPolarHBondContact OE1-CB 3.45Å; E249-Y306 WeakPolarHBondContact OE2-CB 3.38Å; E249-Y306 PolarHBondContact OE2-N 3.17Å; E249-L336 HydrophobicContact CB-CD1 4.07Å; E249-V337 PolarHBondContact N-O 3.28Å; E249-D338 VanDerWaalsContact OE1-CA 3.28Å; E249-D338 WeakPolarHBondContact OE1-CA 3.28Å; E249-V339 HydrophobicContact CG-CB 4.31Å; E249-V339 HydrophobicContact CG-CG2 4.27Å; E249-V339 PolarHBondContact OE1-N 2.84Å
250	N	93.8	Very high	94.5	Very high	104 Å²	104	57.6 Å²	57.6	56%	0.556	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	14.7	173.4	73	-4.7	0	0	0	114.3	S248	S248-N250 VanDerWaalsContact C-N 3.32Å; S248-N250 WeakPolarHBondContact CB-OD1 3.34Å; S248-N250 PolarHBondContact O-N 3.41Å; S248-N250 PolarHBondContact OG-OD1 2.81Å
251	T	95.8	Very high	94.7	Very high	16 Å²	16	55.4 Å²	55.4	10%	0.098	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-57.6	124.9	174.4	-70.3	0	0	0	0	110	L247 S248 E249 T255 V300	L247-T251 HydrophobicContact CD1-CG2 4.06Å; L247-T251 VanDerWaalsContact CD1-OG1 3.29Å; L247-T251 WeakPolarHBondContact CD1-OG1 3.45Å; S248-T251 VanDerWaalsContact O-CB 3.23Å; S248-T251 WeakPolarHBondContact O-CB 3.49Å; S248-T251 PolarHBondContact O-N 3Å; S248-T251 VanDerWaalsContact O-N 3.12Å; S248-T251 PolarHBondContact O-OG1 2.82Å; E249-T251 PolarHBondContact O-N 2.88Å; T251-T255 VanDerWaalsContact CG2-CB 3.5Å; T251-T255 HydrophobicContact CG2-CG2 3.78Å; T251-V300 HydrophobicContact CG2-CG2 3.94Å
252	P	95.3	Very high	95.1	Very high	90 Å²	90	51.7 Å²	51.7	58%	0.584	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-67.2	142.1	-177	24.1	-30.8	0	0	0	112.1	G254 T255	P252-G254 PolarHBondContact O-N 2.82Å; P252-T255 VanDerWaalsContact O-CB 3.3Å; P252-T255 WeakPolarHBondContact O-CB 3.39Å; P252-T255 PolarHBondContact O-N 3.26Å; P252-T255 VanDerWaalsContact O-N 3.14Å; P252-T255 PolarHBondContact O-OG1 2.76Å
253	I	95.9	Very high	95.1	Very high	106 Å²	106	52.7 Å²	52.7	54%	0.544	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	136	175.1	-57.8	170.7	0	0	0	109.6	K301 P303	I253-K301 WeakPolarHBondContact CG2-O 3.39Å; I253-P303 HydrophobicContact CD1-CG 4.19Å
254	G	94.4	Very high	95.1	Very high	51 Å²	51	53.6 Å²	53.6	53%	0.526	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-4.5	-173	0	0	0	0	0	114.5	P252 T256 V300	P252-G254 PolarHBondContact O-N 2.82Å; G254-T256 PolarHBondContact O-N 3.45Å; G254-V300 PolarHBondContact N-O 2.81Å
255	T	95.5	Very high	95	Very high	47 Å²	47	53.1 Å²	53.1	29%	0.288	32%	0.315	S	S	.	.			trans	-71.6	125	175	-57.2	0	0	0	0	111.3	T251 P252 I257 I299 V300	T251-T255 VanDerWaalsContact CG2-CB 3.5Å; T251-T255 HydrophobicContact CG2-CG2 3.78Å; P252-T255 VanDerWaalsContact O-CB 3.3Å; P252-T255 WeakPolarHBondContact O-CB 3.39Å; P252-T255 PolarHBondContact O-N 3.26Å; P252-T255 VanDerWaalsContact O-N 3.14Å; P252-T255 PolarHBondContact O-OG1 2.76Å; T255-I257 HydrophobicContact CG2-CG2 4.19Å; T255-I299 WeakPolarHBondContact O-CA 3.33Å; T255-V300 PolarHBondContact O-N 2.89Å
256	T	96.3	Very high	94.9	Very high	71 Å²	71	52.4 Å²	52.4	44%	0.436	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	120.9	166	-55.9	0	0	0	0	109.8	G254 E297 V298	G254-T256 PolarHBondContact O-N 3.45Å; T256-E297 HydrophobicContact CG2-CB 3.75Å; T256-E297 HydrophobicContact CG2-CG 3.94Å; T256-V298 CarbonylContact C-O 3.57Å; T256-V298 WeakPolarHBondContact CA-O 3.25Å
257	I	95.3	Very high	94.7	Very high	23 Å²	23	52.6 Å²	52.6	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-23	-172.5	58.5	166.4	0	0	0	113.6	L247 T255 F289 V298 V300 I334	L247-I257 HydrophobicContact CD1-CB 4.22Å; L247-I257 HydrophobicContact CD1-CG2 3.47Å; L247-I257 VanDerWaalsContact CD1-CG2 3.47Å; L247-I257 HydrophobicContact CD2-CB 4.4Å; L247-I257 HydrophobicContact CD2-CD1 3.98Å; L247-I257 HydrophobicContact CD2-CG2 3.77Å; L247-I257 HydrophobicContact CG-CG2 4.28Å; T255-I257 HydrophobicContact CG2-CG2 4.19Å; I257-F289 HydrophobicContact CD1-CD1 3.94Å; I257-F289 HydrophobicContact CD1-CE1 3.76Å; I257-V298 HydrophobicContact CD1-CG1 4.23Å; I257-V298 HydrophobicContact CG1-CB 4.24Å; I257-V298 HydrophobicContact CG1-CG1 4.16Å; I257-V298 WeakPolarHBondContact CG1-O 3.41Å; I257-V298 PolarHBondContact N-O 2.9Å; I257-V300 HydrophobicContact CD1-CG2 4.48Å; I257-V300 HydrophobicContact CG2-CG2 3.63Å; I257-I334 HydrophobicContact CD1-CD1 3.51Å; I257-I334 HydrophobicContact CD1-CG1 4.23Å
258	F	94.8	Very high	94.5	Very high	53 Å²	53	54.4 Å²	54.4	23%	0.232	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	156	173.8	-159.4	-111.2	0	0	0	109.9	P243 V245 L260 V298 L332	P243-F258 HydrophobicContact CB-CE1 3.83Å; P243-F258 HydrophobicContact CB-CE2 4.16Å; P243-F258 HydrophobicContact CB-CZ 3.5Å; P243-F258 HydrophobicContact CG-CD1 4.49Å; P243-F258 HydrophobicContact CG-CE1 3.76Å; P243-F258 HydrophobicContact CG-CZ 4Å; V245-F258 HydrophobicContact CG2-CB 4.14Å; V245-F258 HydrophobicContact CG2-CD2 3.36Å; V245-F258 HydrophobicContact CG2-CE2 4.02Å; V245-F258 HydrophobicContact CG2-CG 3.98Å; F258-L260 HydrophobicContact CD1-CD2 3.96Å; F258-L260 HydrophobicContact CD1-CG 4.26Å; F258-L260 HydrophobicContact CE1-CD2 4Å; F258-V298 HydrophobicContact CB-CB 4.41Å; F258-V298 HydrophobicContact CB-CG2 4.45Å; F258-V298 PolarHBondContact O-N 3.38Å; F258-L332 HydrophobicContact CB-CD1 4.35Å; F258-L332 HydrophobicContact CB-CD2 4.01Å; F258-L332 HydrophobicContact CD1-CD1 4.15Å; F258-L332 HydrophobicContact CD1-CD2 4.41Å; F258-L332 HydrophobicContact CG-CD1 4.11Å; F258-L332 HydrophobicContact CG-CD2 4.45Å
259	K	94.9	Very high	94.3	Very high	108 Å²	108	54.9 Å²	54.9	47%	0.47	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	114.9	169.1	-177.9	167.1	-173.6	132.2	0	108.6	T295 E297	K259-T295 WeakPolarHBondContact CE-O 3.2Å; K259-T295 PolarHBondContact NZ-O 2.88Å; K259-E297 HydrophobicContact CB-CG 4.14Å; K259-E297 HydrophobicContact CD-CG 3.94Å; K259-E297 HydrophobicContact CG-CG 3.88Å; K259-E297 IonicContact NZ-OE1 3.16Å; K259-E297 PolarHBondContact NZ-OE1 3.25Å
260	L	94.1	Very high	94.1	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.026	34%	0.34	C	S	.	.			trans	-74.7	139.2	173.6	-64.2	164.8	0	0	0	109.4	F238 F258 Y275 V291 G296 V298 I316	F238-L260 HydrophobicContact CD1-CD2 4.46Å; F238-L260 HydrophobicContact CE1-CB 4.28Å; F238-L260 HydrophobicContact CE1-CD1 4.37Å; F238-L260 HydrophobicContact CE1-CD2 4.17Å; F258-L260 HydrophobicContact CD1-CD2 3.96Å; F258-L260 HydrophobicContact CD1-CG 4.26Å; F258-L260 HydrophobicContact CE1-CD2 4Å; L260-Y275 HydrophobicContact CB-CD1 4.18Å; L260-Y275 HydrophobicContact CB-CE1 3.97Å; L260-Y275 HydrophobicContact CD1-CD1 4.31Å; L260-V291 HydrophobicContact CD1-CG1 4.45Å; L260-G296 WeakPolarHBondContact CB-O 3.25Å; L260-G296 PolarHBondContact N-O 3.02Å; L260-V298 HydrophobicContact CD1-CG2 4.02Å; L260-V298 HydrophobicContact CG-CG2 4.21Å; L260-I316 HydrophobicContact CD1-CB 4.12Å; L260-I316 HydrophobicContact CD1-CD1 3.76Å; L260-I316 HydrophobicContact CD1-CG2 3.54Å
261	T	93.9	Very high	94	Very high	60 Å²	60	51.5 Å²	51.5	37%	0.368	32%	0.324	S	S	.	.			trans	-124.2	112.1	169.2	-53.4	0	0	0	0	107.2	Q239 T263	Q239-T261 PolarHBondContact N-O 2.81Å; T261-T263 HydrophobicContact CG2-CG2 4.31Å
262	A	94.3	Very high	93.9	Very high	9 Å²	9	55.5 Å²	55.5	7%	0.074	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.9	160.6	0	0	0	0	0	108.8	P236 A237 F238 V273 Y275 A318	P236-A262 HydrophobicContact CB-CB 4.28Å; A237-A262 CarbonylContact O-C 3.52Å; A237-A262 VanDerWaalsContact O-CA 3.24Å; A237-A262 WeakPolarHBondContact O-CA 3.5Å; F238-A262 HydrophobicContact CD1-CB 3.9Å; F238-A262 HydrophobicContact CD2-CB 4.44Å; F238-A262 HydrophobicContact CE1-CB 4.17Å; F238-A262 HydrophobicContact CG-CB 4.05Å; A262-V273 HydrophobicContact CB-CG1 4.06Å; A262-Y275 HydrophobicContact CB-CE1 3.91Å; A262-Y275 PolarHBondContact N-OH 2.72Å; A262-Y275 PolarHBondContact O-OH 3.12Å; A262-A318 HydrophobicContact CB-CB 3.79Å
263	T	93.6	Very high	93.8	Very high	90 Å²	90	52.3 Å²	52.3	55%	0.552	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.6	-178.1	51.8	0	0	0	0	109.5	A237 T261	A237-T263 PolarHBondContact N-O 3.23Å; A237-T263 PolarHBondContact O-N 2.69Å; T261-T263 HydrophobicContact CG2-CG2 4.31Å
264	D	95.2	Very high	93.7	Very high	21 Å²	21	48.5 Å²	48.5	11%	0.112	30%	0.299	C	S	.	.			trans	-119.8	135.2	173.7	-161.8	-65.5	0	0	0	107.9	S235 P236 D266 V273	S235-D264 WeakPolarHBondContact CA-OD2 3.46Å; P236-D264 WeakPolarHBondContact CA-OD2 3.24Å; P236-D264 HydrophobicContact CB-CB 4.37Å; P236-D264 WeakPolarHBondContact CD-OD2 3.37Å; P236-D264 HydrophobicContact CG-CB 4.24Å; P236-D264 WeakPolarHBondContact CG-OD2 2.96Å; D264-D266 WeakPolarHBondContact OD1-CB 3.31Å; D264-D266 PolarHBondContact OD1-N 2.79Å; D264-D266 VanDerWaalsContact OD1-N 3.14Å; D264-V273 HydrophobicContact CB-CG2 3.58Å
265	P	93.8	Very high	93.8	Very high	69 Å²	69	46.8 Å²	46.8	45%	0.448	28%	0.277	S	S	.	.			trans	-84.8	-13.1	-175.7	36.5	-38	0	0	0	114.2	R198 E199 N234	R198-P265 PolarHBondContact NH2-O 3.45Å; E199-P265 HydrophobicContact CG-CB 3.79Å; E199-P265 HydrophobicContact CG-CG 4.06Å; N234-P265 HydrophobicContact CB-CG 3.69Å
266	D	94.6	Very high	93.8	Very high	8 Å²	8	49.7 Å²	49.7	4%	0.043	28%	0.283	C	S	.	.	S	Bend	trans	-71	165.3	-173	-61.9	1.8	0	0	0	111.8	N232 D233 N234 D264 N270 G271	N232-D266 WeakPolarHBondContact CA-OD2 3.19Å; D233-D266 PolarHBondContact N-OD2 3.28Å; N234-D266 VanDerWaalsContact CB-OD1 3.26Å; N234-D266 WeakPolarHBondContact CB-OD1 3.46Å; N234-D266 PolarHBondContact N-OD2 3.04Å; N234-D266 PolarHBondContact ND2-OD1 3.19Å; D264-D266 WeakPolarHBondContact OD1-CB 3.31Å; D264-D266 PolarHBondContact OD1-N 2.79Å; D264-D266 VanDerWaalsContact OD1-N 3.14Å; D266-N270 HydrophobicContact CB-CB 3.5Å; D266-N270 VanDerWaalsContact CB-CB 3.5Å; D266-G271 WeakPolarHBondContact O-CA 3.4Å; D266-G271 PolarHBondContact O-N 2.64Å
267	L	91.9	Very high	93.7	Very high	108 Å²	108	48.3 Å²	48.3	57%	0.565	27%	0.271	S	S	*	.			trans	-91	133.5	-168.9	-164.3	64.1	0	0	0	113.6	D230 A269 N270	D230-L267 HydrophobicContact CB-CB 3.8Å; D230-L267 VanDerWaalsContact CG-N 3.26Å; D230-L267 WeakPolarHBondContact OD1-CB 3.05Å; D230-L267 PolarHBondContact OD1-N 2.92Å; D230-L267 PolarHBondContact OD2-N 3.36Å; L267-A269 PolarHBondContact O-N 3.47Å; L267-A269 VanDerWaalsContact O-N 3.11Å; L267-N270 PolarHBondContact O-N 2.73Å
268	G	90.6	Very high	93.7	Very high	55 Å²	55	47.5 Å²	47.5	57%	0.567	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	-111	168.6	0	0	0	0	0	112.8	E272	G268-E272 WeakPolarHBondContact O-CB 3.27Å; G268-E272 PolarHBondContact O-N 3.31Å
269	A	91.1	Very high	93.4	Very high	52 Å²	52	54.6 Å²	54.6	43%	0.43	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-27.6	-177.8	0	0	0	0	0	112.9	L267 E272 H321 G322	L267-A269 PolarHBondContact O-N 3.47Å; L267-A269 VanDerWaalsContact O-N 3.11Å; A269-E272 PolarHBondContact O-N 3.39Å; A269-H321 HydrophobicContact CB-CB 4.39Å; A269-H321 CarbonylContact O-C 3.48Å; A269-H321 VanDerWaalsContact O-CA 3.28Å; A269-H321 WeakPolarHBondContact O-CA 3.35Å; A269-H321 WeakPolarHBondContact O-CB 3.4Å; A269-H321 PolarHBondContact O-N 2.82Å; A269-H321 VanDerWaalsContact O-N 3.09Å; A269-G322 PolarHBondContact O-N 2.86Å
270	N	91.8	Very high	93.2	Very high	19 Å²	19	56 Å²	56	10%	0.102	31%	0.306	C	S	.	.	S	Bend	trans	-69.8	-44.9	175.4	-62.6	-9.4	0	0	0	108.9	D230 N232 D266 L267 E272 D320 G322	D230-N270 PolarHBondContact OD2-ND2 2.98Å; N232-N270 HydrophobicContact CB-CB 4.12Å; N232-N270 PolarHBondContact N-ND2 2.92Å; N232-N270 VanDerWaalsContact OD1-CA 3.24Å; N232-N270 WeakPolarHBondContact OD1-CA 3.12Å; N232-N270 WeakPolarHBondContact OD1-CB 3.49Å; D266-N270 HydrophobicContact CB-CB 3.5Å; D266-N270 VanDerWaalsContact CB-CB 3.5Å; L267-N270 PolarHBondContact O-N 2.73Å; N270-E272 VanDerWaalsContact C-N 3.3Å; N270-E272 PolarHBondContact O-N 2.95Å; N270-D320 WeakPolarHBondContact O-CB 3.19Å; N270-G322 WeakPolarHBondContact OD1-CA 3.41Å
271	G	91.1	Very high	93.2	Very high	21 Å²	21	55.9 Å²	55.9	22%	0.216	31%	0.306	C	S	.	.	S	Bend	trans	-71.5	-6.1	170	0	0	0	0	0	117.2	D266 V273	D266-G271 WeakPolarHBondContact O-CA 3.4Å; D266-G271 PolarHBondContact O-N 2.64Å; G271-V273 PolarHBondContact O-N 2.92Å
272	E	93.3	Very high	93.2	Very high	99 Å²	99	55.5 Å²	55.5	46%	0.463	30%	0.304	S	S	.	.			trans	-84.2	73.8	-172.3	-160.2	-168	147.5	0	0	113.1	G268 A269 N270 K274 H321	G268-E272 WeakPolarHBondContact O-CB 3.27Å; G268-E272 PolarHBondContact O-N 3.31Å; A269-E272 PolarHBondContact O-N 3.39Å; N270-E272 VanDerWaalsContact C-N 3.3Å; N270-E272 PolarHBondContact O-N 2.95Å; E272-K274 VanDerWaalsContact CD-NZ 3.29Å; E272-K274 WeakPolarHBondContact OE1-CE 3.44Å; E272-K274 IonicContact OE1-NZ 3.2Å; E272-K274 PolarHBondContact OE1-NZ 3.45Å; E272-K274 IonicContact OE2-NZ 2.71Å; E272-H321 HydrophobicContact CB-CB 4.4Å
273	V	94.1	Very high	93.2	Very high	23 Å²	23	59.2 Å²	59.2	14%	0.139	33%	0.327	C	S	.	.			trans	-57.6	132.2	178.3	-169.7	0	0	0	0	112.9	P236 A262 D264 G271 Y275 A318	P236-V273 HydrophobicContact CB-CB 4.37Å; P236-V273 HydrophobicContact CB-CG1 3.7Å; P236-V273 HydrophobicContact CB-CG2 3.77Å; P236-V273 HydrophobicContact CG-CB 4.49Å; P236-V273 HydrophobicContact CG-CG1 4.06Å; P236-V273 HydrophobicContact CG-CG2 3.93Å; A262-V273 HydrophobicContact CB-CG1 4.06Å; D264-V273 HydrophobicContact CB-CG2 3.58Å; G271-V273 PolarHBondContact O-N 2.92Å; V273-Y275 HydrophobicContact CG1-CE1 4.41Å; V273-Y275 HydrophobicContact CG1-CE2 4.44Å; V273-A318 HydrophobicContact CG1-CB 3.78Å
274	K	93.9	Very high	93.2	Very high	26 Å²	26	59.1 Å²	59.1	11%	0.113	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	157.9	167.6	-70.7	-164.3	-170.3	67.2	0	113.1	E272 W276 S293 A318 I319 H321	E272-K274 VanDerWaalsContact CD-NZ 3.29Å; E272-K274 WeakPolarHBondContact OE1-CE 3.44Å; E272-K274 IonicContact OE1-NZ 3.2Å; E272-K274 PolarHBondContact OE1-NZ 3.45Å; E272-K274 IonicContact OE2-NZ 2.71Å; K274-W276 VanDerWaalsContact C-CZ3 3.47Å; K274-W276 HydrophobicContact CB-CE3 4.17Å; K274-W276 HydrophobicContact CB-CH2 3.33Å; K274-W276 HydrophobicContact CB-CZ2 4.22Å; K274-W276 HydrophobicContact CB-CZ3 3.27Å; K274-W276 HydrophobicContact CD-CH2 4.09Å; K274-W276 HydrophobicContact CG-CH2 4.31Å; K274-W276 WeakPolarHBondContact O-CZ3 3.07Å; K274-S293 VanDerWaalsContact CA-O 3.22Å; K274-S293 WeakPolarHBondContact CA-O 3.49Å; K274-S293 WeakPolarHBondContact CB-O 3.49Å; K274-S293 VanDerWaalsContact CG-O 3.3Å; K274-S293 WeakPolarHBondContact CG-O 3.29Å; K274-A318 WeakPolarHBondContact O-CA 3.45Å; K274-I319 PolarHBondContact N-O 3.05Å; K274-I319 PolarHBondContact O-N 3.08Å; K274-H321 PolarHBondContact NZ-CD2 2.85Å; K274-H321 PolarHBondContact NZ-NE2 2.97Å
275	Y	95.6	Very high	93.1	Very high	15 Å²	15	59.5 Å²	59.5	6%	0.059	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138.8	-167.3	-54.6	-91.6	0	0	0	113.3	F238 L260 A262 V273 S293 G296 L317 A318	F238-Y275 HydrophobicContact CE1-CD1 4.22Å; F238-Y275 HydrophobicContact CE1-CE1 4.06Å; F238-Y275 HydrophobicContact CZ-CD1 4.46Å; L260-Y275 HydrophobicContact CB-CD1 4.18Å; L260-Y275 HydrophobicContact CB-CE1 3.97Å; L260-Y275 HydrophobicContact CD1-CD1 4.31Å; A262-Y275 HydrophobicContact CB-CE1 3.91Å; A262-Y275 PolarHBondContact N-OH 2.72Å; A262-Y275 PolarHBondContact O-OH 3.12Å; V273-Y275 HydrophobicContact CG1-CE1 4.41Å; V273-Y275 HydrophobicContact CG1-CE2 4.44Å; Y275-S293 PolarHBondContact N-O 2.99Å; Y275-S293 VanDerWaalsContact N-O 3.09Å; Y275-S293 VanDerWaalsContact O-CA 3.31Å; Y275-S293 WeakPolarHBondContact O-CA 3.5Å; Y275-S293 WeakPolarHBondContact O-CB 3.49Å; Y275-G296 VanDerWaalsContact CD2-CA 3.47Å; Y275-L317 WeakPolarHBondContact CA-O 3.48Å; Y275-A318 HydrophobicContact CD1-CB 4.24Å; Y275-A318 HydrophobicContact CE1-CB 4.25Å
276	W	95.1	Very high	93.1	Very high	108 Å²	108	59.8 Å²	59.8	41%	0.409	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	158	176.8	-70.4	-88.1	0	0	0	112.7	K274 S278 I316 L317 I319	K274-W276 VanDerWaalsContact C-CZ3 3.47Å; K274-W276 HydrophobicContact CB-CE3 4.17Å; K274-W276 HydrophobicContact CB-CH2 3.33Å; K274-W276 HydrophobicContact CB-CZ2 4.22Å; K274-W276 HydrophobicContact CB-CZ3 3.27Å; K274-W276 HydrophobicContact CD-CH2 4.09Å; K274-W276 HydrophobicContact CG-CH2 4.31Å; K274-W276 WeakPolarHBondContact O-CZ3 3.07Å; W276-S278 PolarHBondContact O-N 2.76Å; W276-I316 WeakPolarHBondContact O-CG2 3.33Å; W276-L317 HydrophobicContact CB-CD1 4.11Å; W276-L317 HydrophobicContact CB-CG 4.18Å; W276-L317 HydrophobicContact CE3-CD1 3.99Å; W276-L317 PolarHBondContact N-O 3.48Å; W276-L317 PolarHBondContact O-N 2.86Å; W276-I319 HydrophobicContact CE3-CG2 3.66Å; W276-I319 HydrophobicContact CH2-CG2 4.32Å; W276-I319 HydrophobicContact CZ3-CG2 3.31Å
277	F	95.9	Very high	93.1	Very high	43 Å²	43	64.7 Å²	64.7	19%	0.189	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	129.3	164.1	-71.4	-57.9	0	0	0	110.7	T281 Q286 F289 V291 L314 I316	F277-T281 HydrophobicContact CD1-CG2 3.91Å; F277-T281 HydrophobicContact CE1-CG2 4.33Å; F277-T281 HydrophobicContact CG-CG2 4.42Å; F277-Q286 HydrophobicContact CB-CG 4.33Å; F277-Q286 HydrophobicContact CD2-CB 4.25Å; F277-Q286 HydrophobicContact CD2-CG 3.89Å; F277-Q286 HydrophobicContact CE2-CB 4.35Å; F277-Q286 HydrophobicContact CE2-CG 4.35Å; F277-Q286 HydrophobicContact CG-CG 4.08Å; F277-F289 WeakPolarHBondContact CE2-O 3.23Å; F277-F289 HydrophobicContact CZ-CB 3.96Å; F277-V291 HydrophobicContact CD1-CG2 4.05Å; F277-V291 HydrophobicContact CE1-CG2 3.59Å; F277-V291 HydrophobicContact CE2-CG2 4.24Å; F277-V291 HydrophobicContact CZ-CG2 3.7Å; F277-L314 HydrophobicContact CE1-CB 4.4Å; F277-L314 HydrophobicContact CE1-CD1 4.22Å; F277-L314 HydrophobicContact CE1-CD2 4.28Å; F277-I316 HydrophobicContact CD1-CG1 4.14Å; F277-I316 HydrophobicContact CE1-CG1 4.35Å
278	S	93.9	Very high	93.2	Very high	5 Å²	5	61.1 Å²	61.1	4%	0.035	32%	0.319	C	S	.	.			trans	-66.9	153.1	168.9	-177.7	0	0	0	0	110.8	W276 H280 T281 N315	W276-S278 PolarHBondContact O-N 2.76Å; S278-H280 PolarHBondContact O-N 2.71Å; S278-T281 PolarHBondContact O-N 3.26Å; S278-N315 WeakPolarHBondContact CB-O 3.43Å; S278-N315 PolarHBondContact N-O 3.17Å
279	K	89.8	Confident	93.5	Very high	203 Å²	203	58.5 Å²	58.5	88%	0.883	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-15.1	174	-63.5	172.9	-176.5	168.6	0	113.1
280	H	90.3	Very high	93.8	Very high	137 Å²	137	59.8 Å²	59.8	63%	0.634	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.6	175.6	-58	-63.6	0	0	0	114.5	S278 N315	S278-H280 PolarHBondContact O-N 2.71Å; H280-N315 HydrophobicContact CB-CB 4.3Å; H280-N315 PolarHBondContact O-ND2 3.39Å
281	T	94	Very high	94	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.018	29%	0.288	C	S	.	.	S	Bend	trans	-81.6	124	169.4	-69.6	0	0	0	0	109.9	F277 S278 F285 Q286 L314 N315	F277-T281 HydrophobicContact CD1-CG2 3.91Å; F277-T281 HydrophobicContact CE1-CG2 4.33Å; F277-T281 HydrophobicContact CG-CG2 4.42Å; S278-T281 PolarHBondContact O-N 3.26Å; T281-F285 HydrophobicContact CG2-CB 4.15Å; T281-Q286 HydrophobicContact CG2-CG 3.84Å; T281-Q286 PolarHBondContact O-NE2 3.01Å; T281-L314 HydrophobicContact CG2-CD2 4.08Å; T281-N315 WeakPolarHBondContact OG1-CA 3.46Å; T281-N315 WeakPolarHBondContact OG1-CB 3.47Å; T281-N315 PolarHBondContact OG1-N 2.88Å; T281-N315 PolarHBondContact OG1-O 3.07Å
282	P	94.2	Very high	94.2	Very high	51 Å²	51	60.8 Å²	60.8	33%	0.331	29%	0.29	S	S	.	.			trans	-52.6	139.1	179.5	-29	36.1	0	0	0	113.1	E284 F285 Q286	P282-E284 PolarHBondContact O-N 3.48Å; P282-F285 HydrophobicContact CB-CD1 4.44Å; P282-F285 HydrophobicContact CB-CD2 4.04Å; P282-F285 HydrophobicContact CB-CE2 4.33Å; P282-F285 HydrophobicContact CB-CG 4.09Å; P282-F285 HydrophobicContact CG-CD2 3.76Å; P282-F285 HydrophobicContact CG-CE2 3.8Å; P282-F285 HydrophobicContact CG-CG 4.33Å; P282-F285 HydrophobicContact CG-CZ 4.4Å; P282-F285 PolarHBondContact O-N 2.9Å; P282-Q286 PolarHBondContact O-N 2.93Å
283	P	93.1	Very high	94.3	Very high	87 Å²	87	58 Å²	58	57%	0.565	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.7	-175.4	26.8	-35.5	0	0	0	113.1
284	E	93.2	Very high	94.2	Very high	89 Å²	89	64.1 Å²	64.1	42%	0.416	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-42.7	171.7	-57.5	-49.9	120	0	0	111.4	P282 Q286 K287 L288	P282-E284 PolarHBondContact O-N 3.48Å; E284-Q286 VanDerWaalsContact C-N 3.28Å; E284-Q286 PolarHBondContact O-N 3.02Å; E284-K287 VanDerWaalsContact O-CB 3.31Å; E284-K287 WeakPolarHBondContact O-CB 3.24Å; E284-K287 PolarHBondContact O-N 2.85Å; E284-K287 WeakPolarHBondContact OE1-CE 3.04Å; E284-K287 IonicContact OE1-NZ 2.58Å; E284-K287 PolarHBondContact OE1-NZ 2.87Å; E284-K287 WeakPolarHBondContact OE2-CE 3.17Å; E284-K287 IonicContact OE2-NZ 3.06Å; E284-K287 PolarHBondContact OE2-NZ 2.82Å; E284-L288 PolarHBondContact O-N 3.01Å
285	F	94.6	Very high	94.2	Very high	29 Å²	29	65.2 Å²	65.2	13%	0.127	32%	0.317	C	S	.	.	H	α-helix	trans	-68.6	-29.2	179.8	-58.4	-6.6	0	0	0	111.6	T281 P282 K287 L288 F289 E309 Y312 L314	T281-F285 HydrophobicContact CG2-CB 4.15Å; P282-F285 HydrophobicContact CB-CD1 4.44Å; P282-F285 HydrophobicContact CB-CD2 4.04Å; P282-F285 HydrophobicContact CB-CE2 4.33Å; P282-F285 HydrophobicContact CB-CG 4.09Å; P282-F285 HydrophobicContact CG-CD2 3.76Å; P282-F285 HydrophobicContact CG-CE2 3.8Å; P282-F285 HydrophobicContact CG-CG 4.33Å; P282-F285 HydrophobicContact CG-CZ 4.4Å; P282-F285 PolarHBondContact O-N 2.9Å; F285-K287 PolarHBondContact O-N 3.11Å; F285-L288 PolarHBondContact O-N 3.41Å; F285-F289 PolarHBondContact O-N 2.79Å; F285-E309 HydrophobicContact CE1-CG 4.31Å; F285-E309 HydrophobicContact CZ-CG 4.39Å; F285-Y312 AromaticContact CD1-CD1 3.56Å; F285-Y312 HydrophobicContact CD1-CD1 3.56Å; F285-Y312 AromaticContact CD1-CE1 3.94Å; F285-Y312 HydrophobicContact CD1-CE1 3.94Å; F285-Y312 HydrophobicContact CD2-CD1 4.21Å; F285-Y312 AromaticContact CE1-CD1 3.54Å; F285-Y312 HydrophobicContact CE1-CD1 3.54Å; F285-Y312 AromaticContact CE1-CE1 3.85Å; F285-Y312 HydrophobicContact CE1-CE1 3.85Å; F285-Y312 HydrophobicContact CE2-CD1 4.19Å; F285-Y312 AromaticContact CG-CD1 3.92Å; F285-Y312 HydrophobicContact CG-CD1 3.92Å; F285-Y312 AromaticContact CZ-CD1 3.87Å; F285-Y312 HydrophobicContact CZ-CD1 3.87Å; F285-L314 HydrophobicContact CB-CD2 3.81Å; F285-L314 HydrophobicContact CD2-CD2 4.26Å; F285-L314 HydrophobicContact CG-CD2 4.47Å
286	Q	93.3	Very high	94.1	Very high	74 Å²	74	64.5 Å²	64.5	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-69.8	-10.4	172	-56.5	-176.9	31	0	0	113.9	F277 T281 P282 E284	F277-Q286 HydrophobicContact CB-CG 4.33Å; F277-Q286 HydrophobicContact CD2-CB 4.25Å; F277-Q286 HydrophobicContact CD2-CG 3.89Å; F277-Q286 HydrophobicContact CE2-CB 4.35Å; F277-Q286 HydrophobicContact CE2-CG 4.35Å; F277-Q286 HydrophobicContact CG-CG 4.08Å; T281-Q286 HydrophobicContact CG2-CG 3.84Å; T281-Q286 PolarHBondContact O-NE2 3.01Å; P282-Q286 PolarHBondContact O-N 2.93Å; E284-Q286 VanDerWaalsContact C-N 3.28Å; E284-Q286 PolarHBondContact O-N 3.02Å
287	K	94.1	Very high	94.1	Very high	111 Å²	111	61.9 Å²	61.9	48%	0.483	31%	0.307	S	S	.	.	H	α-helix	trans	-86.8	-39.6	168.7	-56.6	169.1	-162.3	172.2	0	111	E284 F285	E284-K287 VanDerWaalsContact O-CB 3.31Å; E284-K287 WeakPolarHBondContact O-CB 3.24Å; E284-K287 PolarHBondContact O-N 2.85Å; E284-K287 WeakPolarHBondContact OE1-CE 3.04Å; E284-K287 IonicContact OE1-NZ 2.58Å; E284-K287 PolarHBondContact OE1-NZ 2.87Å; E284-K287 WeakPolarHBondContact OE2-CE 3.17Å; E284-K287 IonicContact OE2-NZ 3.06Å; E284-K287 PolarHBondContact OE2-NZ 2.82Å; F285-K287 PolarHBondContact O-N 3.11Å
288	L	95.5	Very high	94.2	Very high	33 Å²	33	59.9 Å²	59.9	17%	0.173	30%	0.298	C	S	.	.	H	α-helix	trans	-74.2	-33.6	-177.4	-58.9	-179.2	0	0	0	113.3	E284 F285 K301 A302 L304 Y312	E284-L288 PolarHBondContact O-N 3.01Å; F285-L288 PolarHBondContact O-N 3.41Å; L288-K301 WeakPolarHBondContact O-CA 3.06Å; L288-K301 WeakPolarHBondContact O-CB 3.02Å; L288-K301 PolarHBondContact O-N 2.88Å; L288-A302 HydrophobicContact CD2-CB 4.04Å; L288-A302 PolarHBondContact O-N 2.91Å; L288-L304 HydrophobicContact CB-CD2 4.07Å; L288-L304 HydrophobicContact CD1-CD2 4.31Å; L288-Y312 HydrophobicContact CD1-CD1 4.14Å; L288-Y312 HydrophobicContact CD1-CE1 3.33Å
289	F	96.9	Very high	94.3	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	157.3	-176.4	-57.7	-78.8	0	0	0	112.7	I257 F277 F285 I299 V300 L304 Y312 L314 I334	I257-F289 HydrophobicContact CD1-CD1 3.94Å; I257-F289 HydrophobicContact CD1-CE1 3.76Å; F277-F289 WeakPolarHBondContact CE2-O 3.23Å; F277-F289 HydrophobicContact CZ-CB 3.96Å; F285-F289 PolarHBondContact O-N 2.79Å; F289-I299 CarbonylContact C-O 3.44Å; F289-I299 WeakPolarHBondContact CA-O 3.42Å; F289-V300 HydrophobicContact CD1-CG2 4.49Å; F289-V300 HydrophobicContact CE1-CG2 4.27Å; F289-L304 HydrophobicContact CE1-CD1 3.99Å; F289-L304 HydrophobicContact CE1-CD2 4.05Å; F289-L304 HydrophobicContact CE2-CD2 4.2Å; F289-L304 HydrophobicContact CZ-CD1 4.01Å; F289-L304 HydrophobicContact CZ-CD2 3.61Å; F289-L304 HydrophobicContact CZ-CG 4.5Å; F289-Y312 AromaticContact CE2-CD1 3.86Å; F289-Y312 HydrophobicContact CE2-CD1 3.86Å; F289-Y312 HydrophobicContact CE2-CD2 4.09Å; F289-Y312 HydrophobicContact CE2-CE1 4.38Å; F289-Y312 AromaticContact CE2-CG 3.72Å; F289-Y312 HydrophobicContact CE2-CG 3.72Å; F289-Y312 HydrophobicContact CZ-CD2 4.03Å; F289-Y312 HydrophobicContact CZ-CE2 4.47Å; F289-Y312 HydrophobicContact CZ-CG 4.12Å; F289-L314 HydrophobicContact CB-CD1 4.01Å; F289-L314 HydrophobicContact CD1-CD1 4.42Å; F289-L314 HydrophobicContact CD2-CD1 3.95Å; F289-L314 HydrophobicContact CD2-CD2 3.88Å; F289-L314 HydrophobicContact CD2-CG 4.47Å; F289-L314 HydrophobicContact CE2-CD2 4.45Å; F289-L314 HydrophobicContact CG-CD1 3.86Å; F289-I334 HydrophobicContact CD1-CD1 4.04Å; F289-I334 HydrophobicContact CE1-CD1 3.57Å; F289-I334 HydrophobicContact CE2-CD1 4.09Å; F289-I334 HydrophobicContact CG-CD1 4.49Å; F289-I334 HydrophobicContact CZ-CD1 3.6Å
290	H	95.6	Very high	94.7	Very high	79 Å²	79	51.8 Å²	51.8	37%	0.366	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.9	170.5	-178.8	-96.4	0	0	0	109.2	V298 I299 K301	H290-V298 CarbonylContact O-C 3.42Å; H290-V298 WeakPolarHBondContact O-CA 3.46Å; H290-I299 HydrophobicContact CB-CB 4.36Å; H290-I299 PolarHBondContact N-O 2.73Å; H290-I299 PolarHBondContact O-N 3.13Å; H290-K301 HydrophobicContact CB-CB 4.49Å; H290-K301 HydrophobicContact CB-CD 4.37Å
291	V	96.7	Very high	94.9	Very high	13 Å²	13	50.8 Å²	50.8	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.2	168	-178	0	0	0	0	106.6	L260 F277 S293 E297 V298 I316	L260-V291 HydrophobicContact CD1-CG1 4.45Å; F277-V291 HydrophobicContact CD1-CG2 4.05Å; F277-V291 HydrophobicContact CE1-CG2 3.59Å; F277-V291 HydrophobicContact CE2-CG2 4.24Å; F277-V291 HydrophobicContact CZ-CG2 3.7Å; V291-S293 PolarHBondContact O-N 3.46Å; V291-E297 WeakPolarHBondContact CA-O 3.28Å; V291-V298 HydrophobicContact CG2-CG1 4.49Å; V291-V298 HydrophobicContact CG2-CG2 4.28Å; V291-I316 HydrophobicContact CG1-CG2 4.27Å; V291-I316 HydrophobicContact CG2-CD1 3.79Å; V291-I316 HydrophobicContact CG2-CG1 4.22Å; V291-I316 HydrophobicContact CG2-CG2 4.37Å
292	D	96	Very high	95	Very high	49 Å²	49	51.9 Å²	51.9	26%	0.262	27%	0.267	S	S	.	.			trans	-70.3	126.5	171.4	-171	-78.9	0	0	0	110.1	Q294 T295 G296 E297	D292-Q294 VanDerWaalsContact C-N 3.27Å; D292-Q294 PolarHBondContact O-N 3.12Å; D292-Q294 WeakPolarHBondContact OD1-CA 2.98Å; D292-Q294 PolarHBondContact OD1-N 2.89Å; D292-T295 WeakPolarHBondContact CB-OG1 3.31Å; D292-T295 PolarHBondContact OD1-N 3.27Å; D292-T295 PolarHBondContact OD1-OG1 2.72Å; D292-G296 PolarHBondContact O-N 3.44Å; D292-G296 VanDerWaalsContact O-N 3.14Å; D292-E297 HydrophobicContact CB-CB 4.49Å; D292-E297 PolarHBondContact N-O 2.72Å
293	S	94.8	Very high	95	Very high	41 Å²	41	54 Å²	54	29%	0.287	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-13.5	-172.7	59.8	0	0	0	0	114.2	K274 Y275 V291	K274-S293 VanDerWaalsContact CA-O 3.22Å; K274-S293 WeakPolarHBondContact CA-O 3.49Å; K274-S293 WeakPolarHBondContact CB-O 3.49Å; K274-S293 VanDerWaalsContact CG-O 3.3Å; K274-S293 WeakPolarHBondContact CG-O 3.29Å; Y275-S293 PolarHBondContact N-O 2.99Å; Y275-S293 VanDerWaalsContact N-O 3.09Å; Y275-S293 VanDerWaalsContact O-CA 3.31Å; Y275-S293 WeakPolarHBondContact O-CA 3.5Å; Y275-S293 WeakPolarHBondContact O-CB 3.49Å; V291-S293 PolarHBondContact O-N 3.46Å
294	Q	92.1	Very high	95.2	Very high	150 Å²	150	50.4 Å²	50.4	70%	0.701	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-41.9	178.6	-59.6	179.8	20.8	0	0	111.9	D292	D292-Q294 VanDerWaalsContact C-N 3.27Å; D292-Q294 PolarHBondContact O-N 3.12Å; D292-Q294 WeakPolarHBondContact OD1-CA 2.98Å; D292-Q294 PolarHBondContact OD1-N 2.89Å
295	T	93.9	Very high	95.3	Very high	49 Å²	49	49 Å²	49	30%	0.301	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-13	-174.9	72.8	0	0	0	0	114.1	K259 D292 E297	K259-T295 WeakPolarHBondContact CE-O 3.2Å; K259-T295 PolarHBondContact NZ-O 2.88Å; D292-T295 WeakPolarHBondContact CB-OG1 3.31Å; D292-T295 PolarHBondContact OD1-N 3.27Å; D292-T295 PolarHBondContact OD1-OG1 2.72Å; T295-E297 PolarHBondContact O-N 3.23Å; T295-E297 VanDerWaalsContact OG1-CB 3.29Å; T295-E297 WeakPolarHBondContact OG1-CB 3.48Å; T295-E297 VanDerWaalsContact OG1-CG 3.31Å; T295-E297 WeakPolarHBondContact OG1-CG 3.37Å; T295-E297 PolarHBondContact OG1-N 3.33Å; T295-E297 PolarHBondContact OG1-OE2 3.12Å
296	G	93.3	Very high	95.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.257	C	S	.	.			trans	70.7	9.9	-174.5	0	0	0	0	0	113.8	L260 Y275 D292	L260-G296 WeakPolarHBondContact CB-O 3.25Å; L260-G296 PolarHBondContact N-O 3.02Å; Y275-G296 VanDerWaalsContact CD2-CA 3.47Å; D292-G296 PolarHBondContact O-N 3.44Å; D292-G296 VanDerWaalsContact O-N 3.14Å
297	E	96.3	Very high	95.4	Very high	54 Å²	54	49.7 Å²	49.7	25%	0.252	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.8	-174.7	-73.5	159.9	-177	0	0	111.3	T256 K259 V291 D292 T295	T256-E297 HydrophobicContact CG2-CB 3.75Å; T256-E297 HydrophobicContact CG2-CG 3.94Å; K259-E297 HydrophobicContact CB-CG 4.14Å; K259-E297 HydrophobicContact CD-CG 3.94Å; K259-E297 HydrophobicContact CG-CG 3.88Å; K259-E297 IonicContact NZ-OE1 3.16Å; K259-E297 PolarHBondContact NZ-OE1 3.25Å; V291-E297 WeakPolarHBondContact CA-O 3.28Å; D292-E297 HydrophobicContact CB-CB 4.49Å; D292-E297 PolarHBondContact N-O 2.72Å; T295-E297 PolarHBondContact O-N 3.23Å; T295-E297 VanDerWaalsContact OG1-CB 3.29Å; T295-E297 WeakPolarHBondContact OG1-CB 3.48Å; T295-E297 VanDerWaalsContact OG1-CG 3.31Å; T295-E297 WeakPolarHBondContact OG1-CG 3.37Å; T295-E297 PolarHBondContact OG1-N 3.33Å; T295-E297 PolarHBondContact OG1-OE2 3.12Å
298	V	96.6	Very high	95.4	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.5	178.4	-170.6	0	0	0	0	108.5	T256 I257 F258 L260 H290 V291 L314 I316 L332	T256-V298 CarbonylContact C-O 3.57Å; T256-V298 WeakPolarHBondContact CA-O 3.25Å; I257-V298 HydrophobicContact CD1-CG1 4.23Å; I257-V298 HydrophobicContact CG1-CB 4.24Å; I257-V298 HydrophobicContact CG1-CG1 4.16Å; I257-V298 WeakPolarHBondContact CG1-O 3.41Å; I257-V298 PolarHBondContact N-O 2.9Å; F258-V298 HydrophobicContact CB-CB 4.41Å; F258-V298 HydrophobicContact CB-CG2 4.45Å; F258-V298 PolarHBondContact O-N 3.38Å; L260-V298 HydrophobicContact CD1-CG2 4.02Å; L260-V298 HydrophobicContact CG-CG2 4.21Å; H290-V298 CarbonylContact O-C 3.42Å; H290-V298 WeakPolarHBondContact O-CA 3.46Å; V291-V298 HydrophobicContact CG2-CG1 4.49Å; V291-V298 HydrophobicContact CG2-CG2 4.28Å; V298-L314 HydrophobicContact CG1-CD1 4.06Å; V298-I316 HydrophobicContact CG2-CD1 4.03Å; V298-L332 HydrophobicContact CB-CD2 4.13Å; V298-L332 HydrophobicContact CG1-CD2 3.98Å; V298-L332 HydrophobicContact CG2-CD2 3.8Å
299	I	96.2	Very high	95.3	Very high	38 Å²	38	54.9 Å²	54.9	20%	0.195	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.8	-166.6	-52.8	175.7	0	0	0	110.1	T255 F289 H290 K301	T255-I299 WeakPolarHBondContact O-CA 3.33Å; F289-I299 CarbonylContact C-O 3.44Å; F289-I299 WeakPolarHBondContact CA-O 3.42Å; H290-I299 HydrophobicContact CB-CB 4.36Å; H290-I299 PolarHBondContact N-O 2.73Å; H290-I299 PolarHBondContact O-N 3.13Å; I299-K301 PolarHBondContact O-N 2.62Å
300	V	97.3	Very high	95.2	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.6	172.5	-179.9	0	0	0	0	109.8	L247 T251 G254 T255 I257 F289 A302 L304	L247-V300 HydrophobicContact CD2-CG2 4.12Å; T251-V300 HydrophobicContact CG2-CG2 3.94Å; G254-V300 PolarHBondContact N-O 2.81Å; T255-V300 PolarHBondContact O-N 2.89Å; I257-V300 HydrophobicContact CD1-CG2 4.48Å; I257-V300 HydrophobicContact CG2-CG2 3.63Å; F289-V300 HydrophobicContact CD1-CG2 4.49Å; F289-V300 HydrophobicContact CE1-CG2 4.27Å; V300-A302 WeakPolarHBondContact CG1-O 3.4Å; V300-L304 HydrophobicContact CG1-CD1 4.26Å; V300-L304 HydrophobicContact CG1-CG 4.23Å; V300-L304 HydrophobicContact CG2-CD1 4.17Å
301	K	96.1	Very high	95.2	Very high	115 Å²	115	56.5 Å²	56.5	50%	0.5	29%	0.289	S	S	.	.			trans	-113.1	-23	-172.5	-178.2	178.4	171.3	-174	0	113.6	I253 L288 H290 I299	I253-K301 WeakPolarHBondContact CG2-O 3.39Å; L288-K301 WeakPolarHBondContact O-CA 3.06Å; L288-K301 WeakPolarHBondContact O-CB 3.02Å; L288-K301 PolarHBondContact O-N 2.88Å; H290-K301 HydrophobicContact CB-CB 4.49Å; H290-K301 HydrophobicContact CB-CD 4.37Å; I299-K301 PolarHBondContact O-N 2.62Å
302	A	95.4	Very high	95.2	Very high	26 Å²	26	56.2 Å²	56.2	22%	0.215	29%	0.287	C	S	.	.	S	Bend	trans	-141.1	167.2	173.5	0	0	0	0	0	109.5	L288 V300	L288-A302 HydrophobicContact CD2-CB 4.04Å; L288-A302 PolarHBondContact O-N 2.91Å; V300-A302 WeakPolarHBondContact CG1-O 3.4Å
303	P	95.1	Very high	95.2	Very high	95 Å²	95	56.2 Å²	56.2	62%	0.617	29%	0.289	S	S	*	.			trans	-57.2	149.5	175.8	-22.2	34.8	0	0	0	111.8	I253	I253-P303 HydrophobicContact CD1-CG 4.19Å
304	L	95.6	Very high	95.2	Very high	13 Å²	13	54.2 Å²	54.2	7%	0.068	28%	0.275	C	S	.	.			trans	-108.2	159.4	173.6	-52	176	0	0	0	108.6	L247 E249 L288 F289 V300 L336	L247-L304 HydrophobicContact CD2-CD1 3.49Å; L247-L304 VanDerWaalsContact CD2-CD1 3.49Å; L247-L304 HydrophobicContact CG-CD1 4.45Å; E249-L304 HydrophobicContact CB-CB 4.41Å; L288-L304 HydrophobicContact CB-CD2 4.07Å; L288-L304 HydrophobicContact CD1-CD2 4.31Å; F289-L304 HydrophobicContact CE1-CD1 3.99Å; F289-L304 HydrophobicContact CE1-CD2 4.05Å; F289-L304 HydrophobicContact CE2-CD2 4.2Å; F289-L304 HydrophobicContact CZ-CD1 4.01Å; F289-L304 HydrophobicContact CZ-CD2 3.61Å; F289-L304 HydrophobicContact CZ-CG 4.5Å; V300-L304 HydrophobicContact CG1-CD1 4.26Å; V300-L304 HydrophobicContact CG1-CG 4.23Å; V300-L304 HydrophobicContact CG2-CD1 4.17Å; L304-L336 HydrophobicContact CB-CD1 4.18Å; L304-L336 HydrophobicContact CB-CD2 4.15Å; L304-L336 HydrophobicContact CD1-CD2 3.95Å
305	D	95.1	Very high	95.4	Very high	59 Å²	59	48.6 Å²	48.6	32%	0.316	25%	0.25	S	C	.	.			trans	-156.1	108.4	-159.4	165.9	-7.2	0	0	0	106.3	R308 E309	D305-R308 HydrophobicContact CB-CB 4.3Å; D305-R308 WeakPolarHBondContact OD1-CB 3.37Å; D305-R308 PolarHBondContact OD1-N 3.27Å; D305-R308 VanDerWaalsContact OD2-CB 3.22Å; D305-R308 WeakPolarHBondContact OD2-CB 3.11Å; D305-R308 VanDerWaalsContact OD2-CD 3.23Å; D305-R308 WeakPolarHBondContact OD2-CD 3.4Å; D305-E309 PolarHBondContact O-N 2.67Å
306	Y	95.8	Very high	95.5	Very high	59 Å²	59	46.3 Å²	46.3	23%	0.231	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-43.8	-173.4	178.1	-79.3	0	0	0	111.2	E249 R308 E309 P310 L336 D338	E249-Y306 WeakPolarHBondContact OE1-CB 3.45Å; E249-Y306 WeakPolarHBondContact OE2-CB 3.38Å; E249-Y306 PolarHBondContact OE2-N 3.17Å; Y306-R308 PolarHBondContact O-N 3.43Å; Y306-E309 CarbonylContact O-C 3.54Å; Y306-E309 PolarHBondContact O-N 2.99Å; Y306-P310 HydrophobicContact CD1-CB 4.32Å; Y306-P310 HydrophobicContact CD2-CB 3.78Å; Y306-P310 HydrophobicContact CE1-CB 4.21Å; Y306-P310 HydrophobicContact CE2-CB 3.63Å; Y306-P310 HydrophobicContact CG-CB 4.11Å; Y306-P310 WeakPolarHBondContact O-CD 3.17Å; Y306-L336 HydrophobicContact CD2-CB 3.66Å; Y306-L336 HydrophobicContact CG-CB 4.47Å; Y306-D338 HydrophobicContact CD1-CB 4.03Å; Y306-D338 HydrophobicContact CD2-CB 3.89Å; Y306-D338 HydrophobicContact CE1-CB 4.03Å; Y306-D338 HydrophobicContact CE2-CB 3.9Å; Y306-D338 HydrophobicContact CG-CB 3.98Å
307	E	95.1	Very high	95.5	Very high	58 Å²	58	47.7 Å²	47.7	27%	0.271	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.4	179.9	-75.8	52.5	-114	0	0	111.6	H342 A378	E307-H342 IonicContact OE2-CE1 3.13Å; E307-H342 IonicContact OE2-ND1 2.82Å; E307-A378 HydrophobicContact CG-CB 3.75Å
308	R	93.5	Very high	95.5	Very high	182 Å²	182	45.1 Å²	45.1	69%	0.687	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-44.3	176.6	-177.1	179.2	174.5	-176.7	-3.4	114.6	D305 Y306	D305-R308 HydrophobicContact CB-CB 4.3Å; D305-R308 WeakPolarHBondContact OD1-CB 3.37Å; D305-R308 PolarHBondContact OD1-N 3.27Å; D305-R308 VanDerWaalsContact OD2-CB 3.22Å; D305-R308 WeakPolarHBondContact OD2-CB 3.11Å; D305-R308 VanDerWaalsContact OD2-CD 3.23Å; D305-R308 WeakPolarHBondContact OD2-CD 3.4Å; Y306-R308 PolarHBondContact O-N 3.43Å
309	E	94.2	Very high	95.4	Very high	72 Å²	72	46.6 Å²	46.6	34%	0.336	24%	0.239	S	C	.	.			trans	-156.2	92.5	-176.3	-176.2	70.6	-87.4	0	0	110.8	F285 D305 Y306 S311 Y312	F285-E309 HydrophobicContact CE1-CG 4.31Å; F285-E309 HydrophobicContact CZ-CG 4.39Å; D305-E309 PolarHBondContact O-N 2.67Å; Y306-E309 CarbonylContact O-C 3.54Å; Y306-E309 PolarHBondContact O-N 2.99Å; E309-S311 PolarHBondContact O-N 3.32Å; E309-Y312 HydrophobicContact CB-CE1 4.07Å; E309-Y312 HydrophobicContact CG-CD1 4.09Å; E309-Y312 HydrophobicContact CG-CE1 3.64Å; E309-Y312 HydrophobicContact CG-CE2 4.45Å; E309-Y312 VanDerWaalsContact O-CE2 3.29Å; E309-Y312 WeakPolarHBondContact O-CE2 3.34Å; E309-Y312 PolarHBondContact O-OH 2.87Å
310	P	95.1	Very high	95.3	Very high	55 Å²	55	45.1 Å²	45.1	36%	0.357	23%	0.231	S	C	.	.	S	Bend	trans	-76.2	-3.4	-173.3	30.8	-36.2	0	0	0	113.6	Y306 L336	Y306-P310 HydrophobicContact CD1-CB 4.32Å; Y306-P310 HydrophobicContact CD2-CB 3.78Å; Y306-P310 HydrophobicContact CE1-CB 4.21Å; Y306-P310 HydrophobicContact CE2-CB 3.63Å; Y306-P310 HydrophobicContact CG-CB 4.11Å; Y306-P310 WeakPolarHBondContact O-CD 3.17Å; P310-L336 PolarHBondContact O-N 2.84Å
311	S	95.7	Very high	95	Very high	57 Å²	57	49.7 Å²	49.7	40%	0.399	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	138.7	174.3	70.3	0	0	0	0	114.2	E309 I334	E309-S311 PolarHBondContact O-N 3.32Å; S311-I334 CarbonylContact C-O 3.56Å; S311-I334 VanDerWaalsContact CA-O 3.22Å; S311-I334 WeakPolarHBondContact CA-O 3.14Å; S311-I334 WeakPolarHBondContact CB-O 2.96Å
312	Y	95.6	Very high	94.6	Very high	7 Å²	7	44.7 Å²	44.7	3%	0.027	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	144.7	179.2	-54.1	-92.9	0	0	0	110.5	F285 L288 F289 E309 I334 L336	F285-Y312 AromaticContact CD1-CD1 3.56Å; F285-Y312 HydrophobicContact CD1-CD1 3.56Å; F285-Y312 AromaticContact CD1-CE1 3.94Å; F285-Y312 HydrophobicContact CD1-CE1 3.94Å; F285-Y312 HydrophobicContact CD2-CD1 4.21Å; F285-Y312 AromaticContact CE1-CD1 3.54Å; F285-Y312 HydrophobicContact CE1-CD1 3.54Å; F285-Y312 AromaticContact CE1-CE1 3.85Å; F285-Y312 HydrophobicContact CE1-CE1 3.85Å; F285-Y312 HydrophobicContact CE2-CD1 4.19Å; F285-Y312 AromaticContact CG-CD1 3.92Å; F285-Y312 HydrophobicContact CG-CD1 3.92Å; F285-Y312 AromaticContact CZ-CD1 3.87Å; F285-Y312 HydrophobicContact CZ-CD1 3.87Å; L288-Y312 HydrophobicContact CD1-CD1 4.14Å; L288-Y312 HydrophobicContact CD1-CE1 3.33Å; F289-Y312 AromaticContact CE2-CD1 3.86Å; F289-Y312 HydrophobicContact CE2-CD1 3.86Å; F289-Y312 HydrophobicContact CE2-CD2 4.09Å; F289-Y312 HydrophobicContact CE2-CE1 4.38Å; F289-Y312 AromaticContact CE2-CG 3.72Å; F289-Y312 HydrophobicContact CE2-CG 3.72Å; F289-Y312 HydrophobicContact CZ-CD2 4.03Å; F289-Y312 HydrophobicContact CZ-CE2 4.47Å; F289-Y312 HydrophobicContact CZ-CG 4.12Å; E309-Y312 HydrophobicContact CB-CE1 4.07Å; E309-Y312 HydrophobicContact CG-CD1 4.09Å; E309-Y312 HydrophobicContact CG-CE1 3.64Å; E309-Y312 HydrophobicContact CG-CE2 4.45Å; E309-Y312 VanDerWaalsContact O-CE2 3.29Å; E309-Y312 WeakPolarHBondContact O-CE2 3.34Å; E309-Y312 PolarHBondContact O-OH 2.87Å; Y312-I334 PolarHBondContact N-O 2.85Å; Y312-I334 PolarHBondContact O-N 2.86Å; Y312-L336 HydrophobicContact CD2-CG 4.47Å; Y312-L336 HydrophobicContact CE2-CD1 3.78Å; Y312-L336 HydrophobicContact CE2-CD2 4.25Å; Y312-L336 HydrophobicContact CE2-CG 3.87Å
313	V	95.8	Very high	94.1	Very high	49 Å²	49	47.5 Å²	47.5	30%	0.297	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	105.5	172.6	-173.1	0	0	0	0	108.5	K331	V313-K331 HydrophobicContact CG1-CB 4.47Å
314	L	96.1	Very high	93.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	109.7	179.2	-53.5	-178.6	0	0	0	108.6	F277 T281 F285 F289 V298 I316 L332 I334	F277-L314 HydrophobicContact CE1-CB 4.4Å; F277-L314 HydrophobicContact CE1-CD1 4.22Å; F277-L314 HydrophobicContact CE1-CD2 4.28Å; T281-L314 HydrophobicContact CG2-CD2 4.08Å; F285-L314 HydrophobicContact CB-CD2 3.81Å; F285-L314 HydrophobicContact CD2-CD2 4.26Å; F285-L314 HydrophobicContact CG-CD2 4.47Å; F289-L314 HydrophobicContact CB-CD1 4.01Å; F289-L314 HydrophobicContact CD1-CD1 4.42Å; F289-L314 HydrophobicContact CD2-CD1 3.95Å; F289-L314 HydrophobicContact CD2-CD2 3.88Å; F289-L314 HydrophobicContact CD2-CG 4.47Å; F289-L314 HydrophobicContact CE2-CD2 4.45Å; F289-L314 HydrophobicContact CG-CD1 3.86Å; V298-L314 HydrophobicContact CG1-CD1 4.06Å; L314-I316 HydrophobicContact CB-CD1 3.93Å; L314-I316 HydrophobicContact CB-CG1 3.98Å; L314-I316 PolarHBondContact O-N 2.78Å; L314-L332 HydrophobicContact CB-CB 4.37Å; L314-L332 HydrophobicContact CD1-CD2 4.4Å; L314-L332 PolarHBondContact N-O 3.18Å; L314-L332 PolarHBondContact O-N 2.78Å; L314-I334 HydrophobicContact CD1-CD1 3.58Å; L314-I334 HydrophobicContact CG-CD1 4.16Å
315	N	95.5	Very high	93.4	Very high	32 Å²	32	51 Å²	51	17%	0.171	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	101.6	170.1	-60.3	-75	0	0	0	107.5	S278 H280 T281 K331	S278-N315 WeakPolarHBondContact CB-O 3.43Å; S278-N315 PolarHBondContact N-O 3.17Å; H280-N315 HydrophobicContact CB-CB 4.3Å; H280-N315 PolarHBondContact O-ND2 3.39Å; T281-N315 WeakPolarHBondContact OG1-CA 3.46Å; T281-N315 WeakPolarHBondContact OG1-CB 3.47Å; T281-N315 PolarHBondContact OG1-N 2.88Å; T281-N315 PolarHBondContact OG1-O 3.07Å; N315-K331 WeakPolarHBondContact OD1-CE 3.49Å
316	I	95.6	Very high	93	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.5	-176.3	-57.2	171.4	0	0	0	107.7	L260 W276 F277 V291 V298 L314 H329 C330 L332	L260-I316 HydrophobicContact CD1-CB 4.12Å; L260-I316 HydrophobicContact CD1-CD1 3.76Å; L260-I316 HydrophobicContact CD1-CG2 3.54Å; W276-I316 WeakPolarHBondContact O-CG2 3.33Å; F277-I316 HydrophobicContact CD1-CG1 4.14Å; F277-I316 HydrophobicContact CE1-CG1 4.35Å; V291-I316 HydrophobicContact CG1-CG2 4.27Å; V291-I316 HydrophobicContact CG2-CD1 3.79Å; V291-I316 HydrophobicContact CG2-CG1 4.22Å; V291-I316 HydrophobicContact CG2-CG2 4.37Å; V298-I316 HydrophobicContact CG2-CD1 4.03Å; L314-I316 HydrophobicContact CB-CD1 3.93Å; L314-I316 HydrophobicContact CB-CG1 3.98Å; L314-I316 PolarHBondContact O-N 2.78Å; I316-H329 WeakPolarHBondContact O-CA 3.22Å; I316-C330 PolarHBondContact N-O 3.03Å; I316-C330 PolarHBondContact O-N 3.2Å; I316-L332 HydrophobicContact CD1-CB 4.26Å; I316-L332 HydrophobicContact CD1-CD2 4.33Å
317	L	94.8	Very high	92.7	Very high	29 Å²	29	54 Å²	54	15%	0.152	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	146.6	175.5	74.4	80.5	0	0	0	110.9	Y275 W276 I319 P327 T328 H329	Y275-L317 WeakPolarHBondContact CA-O 3.48Å; W276-L317 HydrophobicContact CB-CD1 4.11Å; W276-L317 HydrophobicContact CB-CG 4.18Å; W276-L317 HydrophobicContact CE3-CD1 3.99Å; W276-L317 PolarHBondContact N-O 3.48Å; W276-L317 PolarHBondContact O-N 2.86Å; L317-I319 HydrophobicContact CD1-CB 4.05Å; L317-I319 HydrophobicContact CD1-CG2 3.68Å; L317-P327 HydrophobicContact CD1-CB 4.39Å; L317-P327 HydrophobicContact CD2-CB 4.48Å; L317-T328 WeakPolarHBondContact CA-O 3.43Å; L317-T328 WeakPolarHBondContact CB-O 3.4Å; L317-H329 VanDerWaalsContact CB-ND1 3.32Å; L317-H329 WeakPolarHBondContact CB-ND1 3.05Å
318	A	95.4	Very high	92.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140.3	161.2	0	0	0	0	0	107.1	P236 F238 A262 V273 K274 Y275 P327 T328	P236-A318 HydrophobicContact CB-CB 3.9Å; F238-A318 HydrophobicContact CD2-CB 4.35Å; F238-A318 HydrophobicContact CE1-CB 4.22Å; F238-A318 HydrophobicContact CE2-CB 3.53Å; F238-A318 HydrophobicContact CZ-CB 3.45Å; F238-A318 VanDerWaalsContact CZ-CB 3.45Å; A262-A318 HydrophobicContact CB-CB 3.79Å; V273-A318 HydrophobicContact CG1-CB 3.78Å; K274-A318 WeakPolarHBondContact O-CA 3.45Å; Y275-A318 HydrophobicContact CD1-CB 4.24Å; Y275-A318 HydrophobicContact CE1-CB 4.25Å; A318-P327 CarbonylContact O-C 3.41Å; A318-P327 WeakPolarHBondContact O-CA 3.46Å; A318-T328 PolarHBondContact N-O 3.37Å; A318-T328 VanDerWaalsContact N-O 3.16Å; A318-T328 PolarHBondContact O-N 2.87Å
319	I	94.1	Very high	92.6	Very high	32 Å²	32	48.9 Å²	48.9	16%	0.164	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	141.7	173	-170.4	175	0	0	0	108.1	K274 W276 L317 S325 P327	K274-I319 PolarHBondContact N-O 3.05Å; K274-I319 PolarHBondContact O-N 3.08Å; W276-I319 HydrophobicContact CE3-CG2 3.66Å; W276-I319 HydrophobicContact CH2-CG2 4.32Å; W276-I319 HydrophobicContact CZ3-CG2 3.31Å; L317-I319 HydrophobicContact CD1-CB 4.05Å; L317-I319 HydrophobicContact CD1-CG2 3.68Å; I319-S325 WeakPolarHBondContact CD1-OG 2.98Å; I319-P327 HydrophobicContact CB-CB 4.14Å; I319-P327 HydrophobicContact CD1-CB 4.06Å; I319-P327 HydrophobicContact CD1-CG 4.35Å; I319-P327 HydrophobicContact CG1-CB 4.28Å
320	D	94.7	Very high	92.6	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.032	26%	0.256	C	S	.	.			trans	-70.2	179.5	174.9	58.8	96.4	0	0	0	112.4	N232 P236 N270 G322 S325 M326	N232-D320 PolarHBondContact ND2-OD1 3.41Å; N232-D320 PolarHBondContact OD1-OD1 3.12Å; P236-D320 HydrophobicContact CG-CB 4.13Å; N270-D320 WeakPolarHBondContact O-CB 3.19Å; D320-G322 WeakPolarHBondContact OD1-CA 3.2Å; D320-G322 PolarHBondContact OD1-N 2.86Å; D320-S325 VanDerWaalsContact OD1-CA 3.28Å; D320-S325 WeakPolarHBondContact OD1-CA 3.25Å; D320-S325 WeakPolarHBondContact OD1-CB 3.27Å; D320-S325 VanDerWaalsContact OD2-CA 3.27Å; D320-S325 WeakPolarHBondContact OD2-CA 3.37Å; D320-S325 WeakPolarHBondContact OD2-CB 3.4Å; D320-M326 PolarHBondContact OD2-N 2.81Å
321	H	90.1	Very high	92.6	Very high	97 Å²	97	48 Å²	48	45%	0.449	26%	0.262	S	S	.	.	S	Bend	trans	-107.3	8.1	175.5	-102.7	-95.1	0	0	0	113.9	A269 E272 K274	A269-H321 HydrophobicContact CB-CB 4.39Å; A269-H321 CarbonylContact O-C 3.48Å; A269-H321 VanDerWaalsContact O-CA 3.28Å; A269-H321 WeakPolarHBondContact O-CA 3.35Å; A269-H321 WeakPolarHBondContact O-CB 3.4Å; A269-H321 PolarHBondContact O-N 2.82Å; A269-H321 VanDerWaalsContact O-N 3.09Å; E272-H321 HydrophobicContact CB-CB 4.4Å; K274-H321 PolarHBondContact NZ-CD2 2.85Å; K274-H321 PolarHBondContact NZ-NE2 2.97Å
322	G	88.1	Confident	92.7	Very high	10 Å²	10	45.2 Å²	45.2	10%	0.103	24%	0.243	C	C	.	.	S	Bend	trans	-81.2	170.9	-177.6	0	0	0	0	0	114.7	A269 N270 D320 S325	A269-G322 PolarHBondContact O-N 2.86Å; N270-G322 WeakPolarHBondContact OD1-CA 3.41Å; D320-G322 WeakPolarHBondContact OD1-CA 3.2Å; D320-G322 PolarHBondContact OD1-N 2.86Å; G322-S325 WeakPolarHBondContact O-CB 3.06Å
323	P	86.1	Confident	92.7	Very high	85 Å²	85	47.9 Å²	47.9	55%	0.552	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	142.9	169.4	30.8	-33.8	0	0	0	110.7	N232 S325	N232-P323 HydrophobicContact CB-CG 4.39Å; N232-P323 WeakPolarHBondContact CB-O 3.35Å; N232-P323 PolarHBondContact ND2-O 2.74Å; P323-S325 PolarHBondContact O-N 2.88Å
324	N	86.3	Confident	92.7	Very high	144 Å²	144	45.6 Å²	45.6	77%	0.77	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.4	13.9	-177.7	-44.6	-55	0	0	0	115.8	M326	N324-M326 VanDerWaalsContact O-CE 3.28Å; N324-M326 WeakPolarHBondContact O-CE 3.4Å; N324-M326 PolarHBondContact O-N 2.77Å
325	S	88.8	Confident	92.8	Very high	38 Å²	38	51 Å²	51	27%	0.266	26%	0.264	S	S	.	.			trans	-33.9	123	176.7	56.3	0	0	0	0	116	I319 D320 G322 P323	I319-S325 WeakPolarHBondContact CD1-OG 2.98Å; D320-S325 VanDerWaalsContact OD1-CA 3.28Å; D320-S325 WeakPolarHBondContact OD1-CA 3.25Å; D320-S325 WeakPolarHBondContact OD1-CB 3.27Å; D320-S325 VanDerWaalsContact OD2-CA 3.27Å; D320-S325 WeakPolarHBondContact OD2-CA 3.37Å; D320-S325 WeakPolarHBondContact OD2-CB 3.4Å; G322-S325 WeakPolarHBondContact O-CB 3.06Å; P323-S325 PolarHBondContact O-N 2.88Å
326	M	86.2	Confident	92.8	Very high	121 Å²	121	50 Å²	50	60%	0.596	26%	0.259	S	S	*	.			trans	-106.5	107.6	-175.7	-77.9	-66	107.3	0	0	111.3	D320 N324 T328	D320-M326 PolarHBondContact OD2-N 2.81Å; N324-M326 VanDerWaalsContact O-CE 3.28Å; N324-M326 WeakPolarHBondContact O-CE 3.4Å; N324-M326 PolarHBondContact O-N 2.77Å; M326-T328 PolarHBondContact O-N 2.78Å
327	P	90.5	Very high	92.8	Very high	60 Å²	60	53.6 Å²	53.6	39%	0.39	28%	0.281	S	S	.	.			trans	-70.6	122.4	-176.1	26.4	-33	0	0	0	112.1	L317 A318 I319	L317-P327 HydrophobicContact CD1-CB 4.39Å; L317-P327 HydrophobicContact CD2-CB 4.48Å; A318-P327 CarbonylContact O-C 3.41Å; A318-P327 WeakPolarHBondContact O-CA 3.46Å; I319-P327 HydrophobicContact CB-CB 4.14Å; I319-P327 HydrophobicContact CD1-CB 4.06Å; I319-P327 HydrophobicContact CD1-CG 4.35Å; I319-P327 HydrophobicContact CG1-CB 4.28Å
328	T	93.3	Very high	92.8	Very high	30 Å²	30	53.5 Å²	53.5	18%	0.184	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	164.2	171.4	71.6	0	0	0	0	110.7	P236 F238 L317 A318 M326	P236-T328 VanDerWaalsContact O-CB 3.3Å; P236-T328 WeakPolarHBondContact O-CB 3.36Å; P236-T328 WeakPolarHBondContact O-CG2 3.45Å; P236-T328 PolarHBondContact O-OG1 2.96Å; F238-T328 WeakPolarHBondContact CD2-OG1 3.19Å; F238-T328 WeakPolarHBondContact CE2-OG1 3.4Å; L317-T328 WeakPolarHBondContact CA-O 3.43Å; L317-T328 WeakPolarHBondContact CB-O 3.4Å; A318-T328 PolarHBondContact N-O 3.37Å; A318-T328 VanDerWaalsContact N-O 3.16Å; A318-T328 PolarHBondContact O-N 2.87Å; M326-T328 PolarHBondContact O-N 2.78Å
329	H	92.9	Very high	92.8	Very high	102 Å²	102	55.2 Å²	55.2	47%	0.472	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	135.2	-171.7	-70	-18.3	0	0	0	113.3	I316 L317	I316-H329 WeakPolarHBondContact O-CA 3.22Å; L317-H329 VanDerWaalsContact CB-ND1 3.32Å; L317-H329 WeakPolarHBondContact CB-ND1 3.05Å
330	C	94.3	Very high	92.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.3	173.9	169.4	0	0	0	0	110.2	F238 E240 P243 I316	F238-C330 HydrophobicContact CB-CB 4.44Å; F238-C330 HydrophobicContact CD1-CB 3.61Å; F238-C330 HydrophobicContact CD2-CB 3.73Å; F238-C330 HydrophobicContact CE1-CB 3.6Å; F238-C330 HydrophobicContact CE2-CB 3.71Å; F238-C330 HydrophobicContact CG-CB 3.67Å; F238-C330 HydrophobicContact CZ-CB 3.64Å; E240-C330 PolarHBondContact O-SG 2.82Å; P243-C330 VanDerWaalsContact CD-SG 3.52Å; I316-C330 PolarHBondContact N-O 3.03Å; I316-C330 PolarHBondContact O-N 3.2Å
331	K	95.4	Very high	92.8	Very high	108 Å²	108	58.8 Å²	58.8	47%	0.47	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	93.1	175.3	-67.6	-172.3	177.6	178.6	0	110.9	S241 S242 V313 N315 H333	S241-K331 PolarHBondContact O-N 3.05Å; S242-K331 CarbonylContact C-O 3.59Å; S242-K331 VanDerWaalsContact CA-O 3.27Å; S242-K331 WeakPolarHBondContact CA-O 3.34Å; V313-K331 HydrophobicContact CG1-CB 4.47Å; N315-K331 WeakPolarHBondContact OD1-CE 3.49Å; K331-H333 PolarHBondContact O-CD2 2.9Å; K331-H333 VanDerWaalsContact O-CD2 3.23Å; K331-H333 PolarHBondContact O-N 2.88Å
332	L	96.2	Very high	92.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	112.9	172.7	174	59.8	0	0	0	109.1	P243 V245 F258 V298 L314 I316 I334	P243-L332 HydrophobicContact CB-CD1 4.29Å; P243-L332 HydrophobicContact CG-CB 4.45Å; P243-L332 HydrophobicContact CG-CD1 3.98Å; V245-L332 HydrophobicContact CG2-CD1 3.88Å; F258-L332 HydrophobicContact CB-CD1 4.35Å; F258-L332 HydrophobicContact CB-CD2 4.01Å; F258-L332 HydrophobicContact CD1-CD1 4.15Å; F258-L332 HydrophobicContact CD1-CD2 4.41Å; F258-L332 HydrophobicContact CG-CD1 4.11Å; F258-L332 HydrophobicContact CG-CD2 4.45Å; V298-L332 HydrophobicContact CB-CD2 4.13Å; V298-L332 HydrophobicContact CG1-CD2 3.98Å; V298-L332 HydrophobicContact CG2-CD2 3.8Å; L314-L332 HydrophobicContact CB-CB 4.37Å; L314-L332 HydrophobicContact CD1-CD2 4.4Å; L314-L332 PolarHBondContact N-O 3.18Å; L314-L332 PolarHBondContact O-N 2.78Å; I316-L332 HydrophobicContact CD1-CB 4.26Å; I316-L332 HydrophobicContact CD1-CD2 4.33Å; L332-I334 HydrophobicContact CD2-CG1 4.46Å; L332-I334 HydrophobicContact CG-CG1 4.14Å
333	H	96.6	Very high	93.2	Very high	62 Å²	62	59.1 Å²	59.1	29%	0.287	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	118	173.5	-69	-89.7	0	0	0	109.5	P243 T244 V245 K331	P243-H333 PolarHBondContact O-N 2.8Å; T244-H333 CarbonylContact C-O 3.56Å; T244-H333 VanDerWaalsContact CA-O 3.28Å; T244-H333 WeakPolarHBondContact CA-O 3.44Å; T244-H333 HydrophobicContact CG2-CB 4.25Å; V245-H333 PolarHBondContact N-O 2.97Å; K331-H333 PolarHBondContact O-CD2 2.9Å; K331-H333 VanDerWaalsContact O-CD2 3.23Å; K331-H333 PolarHBondContact O-N 2.88Å
334	I	96.6	Very high	93.6	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	125.4	173.4	-55.3	169	0	0	0	107.1	V245 L247 I257 F289 S311 Y312 L314 L332	V245-I334 CarbonylContact O-C 3.54Å; V245-I334 WeakPolarHBondContact O-CA 3.41Å; L247-I334 HydrophobicContact CB-CG2 4.05Å; L247-I334 HydrophobicContact CD2-CG2 4.11Å; I257-I334 HydrophobicContact CD1-CD1 3.51Å; I257-I334 HydrophobicContact CD1-CG1 4.23Å; F289-I334 HydrophobicContact CD1-CD1 4.04Å; F289-I334 HydrophobicContact CE1-CD1 3.57Å; F289-I334 HydrophobicContact CE2-CD1 4.09Å; F289-I334 HydrophobicContact CG-CD1 4.49Å; F289-I334 HydrophobicContact CZ-CD1 3.6Å; S311-I334 CarbonylContact C-O 3.56Å; S311-I334 VanDerWaalsContact CA-O 3.22Å; S311-I334 WeakPolarHBondContact CA-O 3.14Å; S311-I334 WeakPolarHBondContact CB-O 2.96Å; Y312-I334 PolarHBondContact N-O 2.85Å; Y312-I334 PolarHBondContact O-N 2.86Å; L314-I334 HydrophobicContact CD1-CD1 3.58Å; L314-I334 HydrophobicContact CG-CD1 4.16Å; L332-I334 HydrophobicContact CD2-CG1 4.46Å; L332-I334 HydrophobicContact CG-CG1 4.14Å
335	K	96.4	Very high	94	Very high	113 Å²	113	55.1 Å²	55.1	49%	0.491	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.1	171.3	-64.4	-177.9	179.5	-178	0	108	T244 V245 T246 L247	T244-K335 HydrophobicContact CG2-CD 4.16Å; T244-K335 HydrophobicContact CG2-CG 4.35Å; V245-K335 PolarHBondContact O-N 3.41Å; T246-K335 CarbonylContact C-O 3.53Å; T246-K335 WeakPolarHBondContact CA-O 3.39Å; L247-K335 PolarHBondContact N-O 2.94Å
336	L	96.6	Very high	94.2	Very high	12 Å²	12	54.3 Å²	54.3	6%	0.063	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	153.5	172	-67.2	-172.2	0	0	0	110.8	L247 E249 L304 Y306 P310 Y312	L247-L336 HydrophobicContact CB-CD2 4.36Å; L247-L336 CarbonylContact O-C 3.56Å; L247-L336 VanDerWaalsContact O-CA 3.24Å; L247-L336 WeakPolarHBondContact O-CA 3.45Å; E249-L336 HydrophobicContact CB-CD1 4.07Å; L304-L336 HydrophobicContact CB-CD1 4.18Å; L304-L336 HydrophobicContact CB-CD2 4.15Å; L304-L336 HydrophobicContact CD1-CD2 3.95Å; Y306-L336 HydrophobicContact CD2-CB 3.66Å; Y306-L336 HydrophobicContact CG-CB 4.47Å; P310-L336 PolarHBondContact O-N 2.84Å; Y312-L336 HydrophobicContact CD2-CG 4.47Å; Y312-L336 HydrophobicContact CE2-CD1 3.78Å; Y312-L336 HydrophobicContact CE2-CD2 4.25Å; Y312-L336 HydrophobicContact CE2-CG 3.87Å
337	V	95	Very high	94.5	Very high	75 Å²	75	50.5 Å²	50.5	46%	0.455	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	114.4	167.1	-178.7	0	0	0	0	106.1	L247 E249	L247-V337 PolarHBondContact O-N 2.92Å; E249-V337 PolarHBondContact N-O 3.28Å
338	D	95.3	Very high	94.6	Very high	28 Å²	28	49.1 Å²	49.1	15%	0.15	25%	0.247	C	C	.	.			trans	-46.9	128.4	170.5	157.5	12.8	0	0	0	112.1	E249 Y306 S380 N383	E249-D338 VanDerWaalsContact OE1-CA 3.28Å; E249-D338 WeakPolarHBondContact OE1-CA 3.28Å; Y306-D338 HydrophobicContact CD1-CB 4.03Å; Y306-D338 HydrophobicContact CD2-CB 3.89Å; Y306-D338 HydrophobicContact CE1-CB 4.03Å; Y306-D338 HydrophobicContact CE2-CB 3.9Å; Y306-D338 HydrophobicContact CG-CB 3.98Å; D338-S380 WeakPolarHBondContact OD2-CA 3.11Å; D338-S380 WeakPolarHBondContact OD2-CB 3.38Å; D338-S380 PolarHBondContact OD2-N 2.86Å; D338-N383 PolarHBondContact OD1-ND2 3.45Å
339	V	94.9	Very high	94.4	Very high	35 Å²	35	53.9 Å²	53.9	21%	0.212	27%	0.265	C	S	.	.			trans	-121.2	129.1	175.1	178.1	0	0	0	0	109.2	S248 E249 D341	S248-V339 VanDerWaalsContact OG-CG2 3.23Å; S248-V339 WeakPolarHBondContact OG-CG2 3.45Å; E249-V339 HydrophobicContact CG-CB 4.31Å; E249-V339 HydrophobicContact CG-CG2 4.27Å; E249-V339 PolarHBondContact OE1-N 2.84Å; V339-D341 PolarHBondContact O-N 2.76Å
340	N	95.1	Very high	94.2	Very high	15 Å²	15	52.4 Å²	52.4	8%	0.08	26%	0.256	C	S	.	.	S	Bend	trans	-61.7	90.6	-177.6	-158.1	112.9	0	0	0	112.9	D379 N383 D431 G433 L437	N340-D379 WeakPolarHBondContact CA-OD2 3.48Å; N340-N383 HydrophobicContact CB-CB 3.88Å; N340-N383 PolarHBondContact N-ND2 3.32Å; N340-N383 VanDerWaalsContact N-ND2 3.15Å; N340-N383 WeakPolarHBondContact OD1-CA 3.44Å; N340-N383 WeakPolarHBondContact OD1-CB 3.35Å; N340-D431 PolarHBondContact ND2-OD2 2.83Å; N340-G433 WeakPolarHBondContact OD1-CA 3.25Å; N340-L437 WeakPolarHBondContact ND2-CD1 3.16Å; N340-L437 WeakPolarHBondContact ND2-CG 3.12Å
341	D	93.5	Very high	93.4	Very high	99 Å²	99	59.1 Å²	59.1	53%	0.529	29%	0.291	S	S	.	.			trans	-130.1	-16.2	-175.1	102.9	-19.1	0	0	0	114.3	V339 D379	V339-D341 PolarHBondContact O-N 2.76Å; D341-D379 PolarHBondContact N-OD2 3.34Å
342	H	92.6	Very high	92.5	Very high	74 Å²	74	56.2 Å²	56.2	34%	0.343	29%	0.285	S	S	.	.	S	Bend	trans	-86.5	148.8	160.3	-57.7	83.3	0	0	0	111	E307 A378 D379 L437	E307-H342 IonicContact OE2-CE1 3.13Å; E307-H342 IonicContact OE2-ND1 2.82Å; H342-A378 HydrophobicContact CB-CB 3.95Å; H342-D379 WeakPolarHBondContact CB-OD1 3.48Å; H342-D379 IonicContact CE1-OD1 3Å; H342-D379 IonicContact CG-OD1 3.54Å; H342-D379 VanDerWaalsContact CG-OD1 3.31Å; H342-D379 PolarHBondContact N-OD1 3.1Å; H342-D379 PolarHBondContact N-OD2 2.99Å; H342-D379 IonicContact ND1-OD1 3.41Å; H342-D379 PolarHBondContact ND1-OD1 3.47Å; H342-L437 WeakPolarHBondContact O-CD1 3.11Å
343	A	94.2	Very high	91.1	Very high	39 Å²	39	62 Å²	62	32%	0.322	32%	0.322	S	S	.	.			trans	-108.2	145.3	176.4	0	0	0	0	0	110.2	R345 L437	A343-R345 WeakPolarHBondContact O-CG 3.41Å; A343-R345 PolarHBondContact O-N 2.86Å; A343-L437 HydrophobicContact CB-CB 3.93Å; A343-L437 HydrophobicContact CB-CD1 4.34Å
344	P	95.4	Very high	90.1	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.35	C	S	.	.			trans	-50.1	134	-174	-29.9	30.2	0	0	0	114.5	V375 D377 V386 A429 D431 T439	P344-V375 HydrophobicContact CB-CG1 4.42Å; P344-D377 WeakPolarHBondContact CA-OD2 3.47Å; P344-D377 WeakPolarHBondContact CD-OD2 3.46Å; P344-D377 WeakPolarHBondContact CG-OD2 3.41Å; P344-D377 VanDerWaalsContact N-OD2 3.11Å; P344-V386 HydrophobicContact CB-CG1 3.74Å; P344-V386 HydrophobicContact CB-CG2 4.07Å; P344-V386 HydrophobicContact CG-CG1 3.88Å; P344-V386 HydrophobicContact CG-CG2 4.01Å; P344-A429 HydrophobicContact CB-CB 3.79Å; P344-D431 HydrophobicContact CG-CB 4.1Å; P344-T439 WeakPolarHBondContact O-CB 3.45Å; P344-T439 VanDerWaalsContact O-CG2 3.27Å; P344-T439 WeakPolarHBondContact O-CG2 3.17Å; P344-T439 PolarHBondContact O-OG1 2.9Å
345	R	94	Very high	89.1	Confident	145 Å²	145	67.3 Å²	67.3	55%	0.547	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.4	-178.3	-61.3	-176.7	63.6	-168.1	-3.3	110.3	A343 V375 Y376	A343-R345 WeakPolarHBondContact O-CG 3.41Å; A343-R345 PolarHBondContact O-N 2.86Å; R345-V375 WeakPolarHBondContact O-CA 3.28Å; R345-Y376 WeakPolarHBondContact CA-O 3.49Å; R345-Y376 HydrophobicContact CB-CD1 4.23Å; R345-Y376 HydrophobicContact CB-CD2 4.08Å; R345-Y376 HydrophobicContact CB-CE1 3.8Å; R345-Y376 HydrophobicContact CB-CE2 3.65Å; R345-Y376 HydrophobicContact CB-CG 4.36Å; R345-Y376 VanDerWaalsContact CB-CZ 3.48Å; R345-Y376 WeakPolarHBondContact CB-O 3.35Å; R345-Y376 HydrophobicContact CG-CE2 4.27Å; R345-Y376 VanDerWaalsContact CZ-OH 3.23Å; R345-Y376 PolarHBondContact N-O 3.25Å; R345-Y376 PolarHBondContact NE-OH 2.8Å; R345-Y376 PolarHBondContact NH2-OH 3Å; R345-Y376 VanDerWaalsContact O-CD1 3.3Å; R345-Y376 WeakPolarHBondContact O-CD1 2.99Å; R345-Y376 PolarHBondContact O-N 2.93Å
346	I	94.4	Very high	88.5	Confident	22 Å²	22	67.2 Å²	67.2	11%	0.113	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	143.9	178	-50.6	177.7	0	0	0	108.6	T348 V373 V375 L388 L427 A429 T439 E441	I346-T348 HydrophobicContact CG2-CG2 4.34Å; I346-V373 HydrophobicContact CG2-CG1 3.5Å; I346-V375 HydrophobicContact CG1-CG1 4.47Å; I346-L388 HydrophobicContact CD1-CD1 4.34Å; I346-L427 HydrophobicContact CD1-CB 4.12Å; I346-L427 HydrophobicContact CG2-CD1 4.27Å; I346-A429 HydrophobicContact CD1-CB 3.66Å; I346-A429 HydrophobicContact CG1-CB 3.71Å; I346-T439 HydrophobicContact CD1-CG2 4.29Å; I346-T439 HydrophobicContact CG1-CG2 4.32Å; I346-E441 VanDerWaalsContact CB-OE2 3.27Å; I346-E441 WeakPolarHBondContact CB-OE2 3.2Å; I346-E441 HydrophobicContact CD1-CB 3.95Å; I346-E441 WeakPolarHBondContact CG2-OE2 3.44Å
347	S	92.3	Very high	88.2	Confident	41 Å²	41	68.4 Å²	68.4	29%	0.287	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	129.2	170.4	177.8	0	0	0	0	109.9	T374	S347-T374 PolarHBondContact N-O 2.89Å; S347-T374 PolarHBondContact O-N 3.25Å; S347-T374 PolarHBondContact O-OG1 2.85Å
348	T	91.8	Very high	88	Confident	30 Å²	30	64.9 Å²	64.9	18%	0.184	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.7	-171.2	45.9	0	0	0	0	111.8	I346 V371 V373 L427 E441 L443	I346-T348 HydrophobicContact CG2-CG2 4.34Å; T348-V371 HydrophobicContact CG2-CG1 4.1Å; T348-V373 HydrophobicContact CG2-CG1 4.31Å; T348-V373 HydrophobicContact CG2-CG2 4.26Å; T348-L427 HydrophobicContact CG2-CD1 4.24Å; T348-E441 WeakPolarHBondContact CG2-OE1 3.23Å; T348-E441 PolarHBondContact OG1-OE1 3.14Å; T348-L443 HydrophobicContact CG2-CD1 4.4Å
349	K	89.1	Confident	87.9	Confident	130 Å²	130	65.5 Å²	65.5	57%	0.565	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.4	135.6	178.2	-65.8	179	-176.7	166.9	0	111.5	V371 L372	K349-V371 WeakPolarHBondContact O-CA 3.44Å; K349-L372 PolarHBondContact N-O 2.97Å; K349-L372 PolarHBondContact O-N 2.98Å
350	W	89.3	Confident	87.8	Confident	71 Å²	71	64.2 Å²	64.2	27%	0.269	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	165.9	-179.2	50.1	92.3	0	0	0	112.6	S352 S355 P358 V371 L443	W350-S352 VanDerWaalsContact C-N 3.3Å; W350-S352 VanDerWaalsContact CD1-O 3.26Å; W350-S352 PolarHBondContact NE1-O 2.9Å; W350-S352 PolarHBondContact O-N 2.65Å; W350-S355 PolarHBondContact NE1-O 2.82Å; W350-P358 HydrophobicContact CB-CB 4.14Å; W350-P358 HydrophobicContact CD2-CB 4.23Å; W350-P358 HydrophobicContact CE3-CB 4.48Å; W350-P358 HydrophobicContact CG-CB 4.1Å; W350-V371 HydrophobicContact CB-CG2 4.24Å; W350-V371 HydrophobicContact CE3-CG2 4.47Å; W350-L443 HydrophobicContact CZ3-CD1 4.4Å
351	L	76.6	Confident	87.7	Confident	141 Å²	141	70.4 Å²	70.4	74%	0.738	38%	0.38	S	S	*	.	S	Bend	trans	-65.3	-24.7	-173.3	-82.9	166.3	0	0	0	115.2	P353 F369	L351-P353 WeakPolarHBondContact O-CD 3.39Å; L351-F369 HydrophobicContact CD1-CD1 3.81Å; L351-F369 HydrophobicContact CD1-CE1 4.16Å; L351-F369 HydrophobicContact CG-CD1 4.14Å; L351-F369 HydrophobicContact CG-CE1 3.97Å
352	S	76.4	Confident	87.7	Confident	48 Å²	48	66.2 Å²	66.2	34%	0.336	36%	0.357	S	S	.	.			trans	-106.1	82.6	-176	-64.7	0	0	0	0	111.2	W350 T354 S355	W350-S352 VanDerWaalsContact C-N 3.3Å; W350-S352 VanDerWaalsContact CD1-O 3.26Å; W350-S352 PolarHBondContact NE1-O 2.9Å; W350-S352 PolarHBondContact O-N 2.65Å; S352-T354 PolarHBondContact O-N 3.32Å; S352-T354 VanDerWaalsContact O-N 3.07Å; S352-S355 PolarHBondContact O-N 3.12Å
353	P	68.1	Low	87.6	Confident	121 Å²	121	65.3 Å²	65.3	79%	0.786	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-8.8	-175.9	29.2	-38.2	0	0	0	114.3	L351	L351-P353 WeakPolarHBondContact O-CD 3.39Å
354	T	73.9	Confident	87.6	Confident	142 Å²	142	64.1 Å²	64.1	87%	0.871	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-12.9	172.4	49	0	0	0	0	113.5	S352	S352-T354 PolarHBondContact O-N 3.32Å; S352-T354 VanDerWaalsContact O-N 3.07Å
355	S	76.9	Confident	87.5	Confident	33 Å²	33	68.6 Å²	68.6	23%	0.231	39%	0.386	C	S	.	.	S	Bend	trans	-93.6	133	176.4	-172.8	0	0	0	0	110.4	W350 S352 V357	W350-S355 PolarHBondContact NE1-O 2.82Å; S352-S355 PolarHBondContact O-N 3.12Å; S355-V357 VanDerWaalsContact CB-O 3.28Å; S355-V357 WeakPolarHBondContact CB-O 3.4Å; S355-V357 PolarHBondContact O-N 3.42Å; S355-V357 PolarHBondContact OG-N 3.31Å; S355-V357 PolarHBondContact OG-O 3.3Å
356	S	83.1	Confident	87.3	Confident	110 Å²	110	66.5 Å²	66.5	77%	0.769	39%	0.385	S	S	*	.	S	Bend	trans	-69.2	-16.1	175.4	51.2	0	0	0	0	113.7
357	V	89.8	Confident	87.2	Confident	37 Å²	37	68 Å²	68	22%	0.224	39%	0.394	C	S	.	.	S	Bend	trans	-133.3	151.3	176.4	-60.6	0	0	0	0	110.4	S355 T359 P444	S355-V357 VanDerWaalsContact CB-O 3.28Å; S355-V357 WeakPolarHBondContact CB-O 3.4Å; S355-V357 PolarHBondContact O-N 3.42Å; S355-V357 PolarHBondContact OG-N 3.31Å; S355-V357 PolarHBondContact OG-O 3.3Å; V357-T359 HydrophobicContact CG2-CG2 4.47Å; V357-P444 HydrophobicContact CG1-CB 4.33Å; V357-P444 HydrophobicContact CG1-CG 3.84Å
358	P	91.8	Very high	87.2	Confident	1 Å²	1	68 Å²	68	1%	0.006	39%	0.392	C	S	.	.			trans	-60.4	142.5	166.1	27.7	-37.5	0	0	0	111.7	W350 L370 V371 L443 P444 V445 S446	W350-P358 HydrophobicContact CB-CB 4.14Å; W350-P358 HydrophobicContact CD2-CB 4.23Å; W350-P358 HydrophobicContact CE3-CB 4.48Å; W350-P358 HydrophobicContact CG-CB 4.1Å; P358-L370 HydrophobicContact CB-CD1 4.2Å; P358-L370 HydrophobicContact CB-CD2 4.47Å; P358-L370 HydrophobicContact CB-CG 4.08Å; P358-V371 HydrophobicContact CB-CG2 3.49Å; P358-V371 VanDerWaalsContact CB-CG2 3.49Å; P358-V371 HydrophobicContact CG-CG2 3.81Å; P358-L443 HydrophobicContact CG-CD1 3.9Å; P358-L443 HydrophobicContact CG-CG 4.13Å; P358-P444 VanDerWaalsContact CD-O 3.26Å; P358-P444 WeakPolarHBondContact CD-O 3.18Å; P358-P444 VanDerWaalsContact CG-O 3.29Å; P358-P444 WeakPolarHBondContact CG-O 3.16Å; P358-V445 HydrophobicContact CG-CG2 4.07Å; P358-S446 PolarHBondContact O-N 2.83Å; P358-S446 VanDerWaalsContact O-N 3.1Å
359	T	92.6	Very high	87.2	Confident	41 Å²	41	70 Å²	70	25%	0.252	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.5	-175.5	56.3	0	0	0	0	110.8	V357 S446 L448	V357-T359 HydrophobicContact CG2-CG2 4.47Å; T359-S446 WeakPolarHBondContact CA-O 3.23Å; T359-L448 HydrophobicContact CG2-CD2 4.12Å; T359-L448 HydrophobicContact CG2-CG 4.45Å
360	V	93.1	Very high	87.3	Confident	9 Å²	9	64.2 Å²	64.2	6%	0.055	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	145.3	177.9	56.1	0	0	0	0	109.3	A364 T368 L370 T411 L415 V445 S446 V447 L448	V360-A364 HydrophobicContact CG2-CB 3.7Å; V360-T368 HydrophobicContact CG2-CG2 4.46Å; V360-L370 HydrophobicContact CB-CD1 3.61Å; V360-L370 HydrophobicContact CG1-CD1 3.81Å; V360-T411 HydrophobicContact CG2-CG2 4.2Å; V360-L415 HydrophobicContact CB-CD1 4.29Å; V360-L415 HydrophobicContact CG1-CD1 3.58Å; V360-L415 HydrophobicContact CG2-CD1 3.7Å; V360-V445 HydrophobicContact CG1-CG1 4.02Å; V360-S446 PolarHBondContact N-O 3.37Å; V360-V447 CarbonylContact O-C 3.37Å; V360-V447 VanDerWaalsContact O-CA 3.3Å; V360-V447 WeakPolarHBondContact O-CA 3.36Å; V360-L448 PolarHBondContact O-N 2.83Å
361	R	92.6	Very high	87.5	Confident	145 Å²	145	60.8 Å²	60.8	55%	0.547	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	155.1	176	-55.3	-163.7	-172.2	175.3	-9.5	111.3	A364 L448 E450	R361-A364 WeakPolarHBondContact O-CB 3.35Å; R361-A364 PolarHBondContact O-N 2.86Å; R361-L448 WeakPolarHBondContact CA-O 3.29Å; R361-L448 HydrophobicContact CG-CB 4.19Å; R361-L448 HydrophobicContact CG-CD1 4.47Å; R361-E450 HydrophobicContact CB-CG 4.09Å; R361-E450 VanDerWaalsContact CD-CD 3.41Å; R361-E450 WeakPolarHBondContact CD-OE1 3.28Å; R361-E450 HydrophobicContact CG-CG 4.45Å; R361-E450 IonicContact CZ-OE1 2.69Å; R361-E450 IonicContact NE-OE1 3.65Å; R361-E450 IonicContact NH1-OE1 3.84Å; R361-E450 PolarHBondContact NH1-OE1 2.91Å
362	E	94.4	Very high	88.2	Confident	11 Å²	11	56.7 Å²	56.7	5%	0.051	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-43.9	176.1	60.5	-148	116	0	0	113.9	A364 L415 R417 V447 L448 D449 E450	E362-A364 PolarHBondContact O-N 2.95Å; E362-L415 HydrophobicContact CB-CB 4.31Å; E362-R417 WeakPolarHBondContact OE2-CA 3.48Å; E362-R417 WeakPolarHBondContact OE2-CB 3.19Å; E362-R417 PolarHBondContact OE2-N 3.32Å; E362-V447 HydrophobicContact CB-CG1 3.87Å; E362-L448 PolarHBondContact N-O 3.48Å; E362-D449 WeakPolarHBondContact OE1-CA 3.22Å; E362-E450 HydrophobicContact CG-CB 4.4Å; E362-E450 PolarHBondContact OE1-N 3.22Å
363	G	91	Very high	89	Confident	54 Å²	54	54.4 Å²	54.4	56%	0.557	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	9.5	170.8	0	0	0	0	0	115.1	E450	G363-E450 WeakPolarHBondContact CA-OE2 3.48Å
364	A	92.3	Very high	90.2	Very high	15 Å²	15	50 Å²	50	12%	0.124	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-68.3	126.7	176.3	0	0	0	0	0	111.2	V360 R361 E362 T368	V360-A364 HydrophobicContact CG2-CB 3.7Å; R361-A364 WeakPolarHBondContact O-CB 3.35Å; R361-A364 PolarHBondContact O-N 2.86Å; E362-A364 PolarHBondContact O-N 2.95Å; A364-T368 HydrophobicContact CB-CG2 4.12Å
365	P	93.3	Very high	91.1	Very high	93 Å²	93	43.4 Å²	43.4	60%	0.604	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-66.3	160.4	178	28.2	-35.4	0	0	0	112.1	T368 T411	P365-T368 WeakPolarHBondContact CD-OG1 3.3Å; P365-T368 VanDerWaalsContact O-CB 3.28Å; P365-T368 WeakPolarHBondContact O-CB 3.36Å; P365-T368 PolarHBondContact O-N 3.3Å; P365-T368 PolarHBondContact O-OG1 2.86Å; P365-T411 PolarHBondContact O-OG1 2.92Å
366	I	91.6	Very high	91.8	Very high	101 Å²	101	46.1 Å²	46.1	52%	0.518	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	145.8	170.4	-59	172.8	0	0	0	109.9	T368 T411	I366-T368 VanDerWaalsContact C-N 3.27Å; I366-T368 PolarHBondContact O-N 3.07Å; I366-T411 WeakPolarHBondContact CA-OG1 3.15Å
367	D	92.1	Very high	92.3	Very high	55 Å²	55	42 Å²	42	29%	0.294	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	16.9	-171.7	-96.9	17.6	0	0	0	115.8	F369 R398 K400 V410 T411	D367-F369 PolarHBondContact O-N 3Å; D367-R398 VanDerWaalsContact CG-NH2 3.25Å; D367-R398 IonicContact OD1-CZ 2.66Å; D367-R398 IonicContact OD1-NE 2.66Å; D367-R398 PolarHBondContact OD1-NE 2.65Å; D367-R398 IonicContact OD1-NH2 3.33Å; D367-R398 PolarHBondContact OD1-NH2 3.41Å; D367-R398 IonicContact OD2-NH2 2.68Å; D367-R398 PolarHBondContact OD2-NH2 3.01Å; D367-R398 VanDerWaalsContact OD2-NH2 3.12Å; D367-K400 IonicContact OD2-NZ 3.27Å; D367-K400 PolarHBondContact OD2-NZ 3.3Å; D367-V410 VanDerWaalsContact OD1-CG2 3.25Å; D367-V410 WeakPolarHBondContact OD1-CG2 3Å; D367-T411 PolarHBondContact N-O 3.39Å; D367-T411 PolarHBondContact N-OG1 2.96Å
368	T	92.5	Very high	92.5	Very high	41 Å²	41	42.4 Å²	42.4	25%	0.252	24%	0.235	S	C	.	.			trans	-64.6	129.1	166.2	-65.1	0	0	0	0	110.4	V360 A364 P365 I366 V410 T411	V360-T368 HydrophobicContact CG2-CG2 4.46Å; A364-T368 HydrophobicContact CB-CG2 4.12Å; P365-T368 WeakPolarHBondContact CD-OG1 3.3Å; P365-T368 VanDerWaalsContact O-CB 3.28Å; P365-T368 WeakPolarHBondContact O-CB 3.36Å; P365-T368 PolarHBondContact O-N 3.3Å; P365-T368 PolarHBondContact O-OG1 2.86Å; I366-T368 VanDerWaalsContact C-N 3.27Å; I366-T368 PolarHBondContact O-N 3.07Å; T368-V410 WeakPolarHBondContact O-CA 3.39Å; T368-V410 WeakPolarHBondContact O-CB 3.07Å; T368-T411 PolarHBondContact N-OG1 2.8Å; T368-T411 PolarHBondContact O-N 2.84Å; T368-T411 VanDerWaalsContact O-N 3.11Å
369	F	91.8	Very high	92.7	Very high	72 Å²	72	42.8 Å²	42.8	32%	0.316	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	132.8	177.9	170.8	-94.6	0	0	0	112.5	L351 D367 V371 L372 L408	L351-F369 HydrophobicContact CD1-CD1 3.81Å; L351-F369 HydrophobicContact CD1-CE1 4.16Å; L351-F369 HydrophobicContact CG-CD1 4.14Å; L351-F369 HydrophobicContact CG-CE1 3.97Å; D367-F369 PolarHBondContact O-N 3Å; F369-V371 WeakPolarHBondContact CE2-O 3.47Å; F369-V371 VanDerWaalsContact CZ-C 3.43Å; F369-L372 HydrophobicContact CE2-CB 4.2Å; F369-L372 HydrophobicContact CZ-CB 3.98Å; F369-L372 VanDerWaalsContact CZ-N 3.27Å; F369-L408 HydrophobicContact CD2-CB 4.25Å; F369-L408 HydrophobicContact CD2-CD2 4.09Å; F369-L408 HydrophobicContact CE2-CB 4.38Å; F369-L408 HydrophobicContact CE2-CD2 3.67Å
370	L	91.4	Very high	92.6	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.037	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-62.6	177.6	-172.9	80.8	0	0	0	112.2	P358 V360 F397 I409 I425 V445	P358-L370 HydrophobicContact CB-CD1 4.2Å; P358-L370 HydrophobicContact CB-CD2 4.47Å; P358-L370 HydrophobicContact CB-CG 4.08Å; V360-L370 HydrophobicContact CB-CD1 3.61Å; V360-L370 HydrophobicContact CG1-CD1 3.81Å; L370-F397 HydrophobicContact CD2-CD1 4.46Å; L370-F397 HydrophobicContact CD2-CE1 4.34Å; L370-I409 HydrophobicContact CB-CG2 4.35Å; L370-I409 WeakPolarHBondContact CB-O 3.36Å; L370-I409 HydrophobicContact CD2-CG2 3.96Å; L370-I409 PolarHBondContact N-O 3.14Å; L370-I425 HydrophobicContact CD2-CD1 4.06Å; L370-V445 HydrophobicContact CD1-CG1 3.8Å; L370-V445 HydrophobicContact CD2-CB 4.44Å; L370-V445 HydrophobicContact CD2-CG1 3.78Å; L370-V445 HydrophobicContact CD2-CG2 3.73Å; L370-V445 HydrophobicContact CG-CG1 4.41Å
371	V	92.1	Very high	92.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	136.5	-171.8	-179.5	0	0	0	0	110.7	T348 K349 W350 P358 F369 V373 I409 L443	T348-V371 HydrophobicContact CG2-CG1 4.1Å; K349-V371 WeakPolarHBondContact O-CA 3.44Å; W350-V371 HydrophobicContact CB-CG2 4.24Å; W350-V371 HydrophobicContact CE3-CG2 4.47Å; P358-V371 HydrophobicContact CB-CG2 3.49Å; P358-V371 VanDerWaalsContact CB-CG2 3.49Å; P358-V371 HydrophobicContact CG-CG2 3.81Å; F369-V371 WeakPolarHBondContact CE2-O 3.47Å; F369-V371 VanDerWaalsContact CZ-C 3.43Å; V371-V373 HydrophobicContact CG1-CG2 4.09Å; V371-I409 HydrophobicContact CB-CB 4.38Å; V371-I409 HydrophobicContact CB-CD1 4.24Å; V371-I409 PolarHBondContact O-N 3.15Å; V371-L443 HydrophobicContact CB-CD2 4.23Å; V371-L443 HydrophobicContact CG1-CD2 4.22Å; V371-L443 HydrophobicContact CG2-CD2 3.84Å
372	L	91.9	Very high	92.4	Very high	54 Å²	54	45.8 Å²	45.8	28%	0.283	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	118.8	163	171.4	64.9	0	0	0	107.7	K349 F369 T374 N406 L408	K349-L372 PolarHBondContact N-O 2.97Å; K349-L372 PolarHBondContact O-N 2.98Å; F369-L372 HydrophobicContact CE2-CB 4.2Å; F369-L372 HydrophobicContact CZ-CB 3.98Å; F369-L372 VanDerWaalsContact CZ-N 3.27Å; L372-T374 HydrophobicContact CD1-CG2 4.44Å; L372-T374 HydrophobicContact CD2-CG2 4.39Å; L372-T374 HydrophobicContact CG-CG2 4.16Å; L372-N406 HydrophobicContact CD1-CB 4.37Å; L372-L408 HydrophobicContact CD1-CD2 3.78Å
373	V	93.4	Very high	92.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	115.2	175.3	-169.8	0	0	0	0	107.6	I346 T348 V371 V375 L388 F407 I409 L427	I346-V373 HydrophobicContact CG2-CG1 3.5Å; T348-V373 HydrophobicContact CG2-CG1 4.31Å; T348-V373 HydrophobicContact CG2-CG2 4.26Å; V371-V373 HydrophobicContact CG1-CG2 4.09Å; V373-V375 HydrophobicContact CG1-CG2 3.99Å; V373-L388 HydrophobicContact CB-CD2 4.16Å; V373-L388 HydrophobicContact CG1-CD2 3.81Å; V373-F407 HydrophobicContact CB-CB 4.41Å; V373-F407 PolarHBondContact N-O 3.36Å; V373-F407 PolarHBondContact O-N 3.13Å; V373-I409 HydrophobicContact CG2-CD1 3.65Å; V373-I409 HydrophobicContact CG2-CG1 3.77Å; V373-L427 HydrophobicContact CG1-CD1 4.15Å; V373-L427 HydrophobicContact CG2-CD1 4.16Å
374	T	92.5	Very high	92.3	Very high	30 Å²	30	44.6 Å²	44.6	18%	0.184	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.5	171.8	59.4	0	0	0	0	108.3	S347 L372 F405 N406	S347-T374 PolarHBondContact N-O 2.89Å; S347-T374 PolarHBondContact O-N 3.25Å; S347-T374 PolarHBondContact O-OG1 2.85Å; L372-T374 HydrophobicContact CD1-CG2 4.44Å; L372-T374 HydrophobicContact CD2-CG2 4.39Å; L372-T374 HydrophobicContact CG-CG2 4.16Å; T374-F405 WeakPolarHBondContact CA-O 3.48Å; T374-N406 WeakPolarHBondContact CG2-OD1 3.09Å
375	V	92.6	Very high	92.2	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.3	179.8	-169.3	0	0	0	0	108.6	P344 R345 I346 V373 V386 L388 F405 F407 A429	P344-V375 HydrophobicContact CB-CG1 4.42Å; R345-V375 WeakPolarHBondContact O-CA 3.28Å; I346-V375 HydrophobicContact CG1-CG1 4.47Å; V373-V375 HydrophobicContact CG1-CG2 3.99Å; V375-V386 HydrophobicContact CG1-CB 4.27Å; V375-V386 HydrophobicContact CG1-CG1 3.64Å; V375-L388 HydrophobicContact CG2-CB 4.33Å; V375-L388 HydrophobicContact CG2-CD1 4.07Å; V375-L388 HydrophobicContact CG2-CD2 3.91Å; V375-L388 HydrophobicContact CG2-CG 4.31Å; V375-F405 PolarHBondContact N-O 3.2Å; V375-F405 WeakPolarHBondContact O-CB 3.28Å; V375-F405 WeakPolarHBondContact O-CD1 3.08Å; V375-F407 HydrophobicContact CB-CE2 4.3Å; V375-F407 HydrophobicContact CG2-CD2 4.03Å; V375-F407 HydrophobicContact CG2-CE2 4.06Å; V375-A429 HydrophobicContact CG1-CB 3.9Å
376	Y	91.4	Very high	92.2	Very high	91 Å²	91	44.8 Å²	44.8	36%	0.357	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	146.5	-179.7	61	-78.5	0	0	0	109.4	R345	R345-Y376 WeakPolarHBondContact CA-O 3.49Å; R345-Y376 HydrophobicContact CB-CD1 4.23Å; R345-Y376 HydrophobicContact CB-CD2 4.08Å; R345-Y376 HydrophobicContact CB-CE1 3.8Å; R345-Y376 HydrophobicContact CB-CE2 3.65Å; R345-Y376 HydrophobicContact CB-CG 4.36Å; R345-Y376 VanDerWaalsContact CB-CZ 3.48Å; R345-Y376 WeakPolarHBondContact CB-O 3.35Å; R345-Y376 HydrophobicContact CG-CE2 4.27Å; R345-Y376 VanDerWaalsContact CZ-OH 3.23Å; R345-Y376 PolarHBondContact N-O 3.25Å; R345-Y376 PolarHBondContact NE-OH 2.8Å; R345-Y376 PolarHBondContact NH2-OH 3Å; R345-Y376 VanDerWaalsContact O-CD1 3.3Å; R345-Y376 WeakPolarHBondContact O-CD1 2.99Å; R345-Y376 PolarHBondContact O-N 2.93Å
377	D	94.8	Very high	92.2	Very high	22 Å²	22	42 Å²	42	12%	0.118	24%	0.241	C	C	.	.			trans	-106.7	172	163.4	-128.2	-51	0	0	0	111.2	P344 V386	P344-D377 WeakPolarHBondContact CA-OD2 3.47Å; P344-D377 WeakPolarHBondContact CD-OD2 3.46Å; P344-D377 WeakPolarHBondContact CG-OD2 3.41Å; P344-D377 VanDerWaalsContact N-OD2 3.11Å; D377-V386 HydrophobicContact CB-CG2 4.04Å
378	A	93.3	Very high	92.2	Very high	46 Å²	46	40.1 Å²	40.1	38%	0.38	23%	0.231	S	C	.	.	S	Bend	trans	-92.8	-41	168.1	0	0	0	0	0	111.1	E307 H342	E307-A378 HydrophobicContact CG-CB 3.75Å; H342-A378 HydrophobicContact CB-CB 3.95Å
379	D	95.4	Very high	92.3	Very high	9 Å²	9	41.5 Å²	41.5	5%	0.048	24%	0.239	C	C	.	.	S	Bend	trans	-58.5	167.5	179.2	-57.6	-2	0	0	0	112.7	N340 D341 H342 N383 G384	N340-D379 WeakPolarHBondContact CA-OD2 3.48Å; D341-D379 PolarHBondContact N-OD2 3.34Å; H342-D379 WeakPolarHBondContact CB-OD1 3.48Å; H342-D379 IonicContact CE1-OD1 3Å; H342-D379 IonicContact CG-OD1 3.54Å; H342-D379 VanDerWaalsContact CG-OD1 3.31Å; H342-D379 PolarHBondContact N-OD1 3.1Å; H342-D379 PolarHBondContact N-OD2 2.99Å; H342-D379 IonicContact ND1-OD1 3.41Å; H342-D379 PolarHBondContact ND1-OD1 3.47Å; D379-N383 HydrophobicContact CB-CB 3.62Å; D379-G384 WeakPolarHBondContact O-CA 3.26Å
380	S	91.8	Very high	92.4	Very high	42 Å²	42	39.8 Å²	39.8	29%	0.294	23%	0.233	S	C	.	.			trans	-115.7	173.5	-170.9	-81.8	0	0	0	0	114.3	D338 K382 N383 G384	D338-S380 WeakPolarHBondContact OD2-CA 3.11Å; D338-S380 WeakPolarHBondContact OD2-CB 3.38Å; D338-S380 PolarHBondContact OD2-N 2.86Å; S380-K382 PolarHBondContact O-N 3.07Å; S380-N383 WeakPolarHBondContact O-CA 3.32Å; S380-N383 WeakPolarHBondContact O-CB 3.41Å; S380-N383 PolarHBondContact O-N 3.4Å; S380-G384 PolarHBondContact O-N 3.4Å
381	G	90.6	Very high	92.6	Very high	70 Å²	70	43.4 Å²	43.4	72%	0.722	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	-105.6	172.5	0	0	0	0	0	114.3
382	K	90.9	Very high	92.4	Very high	146 Å²	146	52.2 Å²	52.2	64%	0.635	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-22.2	175.1	-74.7	-168.4	172.6	-167.3	0	113.6	S380 E385 H432	S380-K382 PolarHBondContact O-N 3.07Å; K382-E385 PolarHBondContact O-N 3.27Å; K382-H432 CarbonylContact O-C 3.57Å; K382-H432 WeakPolarHBondContact O-CB 3.47Å
383	N	91.8	Very high	92	Very high	28 Å²	28	53.7 Å²	53.7	15%	0.15	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-45	177.7	-59.6	-7.4	0	0	0	107.5	D338 N340 D379 S380 E385 D431	D338-N383 PolarHBondContact OD1-ND2 3.45Å; N340-N383 HydrophobicContact CB-CB 3.88Å; N340-N383 PolarHBondContact N-ND2 3.32Å; N340-N383 VanDerWaalsContact N-ND2 3.15Å; N340-N383 WeakPolarHBondContact OD1-CA 3.44Å; N340-N383 WeakPolarHBondContact OD1-CB 3.35Å; D379-N383 HydrophobicContact CB-CB 3.62Å; S380-N383 WeakPolarHBondContact O-CA 3.32Å; S380-N383 WeakPolarHBondContact O-CB 3.41Å; S380-N383 PolarHBondContact O-N 3.4Å; N383-E385 VanDerWaalsContact C-N 3.28Å; N383-E385 PolarHBondContact O-N 3.15Å; N383-D431 VanDerWaalsContact O-CB 3.26Å; N383-D431 WeakPolarHBondContact O-CB 3.29Å
384	G	90.2	Very high	91.9	Very high	13 Å²	13	54.2 Å²	54.2	13%	0.134	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	6.4	168.5	0	0	0	0	0	117.6	D379 S380	D379-G384 WeakPolarHBondContact O-CA 3.26Å; S380-G384 PolarHBondContact O-N 3.4Å
385	E	91.4	Very high	91.7	Very high	93 Å²	93	54.4 Å²	54.4	44%	0.435	33%	0.331	S	S	.	.			trans	-91.6	107.7	178.4	-170.4	-176.1	-156.4	0	0	110.4	K382 N383 D431 H432	K382-E385 PolarHBondContact O-N 3.27Å; N383-E385 VanDerWaalsContact C-N 3.28Å; N383-E385 PolarHBondContact O-N 3.15Å; E385-D431 CarbonylContact O-C 3.56Å; E385-D431 WeakPolarHBondContact O-CA 3.43Å; E385-H432 HydrophobicContact CB-CB 4.35Å; E385-H432 WeakPolarHBondContact CG-ND1 3.22Å; E385-H432 PolarHBondContact O-N 3.18Å; E385-H432 IonicContact OE1-ND1 3.89Å; E385-H432 IonicContact OE2-CE1 3.4Å; E385-H432 IonicContact OE2-CG 2.64Å; E385-H432 IonicContact OE2-ND1 2.75Å; E385-H432 PolarHBondContact OE2-ND1 3.29Å
386	V	92	Very high	91.7	Very high	18 Å²	18	55.6 Å²	55.6	11%	0.109	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.6	-170.2	-170.5	0	0	0	0	113.5	P344 V375 D377 A429	P344-V386 HydrophobicContact CB-CG1 3.74Å; P344-V386 HydrophobicContact CB-CG2 4.07Å; P344-V386 HydrophobicContact CG-CG1 3.88Å; P344-V386 HydrophobicContact CG-CG2 4.01Å; V375-V386 HydrophobicContact CG1-CB 4.27Å; V375-V386 HydrophobicContact CG1-CG1 3.64Å; D377-V386 HydrophobicContact CB-CG2 4.04Å; V386-A429 HydrophobicContact CG1-CB 4.07Å
387	S	91.3	Very high	91.9	Very high	42 Å²	42	52 Å²	52	29%	0.294	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.4	166.4	64.8	0	0	0	0	111.2	A429 K430	S387-A429 CarbonylContact O-C 3.59Å; S387-A429 WeakPolarHBondContact O-CA 3.42Å; S387-K430 PolarHBondContact N-O 2.84Å; S387-K430 PolarHBondContact O-N 3.16Å; S387-K430 PolarHBondContact OG-O 2.85Å
388	L	93.3	Very high	91.8	Very high	16 Å²	16	55.8 Å²	55.8	8%	0.084	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.2	174.2	-177.2	68.9	0	0	0	110.9	I346 V373 V375 L399 F407 L427 A429	I346-L388 HydrophobicContact CD1-CD1 4.34Å; V373-L388 HydrophobicContact CB-CD2 4.16Å; V373-L388 HydrophobicContact CG1-CD2 3.81Å; V375-L388 HydrophobicContact CG2-CB 4.33Å; V375-L388 HydrophobicContact CG2-CD1 4.07Å; V375-L388 HydrophobicContact CG2-CD2 3.91Å; V375-L388 HydrophobicContact CG2-CG 4.31Å; L388-L399 HydrophobicContact CB-CD1 4.41Å; L388-L399 HydrophobicContact CD2-CD1 4.07Å; L388-L399 HydrophobicContact CD2-CD2 3.86Å; L388-L399 HydrophobicContact CG-CD1 3.85Å; L388-L399 WeakPolarHBondContact O-CD1 3.45Å; L388-F407 HydrophobicContact CB-CD1 4.35Å; L388-F407 HydrophobicContact CB-CD2 4.08Å; L388-F407 HydrophobicContact CB-CE1 4.17Å; L388-F407 HydrophobicContact CB-CE2 3.89Å; L388-F407 HydrophobicContact CB-CG 4.32Å; L388-F407 HydrophobicContact CB-CZ 3.94Å; L388-F407 HydrophobicContact CD2-CB 3.77Å; L388-F407 HydrophobicContact CD2-CD1 4.31Å; L388-F407 HydrophobicContact CD2-CD2 3.57Å; L388-F407 HydrophobicContact CD2-CE2 4.24Å; L388-F407 HydrophobicContact CD2-CG 3.62Å; L388-F407 HydrophobicContact CG-CD2 4.47Å; L388-L427 HydrophobicContact CD1-CB 4.33Å; L388-L427 HydrophobicContact CD1-CD2 4.44Å; L388-A429 HydrophobicContact CD1-CB 4.03Å
389	T	93.8	Very high	91.8	Very high	71 Å²	71	55.8 Å²	55.8	44%	0.436	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	153.2	175.1	57.2	0	0	0	0	111.6	I428	T389-I428 PolarHBondContact N-O 3.27Å; T389-I428 PolarHBondContact O-N 2.75Å; T389-I428 PolarHBondContact OG1-O 2.98Å
390	I	94.9	Very high	91.5	Very high	36 Å²	36	59.7 Å²	59.7	19%	0.185	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	134.5	163.7	-73.7	170.2	0	0	0	107	S394 F397 L399 I425 L427	I390-S394 VanDerWaalsContact CG2-CB 3.43Å; I390-F397 HydrophobicContact CD1-CB 4.42Å; I390-L399 HydrophobicContact CD1-CD2 4.07Å; I390-L399 HydrophobicContact CD1-CG 3.76Å; I390-L399 HydrophobicContact CG1-CD1 4.07Å; I390-L399 HydrophobicContact CG1-CD2 4.21Å; I390-L399 HydrophobicContact CG1-CG 3.83Å; I390-I425 HydrophobicContact CD1-CG2 3.93Å; I390-I425 HydrophobicContact CG1-CG2 3.83Å; I390-I425 HydrophobicContact CG2-CG2 4.03Å; I390-L427 HydrophobicContact CG1-CD2 3.76Å
391	Q	94.2	Very high	91.2	Very high	82 Å²	82	61.5 Å²	61.5	38%	0.383	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-67.6	135.5	176.3	-159.9	-163.9	-71.6	0	0	111	G393 S394 K426 I428	Q391-G393 PolarHBondContact O-N 2.74Å; Q391-S394 WeakPolarHBondContact O-CB 3.5Å; Q391-S394 PolarHBondContact O-N 3.13Å; Q391-S394 VanDerWaalsContact O-N 3.17Å; Q391-S394 PolarHBondContact O-OG 2.69Å; Q391-K426 HydrophobicContact CB-CB 4.19Å; Q391-K426 HydrophobicContact CB-CG 4.44Å; Q391-K426 PolarHBondContact N-O 3.29Å; Q391-I428 HydrophobicContact CB-CD1 3.99Å; Q391-I428 HydrophobicContact CG-CD1 4.06Å
392	E	88.1	Confident	90.4	Very high	186 Å²	186	61.6 Å²	61.6	87%	0.869	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	136.3	169.7	-64.1	-176.6	174.9	0	0	111.3
393	G	85	Confident	89.6	Confident	85 Å²	85	58.8 Å²	58.8	88%	0.876	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.8	-6	-174	0	0	0	0	0	115.6	Q391 G395	Q391-G393 PolarHBondContact O-N 2.74Å; G393-G395 PolarHBondContact O-N 3.03Å
394	S	90.3	Very high	88.5	Confident	11 Å²	11	65.2 Å²	65.2	8%	0.077	37%	0.37	C	S	.	.	S	Bend	trans	-70.1	12.9	-179	-65.4	0	0	0	0	116.5	I390 Q391 K426	I390-S394 VanDerWaalsContact CG2-CB 3.43Å; Q391-S394 WeakPolarHBondContact O-CB 3.5Å; Q391-S394 PolarHBondContact O-N 3.13Å; Q391-S394 VanDerWaalsContact O-N 3.17Å; Q391-S394 PolarHBondContact O-OG 2.69Å; S394-K426 PolarHBondContact OG-N 3.15Å
395	G	88.6	Confident	87.9	Confident	34 Å²	34	69.9 Å²	69.9	35%	0.351	39%	0.387	S	S	.	.			trans	89.4	-178.2	-173.2	0	0	0	0	0	114.6	G393 F397	G393-G395 PolarHBondContact O-N 3.03Å; G395-F397 PolarHBondContact O-N 3.25Å
396	P	93.4	Very high	87.7	Confident	26 Å²	26	68 Å²	68	17%	0.169	38%	0.38	C	S	.	.	S	Bend	trans	-81.8	54.4	-171.1	35.2	-37	0	0	0	112.9	N412 D413 L415 Y423	P396-N412 WeakPolarHBondContact O-CB 3.26Å; P396-N412 PolarHBondContact O-N 3.28Å; P396-D413 HydrophobicContact CB-CB 3.69Å; P396-L415 HydrophobicContact CG-CD2 3.61Å; P396-Y423 VanDerWaalsContact CD-CE1 3.41Å; P396-Y423 HydrophobicContact CG-CE1 4.47Å
397	F	94.4	Very high	87.7	Confident	16 Å²	16	68 Å²	68	7%	0.07	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	149.1	-178.1	-54.8	-79.6	0	0	0	111.7	L370 I390 G395 I409 V410 T411 L415 Y423 I425 V445	L370-F397 HydrophobicContact CD2-CD1 4.46Å; L370-F397 HydrophobicContact CD2-CE1 4.34Å; I390-F397 HydrophobicContact CD1-CB 4.42Å; G395-F397 PolarHBondContact O-N 3.25Å; F397-I409 HydrophobicContact CB-CG2 4.12Å; F397-I409 HydrophobicContact CD1-CG2 4.44Å; F397-V410 WeakPolarHBondContact CA-O 3.34Å; F397-T411 HydrophobicContact CE1-CG2 4.37Å; F397-L415 HydrophobicContact CE1-CD2 4.41Å; F397-L415 HydrophobicContact CZ-CD2 4.04Å; F397-Y423 HydrophobicContact CE2-CD1 4.03Å; F397-Y423 AromaticContact CE2-CD2 3.8Å; F397-Y423 HydrophobicContact CE2-CD2 3.8Å; F397-Y423 HydrophobicContact CE2-CE2 4.36Å; F397-Y423 AromaticContact CE2-CG 3.6Å; F397-Y423 HydrophobicContact CE2-CG 3.6Å; F397-Y423 AromaticContact CZ-CD2 3.85Å; F397-Y423 HydrophobicContact CZ-CD2 3.85Å; F397-Y423 HydrophobicContact CZ-CE2 4.32Å; F397-Y423 HydrophobicContact CZ-CG 4.14Å; F397-I425 HydrophobicContact CB-CD1 3.88Å; F397-I425 HydrophobicContact CD1-CD1 4.02Å; F397-I425 HydrophobicContact CD2-CD1 3.51Å; F397-I425 HydrophobicContact CD2-CG1 3.75Å; F397-I425 HydrophobicContact CE1-CD1 4.47Å; F397-I425 HydrophobicContact CE2-CD1 4.02Å; F397-I425 HydrophobicContact CE2-CG1 4.17Å; F397-I425 HydrophobicContact CG-CD1 3.51Å; F397-I425 HydrophobicContact CG-CG1 4.25Å; F397-I425 HydrophobicContact CZ-CD1 4.47Å; F397-V445 HydrophobicContact CZ-CG1 4.39Å
398	R	93.1	Very high	87.7	Confident	101 Å²	101	68.2 Å²	68.2	38%	0.381	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	150.3	177.7	70.3	-163	-154.8	134.8	-3.5	111.9	D367 V410 N412	D367-R398 VanDerWaalsContact CG-NH2 3.25Å; D367-R398 IonicContact OD1-CZ 2.66Å; D367-R398 IonicContact OD1-NE 2.66Å; D367-R398 PolarHBondContact OD1-NE 2.65Å; D367-R398 IonicContact OD1-NH2 3.33Å; D367-R398 PolarHBondContact OD1-NH2 3.41Å; D367-R398 IonicContact OD2-NH2 2.68Å; D367-R398 PolarHBondContact OD2-NH2 3.01Å; D367-R398 VanDerWaalsContact OD2-NH2 3.12Å; R398-V410 HydrophobicContact CG-CG2 3.44Å; R398-V410 VanDerWaalsContact CG-CG2 3.44Å; R398-V410 PolarHBondContact N-O 3.16Å; R398-V410 PolarHBondContact O-N 2.96Å; R398-N412 HydrophobicContact CB-CB 4.1Å; R398-N412 WeakPolarHBondContact CD-OD1 3.07Å; R398-N412 HydrophobicContact CG-CB 4.15Å
399	L	93.2	Very high	87.8	Confident	47 Å²	47	67.5 Å²	67.5	25%	0.246	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	137.8	167.7	-69.1	170	0	0	0	110.1	L388 I390 F407 I409 L427	L388-L399 HydrophobicContact CB-CD1 4.41Å; L388-L399 HydrophobicContact CD2-CD1 4.07Å; L388-L399 HydrophobicContact CD2-CD2 3.86Å; L388-L399 HydrophobicContact CG-CD1 3.85Å; L388-L399 WeakPolarHBondContact O-CD1 3.45Å; I390-L399 HydrophobicContact CD1-CD2 4.07Å; I390-L399 HydrophobicContact CD1-CG 3.76Å; I390-L399 HydrophobicContact CG1-CD1 4.07Å; I390-L399 HydrophobicContact CG1-CD2 4.21Å; I390-L399 HydrophobicContact CG1-CG 3.83Å; L399-F407 HydrophobicContact CD2-CB 4.21Å; L399-I409 HydrophobicContact CD2-CG1 3.9Å; L399-L427 HydrophobicContact CD2-CD2 4.48Å
400	K	90.1	Very high	87.8	Confident	90 Å²	90	64.3 Å²	64.3	39%	0.391	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	105.8	173.4	-174.5	173	-174.6	172.1	0	107.2	D367 S402 L408 V410	D367-K400 IonicContact OD2-NZ 3.27Å; D367-K400 PolarHBondContact OD2-NZ 3.3Å; K400-S402 PolarHBondContact O-N 3.48Å; K400-L408 HydrophobicContact CB-CB 4.37Å; K400-L408 PolarHBondContact N-O 2.78Å; K400-L408 PolarHBondContact O-N 3.2Å; K400-V410 HydrophobicContact CB-CG2 4.46Å; K400-V410 HydrophobicContact CD-CG1 4.46Å
401	S	83.8	Confident	87.7	Confident	80 Å²	80	62.6 Å²	62.6	56%	0.559	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.9	133.3	175.8	-108.4	0	0	0	0	110	D403 F407	S401-D403 PolarHBondContact OG-O 3.45Å; S401-F407 WeakPolarHBondContact OG-CD1 3.49Å; S401-F407 WeakPolarHBondContact OG-CE1 2.98Å
402	S	74.9	Confident	87.7	Confident	72 Å²	72	62.2 Å²	62.2	50%	0.503	35%	0.345	S	S	.	.	S	Bend	trans	-97.8	-47.6	165.1	-175.5	0	0	0	0	109.6	K400 N406	K400-S402 PolarHBondContact O-N 3.48Å; S402-N406 WeakPolarHBondContact CB-O 3.45Å; S402-N406 PolarHBondContact N-O 3.12Å
403	D	73.4	Confident	87.9	Confident	87 Å²	87	57.6 Å²	57.6	47%	0.465	33%	0.326	S	S	.	.	S	Bend	trans	-136.3	-171.7	176.9	-56.2	-77.7	0	0	0	110	S401 F405 N406	S401-D403 PolarHBondContact OG-O 3.45Å; D403-F405 VanDerWaalsContact C-N 3.31Å; D403-F405 PolarHBondContact O-N 3.44Å; D403-N406 HydrophobicContact CB-CB 4.02Å; D403-N406 PolarHBondContact N-O 3.32Å; D403-N406 VanDerWaalsContact N-O 3.08Å; D403-N406 PolarHBondContact OD2-ND2 3.35Å
404	H	69.1	Low	88.2	Confident	164 Å²	164	57.8 Å²	57.8	76%	0.759	31%	0.314	S	S	*	.	S	Bend	trans	-63.6	-33	173.5	-68	84.4	0	0	0	113.2
405	F	78	Confident	88.4	Confident	111 Å²	111	57.8 Å²	57.8	49%	0.487	31%	0.313	S	S	.	.	S	Bend	trans	-113.1	-9.2	-176.6	-59.1	-69	0	0	0	113.7	T374 V375 D403	T374-F405 WeakPolarHBondContact CA-O 3.48Å; V375-F405 PolarHBondContact N-O 3.2Å; V375-F405 WeakPolarHBondContact O-CB 3.28Å; V375-F405 WeakPolarHBondContact O-CD1 3.08Å; D403-F405 VanDerWaalsContact C-N 3.31Å; D403-F405 PolarHBondContact O-N 3.44Å
406	N	87.7	Confident	88.7	Confident	53 Å²	53	58.4 Å²	58.4	28%	0.283	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.8	-174.1	-61	-38.9	0	0	0	110.5	L372 T374 S402 D403	L372-N406 HydrophobicContact CD1-CB 4.37Å; T374-N406 WeakPolarHBondContact CG2-OD1 3.09Å; S402-N406 WeakPolarHBondContact CB-O 3.45Å; S402-N406 PolarHBondContact N-O 3.12Å; D403-N406 HydrophobicContact CB-CB 4.02Å; D403-N406 PolarHBondContact N-O 3.32Å; D403-N406 VanDerWaalsContact N-O 3.08Å; D403-N406 PolarHBondContact OD2-ND2 3.35Å
407	F	91.6	Very high	88.8	Confident	19 Å²	19	58.3 Å²	58.3	8%	0.083	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143	-179.9	-53.4	-93.2	0	0	0	110.5	V373 V375 L388 L399 S401	V373-F407 HydrophobicContact CB-CB 4.41Å; V373-F407 PolarHBondContact N-O 3.36Å; V373-F407 PolarHBondContact O-N 3.13Å; V375-F407 HydrophobicContact CB-CE2 4.3Å; V375-F407 HydrophobicContact CG2-CD2 4.03Å; V375-F407 HydrophobicContact CG2-CE2 4.06Å; L388-F407 HydrophobicContact CB-CD1 4.35Å; L388-F407 HydrophobicContact CB-CD2 4.08Å; L388-F407 HydrophobicContact CB-CE1 4.17Å; L388-F407 HydrophobicContact CB-CE2 3.89Å; L388-F407 HydrophobicContact CB-CG 4.32Å; L388-F407 HydrophobicContact CB-CZ 3.94Å; L388-F407 HydrophobicContact CD2-CB 3.77Å; L388-F407 HydrophobicContact CD2-CD1 4.31Å; L388-F407 HydrophobicContact CD2-CD2 3.57Å; L388-F407 HydrophobicContact CD2-CE2 4.24Å; L388-F407 HydrophobicContact CD2-CG 3.62Å; L388-F407 HydrophobicContact CG-CD2 4.47Å; L399-F407 HydrophobicContact CD2-CB 4.21Å; S401-F407 WeakPolarHBondContact OG-CD1 3.49Å; S401-F407 WeakPolarHBondContact OG-CE1 2.98Å
408	L	91.9	Very high	88.8	Confident	46 Å²	46	60.3 Å²	60.3	24%	0.241	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.2	176.3	-51	172.9	0	0	0	108.5	F369 L372 K400 V410	F369-L408 HydrophobicContact CD2-CB 4.25Å; F369-L408 HydrophobicContact CD2-CD2 4.09Å; F369-L408 HydrophobicContact CE2-CB 4.38Å; F369-L408 HydrophobicContact CE2-CD2 3.67Å; L372-L408 HydrophobicContact CD1-CD2 3.78Å; K400-L408 HydrophobicContact CB-CB 4.37Å; K400-L408 PolarHBondContact N-O 2.78Å; K400-L408 PolarHBondContact O-N 3.2Å; L408-V410 HydrophobicContact CB-CG1 4.24Å
409	I	93.9	Very high	88.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.4	165	-60.3	176.2	0	0	0	107.6	L370 V371 V373 F397 L399 I425 L427 L443	L370-I409 HydrophobicContact CB-CG2 4.35Å; L370-I409 WeakPolarHBondContact CB-O 3.36Å; L370-I409 HydrophobicContact CD2-CG2 3.96Å; L370-I409 PolarHBondContact N-O 3.14Å; V371-I409 HydrophobicContact CB-CB 4.38Å; V371-I409 HydrophobicContact CB-CD1 4.24Å; V371-I409 PolarHBondContact O-N 3.15Å; V373-I409 HydrophobicContact CG2-CD1 3.65Å; V373-I409 HydrophobicContact CG2-CG1 3.77Å; F397-I409 HydrophobicContact CB-CG2 4.12Å; F397-I409 HydrophobicContact CD1-CG2 4.44Å; L399-I409 HydrophobicContact CD2-CG1 3.9Å; I409-I425 HydrophobicContact CD1-CD1 4.47Å; I409-I425 HydrophobicContact CD1-CG2 4.44Å; I409-I425 HydrophobicContact CG2-CD1 3.84Å; I409-L427 HydrophobicContact CD1-CD1 4.36Å; I409-L427 HydrophobicContact CD1-CD2 4.03Å; I409-L443 HydrophobicContact CD1-CD2 3.53Å
410	V	93.3	Very high	88.8	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.024	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	157.8	178.2	-51.3	0	0	0	0	111.3	D367 T368 F397 R398 K400 L408	D367-V410 VanDerWaalsContact OD1-CG2 3.25Å; D367-V410 WeakPolarHBondContact OD1-CG2 3Å; T368-V410 WeakPolarHBondContact O-CA 3.39Å; T368-V410 WeakPolarHBondContact O-CB 3.07Å; F397-V410 WeakPolarHBondContact CA-O 3.34Å; R398-V410 HydrophobicContact CG-CG2 3.44Å; R398-V410 VanDerWaalsContact CG-CG2 3.44Å; R398-V410 PolarHBondContact N-O 3.16Å; R398-V410 PolarHBondContact O-N 2.96Å; K400-V410 HydrophobicContact CB-CG2 4.46Å; K400-V410 HydrophobicContact CD-CG1 4.46Å; L408-V410 HydrophobicContact CB-CG1 4.24Å
411	T	94.1	Very high	88.9	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	138.1	173.1	50	0	0	0	0	111.3	V360 P365 I366 D367 T368 F397 L415	V360-T411 HydrophobicContact CG2-CG2 4.2Å; P365-T411 PolarHBondContact O-OG1 2.92Å; I366-T411 WeakPolarHBondContact CA-OG1 3.15Å; D367-T411 PolarHBondContact N-O 3.39Å; D367-T411 PolarHBondContact N-OG1 2.96Å; T368-T411 PolarHBondContact N-OG1 2.8Å; T368-T411 PolarHBondContact O-N 2.84Å; T368-T411 VanDerWaalsContact O-N 3.11Å; F397-T411 HydrophobicContact CE1-CG2 4.37Å; T411-L415 HydrophobicContact CG2-CD1 3.79Å; T411-L415 HydrophobicContact CG2-CG 4.43Å
412	N	93.8	Very high	89.3	Confident	75 Å²	75	63.3 Å²	63.3	40%	0.401	33%	0.33	S	S	.	.			trans	-107.8	-25.7	178.1	-175.5	86.3	0	0	0	112.9	P396 R398	P396-N412 WeakPolarHBondContact O-CB 3.26Å; P396-N412 PolarHBondContact O-N 3.28Å; R398-N412 HydrophobicContact CB-CB 4.1Å; R398-N412 WeakPolarHBondContact CD-OD1 3.07Å; R398-N412 HydrophobicContact CG-CB 4.15Å
413	D	92	Very high	90.3	Very high	88 Å²	88	61.9 Å²	61.9	47%	0.471	31%	0.314	S	S	.	.	S	Bend	trans	-141.1	176.5	-178.1	-145	-26.8	0	0	0	109.5	P396	P396-D413 HydrophobicContact CB-CB 3.69Å
414	S	91.9	Very high	91.3	Very high	89 Å²	89	61.8 Å²	61.8	62%	0.622	31%	0.314	S	S	*	.			trans	-63.1	143.5	172.2	53.4	0	0	0	0	112
415	L	94.2	Very high	92.5	Very high	11 Å²	11	54 Å²	54	6%	0.058	28%	0.278	C	S	.	.			trans	-101.4	159.3	172.1	-69.7	171.3	0	0	0	110.2	V360 E362 P396 F397 T411 Y423	V360-L415 HydrophobicContact CB-CD1 4.29Å; V360-L415 HydrophobicContact CG1-CD1 3.58Å; V360-L415 HydrophobicContact CG2-CD1 3.7Å; E362-L415 HydrophobicContact CB-CB 4.31Å; P396-L415 HydrophobicContact CG-CD2 3.61Å; F397-L415 HydrophobicContact CE1-CD2 4.41Å; F397-L415 HydrophobicContact CZ-CD2 4.04Å; T411-L415 HydrophobicContact CG2-CD1 3.79Å; T411-L415 HydrophobicContact CG2-CG 4.43Å; L415-Y423 HydrophobicContact CD2-CE2 3.69Å
416	D	94.2	Very high	93.3	Very high	48 Å²	48	51.8 Å²	51.8	26%	0.257	27%	0.268	S	S	.	.			trans	-163.2	109	-169.7	-171.7	-74.2	0	0	0	108.1	K419 V420	D416-K419 HydrophobicContact CB-CB 4.37Å; D416-K419 HydrophobicContact CB-CD 4.27Å; D416-K419 WeakPolarHBondContact OD1-CB 3.46Å; D416-K419 WeakPolarHBondContact OD1-CD 3.3Å; D416-K419 WeakPolarHBondContact OD1-CG 3.2Å; D416-K419 PolarHBondContact OD1-N 2.77Å; D416-K419 IonicContact OD1-NZ 2.61Å; D416-K419 PolarHBondContact OD1-NZ 3.44Å; D416-K419 WeakPolarHBondContact OD2-CE 3.41Å; D416-K419 IonicContact OD2-NZ 2.91Å; D416-K419 PolarHBondContact OD2-NZ 3.23Å; D416-V420 PolarHBondContact O-N 3.2Å
417	R	95.4	Very high	93.6	Very high	23 Å²	23	49.2 Å²	49.2	9%	0.087	25%	0.254	C	S	.	.	H	α-helix	trans	-81.7	-30.8	-167.3	-177.1	-136	60.7	116.7	2.9	111.4	E362 K419 V420 N421 V447 D449 D484	E362-R417 WeakPolarHBondContact OE2-CA 3.48Å; E362-R417 WeakPolarHBondContact OE2-CB 3.19Å; E362-R417 PolarHBondContact OE2-N 3.32Å; R417-K419 VanDerWaalsContact C-N 3.28Å; R417-K419 PolarHBondContact O-N 2.58Å; R417-V420 CarbonylContact O-C 3.56Å; R417-V420 PolarHBondContact O-N 2.89Å; R417-N421 HydrophobicContact CG-CB 3.8Å; R417-N421 WeakPolarHBondContact O-CA 3.3Å; R417-N421 WeakPolarHBondContact O-CB 3.25Å; R417-N421 PolarHBondContact O-N 3.17Å; R417-V447 HydrophobicContact CB-CB 4.22Å; R417-V447 HydrophobicContact CB-CG1 3.82Å; R417-V447 HydrophobicContact CG-CB 4.21Å; R417-V447 HydrophobicContact CG-CG1 4.27Å; R417-D449 WeakPolarHBondContact CD-OD1 3.23Å; R417-D449 IonicContact CZ-OD1 2.65Å; R417-D449 IonicContact NE-OD1 3.12Å; R417-D449 PolarHBondContact NE-OD1 3.43Å; R417-D449 IonicContact NH1-OD1 3.79Å; R417-D449 PolarHBondContact NH1-OD1 3.28Å; R417-D449 IonicContact NH2-OD1 2.74Å; R417-D484 PolarHBondContact NH2-O 3.26Å
418	E	94.3	Very high	93.8	Very high	58 Å²	58	50 Å²	50	27%	0.271	26%	0.259	S	S	.	.	H	α-helix	trans	-63.8	-37.5	175.8	-62	57.8	-111.8	0	0	109.7	D484	E418-D484 HydrophobicContact CG-CB 4.11Å
419	K	92.6	Very high	94	Very high	155 Å²	155	47.9 Å²	47.9	67%	0.674	25%	0.248	S	C	*	.	H	α-helix	trans	-76.8	-50.3	170.9	-70.4	166.8	-160	67.8	0	112.2	D416 R417	D416-K419 HydrophobicContact CB-CB 4.37Å; D416-K419 HydrophobicContact CB-CD 4.27Å; D416-K419 WeakPolarHBondContact OD1-CB 3.46Å; D416-K419 WeakPolarHBondContact OD1-CD 3.3Å; D416-K419 WeakPolarHBondContact OD1-CG 3.2Å; D416-K419 PolarHBondContact OD1-N 2.77Å; D416-K419 IonicContact OD1-NZ 2.61Å; D416-K419 PolarHBondContact OD1-NZ 3.44Å; D416-K419 WeakPolarHBondContact OD2-CE 3.41Å; D416-K419 IonicContact OD2-NZ 2.91Å; D416-K419 PolarHBondContact OD2-NZ 3.23Å; R417-K419 VanDerWaalsContact C-N 3.28Å; R417-K419 PolarHBondContact O-N 2.58Å
420	V	93.8	Very high	94	Very high	55 Å²	55	51.7 Å²	51.7	33%	0.333	26%	0.264	S	S	.	.	H	α-helix	trans	-145.9	89.3	-174.8	-170.3	0	0	0	0	112.3	D416 R417 N422 Y423 V447	D416-V420 PolarHBondContact O-N 3.2Å; R417-V420 CarbonylContact O-C 3.56Å; R417-V420 PolarHBondContact O-N 2.89Å; V420-N422 VanDerWaalsContact C-N 3.31Å; V420-N422 WeakPolarHBondContact CG1-O 3.21Å; V420-N422 PolarHBondContact O-N 2.66Å; V420-Y423 HydrophobicContact CB-CE1 4.16Å; V420-Y423 HydrophobicContact CB-CE2 4.13Å; V420-Y423 HydrophobicContact CG1-CD1 3.98Å; V420-Y423 HydrophobicContact CG1-CD2 4.21Å; V420-Y423 HydrophobicContact CG1-CE1 3.61Å; V420-Y423 HydrophobicContact CG1-CE2 3.86Å; V420-Y423 HydrophobicContact CG1-CG 4.28Å; V420-V447 WeakPolarHBondContact O-CG2 3.13Å
421	N	92.4	Very high	94	Very high	84 Å²	84	51.5 Å²	51.5	45%	0.449	26%	0.263	S	S	.	.	S	Bend	trans	-68.7	-19.1	-180	63	23.1	0	0	0	115.7	R417 V447	R417-N421 HydrophobicContact CG-CB 3.8Å; R417-N421 WeakPolarHBondContact O-CA 3.3Å; R417-N421 WeakPolarHBondContact O-CB 3.25Å; R417-N421 PolarHBondContact O-N 3.17Å; N421-V447 PolarHBondContact O-N 3.12Å
422	N	93.9	Very high	94	Very high	87 Å²	87	55.1 Å²	55.1	47%	0.465	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	138.9	179.3	-66.4	-86.1	0	0	0	111.4	V420 V445 S446	V420-N422 VanDerWaalsContact C-N 3.31Å; V420-N422 WeakPolarHBondContact CG1-O 3.21Å; V420-N422 PolarHBondContact O-N 2.66Å; N422-V445 CarbonylContact C-O 3.54Å; N422-V445 VanDerWaalsContact CA-O 3.32Å; N422-V445 WeakPolarHBondContact CA-O 3.27Å; N422-S446 WeakPolarHBondContact OD1-CA 3.42Å; N422-S446 WeakPolarHBondContact OD1-CB 3.38Å; N422-S446 PolarHBondContact OD1-OG 2.89Å
423	Y	94.1	Very high	93.9	Very high	42 Å²	42	51.8 Å²	51.8	17%	0.165	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	160.9	172.8	-65.3	-89.6	0	0	0	110.7	P396 F397 L415 V420 P444 V445 V447	P396-Y423 VanDerWaalsContact CD-CE1 3.41Å; P396-Y423 HydrophobicContact CG-CE1 4.47Å; F397-Y423 HydrophobicContact CE2-CD1 4.03Å; F397-Y423 AromaticContact CE2-CD2 3.8Å; F397-Y423 HydrophobicContact CE2-CD2 3.8Å; F397-Y423 HydrophobicContact CE2-CE2 4.36Å; F397-Y423 AromaticContact CE2-CG 3.6Å; F397-Y423 HydrophobicContact CE2-CG 3.6Å; F397-Y423 AromaticContact CZ-CD2 3.85Å; F397-Y423 HydrophobicContact CZ-CD2 3.85Å; F397-Y423 HydrophobicContact CZ-CE2 4.32Å; F397-Y423 HydrophobicContact CZ-CG 4.14Å; L415-Y423 HydrophobicContact CD2-CE2 3.69Å; V420-Y423 HydrophobicContact CB-CE1 4.16Å; V420-Y423 HydrophobicContact CB-CE2 4.13Å; V420-Y423 HydrophobicContact CG1-CD1 3.98Å; V420-Y423 HydrophobicContact CG1-CD2 4.21Å; V420-Y423 HydrophobicContact CG1-CE1 3.61Å; V420-Y423 HydrophobicContact CG1-CE2 3.86Å; V420-Y423 HydrophobicContact CG1-CG 4.28Å; Y423-P444 CarbonylContact O-C 3.59Å; Y423-P444 WeakPolarHBondContact O-CA 3.36Å; Y423-V445 PolarHBondContact N-O 2.6Å; Y423-V445 PolarHBondContact O-N 3.41Å; Y423-V447 HydrophobicContact CD2-CG2 3.98Å; Y423-V447 HydrophobicContact CE2-CG2 3.82Å
424	N	94.4	Very high	93.7	Very high	86 Å²	86	54.6 Å²	54.6	46%	0.46	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	96.2	172.2	-176.7	17.4	0	0	0	108.4	K426 N442	N424-K426 PolarHBondContact O-N 2.85Å; N424-N442 WeakPolarHBondContact OD1-CB 3.28Å
425	I	94.6	Very high	93.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	112.6	-177	-58.1	178.7	0	0	0	108.3	L370 I390 F397 I409 L427 L443 V445	L370-I425 HydrophobicContact CD2-CD1 4.06Å; I390-I425 HydrophobicContact CD1-CG2 3.93Å; I390-I425 HydrophobicContact CG1-CG2 3.83Å; I390-I425 HydrophobicContact CG2-CG2 4.03Å; F397-I425 HydrophobicContact CB-CD1 3.88Å; F397-I425 HydrophobicContact CD1-CD1 4.02Å; F397-I425 HydrophobicContact CD2-CD1 3.51Å; F397-I425 HydrophobicContact CD2-CG1 3.75Å; F397-I425 HydrophobicContact CE1-CD1 4.47Å; F397-I425 HydrophobicContact CE2-CD1 4.02Å; F397-I425 HydrophobicContact CE2-CG1 4.17Å; F397-I425 HydrophobicContact CG-CD1 3.51Å; F397-I425 HydrophobicContact CG-CG1 4.25Å; F397-I425 HydrophobicContact CZ-CD1 4.47Å; I409-I425 HydrophobicContact CD1-CD1 4.47Å; I409-I425 HydrophobicContact CD1-CG2 4.44Å; I409-I425 HydrophobicContact CG2-CD1 3.84Å; I425-L427 HydrophobicContact CG2-CD2 4.21Å; I425-L427 HydrophobicContact CG2-CG 4.44Å; I425-L427 PolarHBondContact O-N 2.85Å; I425-L443 HydrophobicContact CB-CB 4.31Å; I425-L443 PolarHBondContact N-O 3.47Å; I425-L443 PolarHBondContact O-N 2.78Å; I425-V445 HydrophobicContact CD1-CG2 3.65Å; I425-V445 HydrophobicContact CG1-CG2 3.87Å
426	K	95.3	Very high	93.7	Very high	64 Å²	64	56.7 Å²	56.7	28%	0.278	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	103	178.6	-173.5	168.3	170.4	-148.7	0	110.1	Q391 S394 N424 I440 N442	Q391-K426 HydrophobicContact CB-CB 4.19Å; Q391-K426 HydrophobicContact CB-CG 4.44Å; Q391-K426 PolarHBondContact N-O 3.29Å; S394-K426 PolarHBondContact OG-N 3.15Å; N424-K426 PolarHBondContact O-N 2.85Å; K426-I440 HydrophobicContact CD-CG2 4.15Å; K426-I440 HydrophobicContact CG-CG2 3.81Å; K426-N442 WeakPolarHBondContact CG-OD1 3.34Å
427	L	95.3	Very high	93.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	137.8	175.7	-64.1	172.2	0	0	0	109.8	I346 T348 V373 L388 I390 L399 I409 I425 I440 E441 L443	I346-L427 HydrophobicContact CD1-CB 4.12Å; I346-L427 HydrophobicContact CG2-CD1 4.27Å; T348-L427 HydrophobicContact CG2-CD1 4.24Å; V373-L427 HydrophobicContact CG1-CD1 4.15Å; V373-L427 HydrophobicContact CG2-CD1 4.16Å; L388-L427 HydrophobicContact CD1-CB 4.33Å; L388-L427 HydrophobicContact CD1-CD2 4.44Å; I390-L427 HydrophobicContact CG1-CD2 3.76Å; L399-L427 HydrophobicContact CD2-CD2 4.48Å; I409-L427 HydrophobicContact CD1-CD1 4.36Å; I409-L427 HydrophobicContact CD1-CD2 4.03Å; I425-L427 HydrophobicContact CG2-CD2 4.21Å; I425-L427 HydrophobicContact CG2-CG 4.44Å; I425-L427 PolarHBondContact O-N 2.85Å; L427-I440 VanDerWaalsContact O-CA 3.3Å; L427-I440 WeakPolarHBondContact O-CA 3.48Å; L427-E441 HydrophobicContact CB-CB 4.39Å; L427-E441 PolarHBondContact N-O 2.88Å; L427-E441 PolarHBondContact O-N 2.68Å; L427-E441 VanDerWaalsContact O-N 3.07Å; L427-L443 HydrophobicContact CD1-CD2 4.48Å
428	I	94.9	Very high	93.7	Very high	36 Å²	36	59.3 Å²	59.3	19%	0.185	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	106.3	176.1	-55	179.1	0	0	0	107.2	T389 Q391 V438 I440	T389-I428 PolarHBondContact N-O 3.27Å; T389-I428 PolarHBondContact O-N 2.75Å; T389-I428 PolarHBondContact OG1-O 2.98Å; Q391-I428 HydrophobicContact CB-CD1 3.99Å; Q391-I428 HydrophobicContact CG-CD1 4.06Å; I428-V438 HydrophobicContact CG2-CG1 3.57Å; I428-I440 HydrophobicContact CG1-CG1 4.35Å
429	A	94.9	Very high	93.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	133.5	170.5	0	0	0	0	0	109.1	P344 I346 V375 V386 S387 L388 V438 T439	P344-A429 HydrophobicContact CB-CB 3.79Å; I346-A429 HydrophobicContact CD1-CB 3.66Å; I346-A429 HydrophobicContact CG1-CB 3.71Å; V375-A429 HydrophobicContact CG1-CB 3.9Å; V386-A429 HydrophobicContact CG1-CB 4.07Å; S387-A429 CarbonylContact O-C 3.59Å; S387-A429 WeakPolarHBondContact O-CA 3.42Å; L388-A429 HydrophobicContact CD1-CB 4.03Å; A429-V438 CarbonylContact O-C 3.56Å; A429-V438 WeakPolarHBondContact O-CA 3.46Å; A429-T439 PolarHBondContact N-O 2.91Å; A429-T439 PolarHBondContact O-N 3.34Å
430	K	94.3	Very high	93.9	Very high	81 Å²	81	55.3 Å²	55.3	35%	0.352	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	131.2	-176.9	161.1	166.5	170.9	153.4	0	110.3	S387 S436 V438	S387-K430 PolarHBondContact N-O 2.84Å; S387-K430 PolarHBondContact O-N 3.16Å; S387-K430 PolarHBondContact OG-O 2.85Å; K430-S436 WeakPolarHBondContact CE-OG 3.47Å; K430-S436 PolarHBondContact NZ-OG 3.19Å; K430-V438 HydrophobicContact CB-CG2 4.07Å; K430-V438 HydrophobicContact CD-CG2 4.13Å; K430-V438 HydrophobicContact CG-CG2 4.14Å
431	D	94.9	Very high	93.9	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	175.4	172.9	65.8	45.5	0	0	0	113.8	N340 P344 N383 E385 G433 S436 L437	N340-D431 PolarHBondContact ND2-OD2 2.83Å; P344-D431 HydrophobicContact CG-CB 4.1Å; N383-D431 VanDerWaalsContact O-CB 3.26Å; N383-D431 WeakPolarHBondContact O-CB 3.29Å; E385-D431 CarbonylContact O-C 3.56Å; E385-D431 WeakPolarHBondContact O-CA 3.43Å; D431-G433 WeakPolarHBondContact OD1-CA 3.16Å; D431-G433 PolarHBondContact OD1-N 3.18Å; D431-S436 WeakPolarHBondContact OD1-CA 3.43Å; D431-S436 WeakPolarHBondContact OD1-CB 3.18Å; D431-L437 VanDerWaalsContact CG-N 3.29Å; D431-L437 PolarHBondContact N-O 3Å; D431-L437 PolarHBondContact OD1-N 3.27Å; D431-L437 VanDerWaalsContact OD1-N 3.13Å; D431-L437 VanDerWaalsContact OD2-CA 3.25Å; D431-L437 WeakPolarHBondContact OD2-CA 3.27Å; D431-L437 WeakPolarHBondContact OD2-CB 3.47Å; D431-L437 PolarHBondContact OD2-N 3.39Å
432	H	93.4	Very high	94	Very high	76 Å²	76	55.5 Å²	55.5	35%	0.352	30%	0.295	S	S	.	.	S	Bend	trans	-104	21.8	170.1	-62.5	166.6	0	0	0	113.2	K382 E385 N434	K382-H432 CarbonylContact O-C 3.57Å; K382-H432 WeakPolarHBondContact O-CB 3.47Å; E385-H432 HydrophobicContact CB-CB 4.35Å; E385-H432 WeakPolarHBondContact CG-ND1 3.22Å; E385-H432 PolarHBondContact O-N 3.18Å; E385-H432 IonicContact OE1-ND1 3.89Å; E385-H432 IonicContact OE2-CE1 3.4Å; E385-H432 IonicContact OE2-CG 2.64Å; E385-H432 IonicContact OE2-ND1 2.75Å; E385-H432 PolarHBondContact OE2-ND1 3.29Å; H432-N434 PolarHBondContact O-ND2 3.12Å
433	G	91.6	Very high	94	Very high	4 Å²	4	51.6 Å²	51.6	4%	0.041	27%	0.274	C	S	.	.			trans	-65	170.9	174.9	0	0	0	0	0	115.3	N340 D431 P435 S436	N340-G433 WeakPolarHBondContact OD1-CA 3.25Å; D431-G433 WeakPolarHBondContact OD1-CA 3.16Å; D431-G433 PolarHBondContact OD1-N 3.18Å; G433-P435 VanDerWaalsContact C-C 3.49Å; G433-P435 CarbonylContact C-O 3.56Å; G433-P435 CarbonylContact O-C 3.57Å; G433-S436 WeakPolarHBondContact O-CA 3.19Å; G433-S436 WeakPolarHBondContact O-CB 2.93Å; G433-S436 PolarHBondContact O-N 3Å
434	N	88.1	Confident	94	Very high	148 Å²	148	52.7 Å²	52.7	79%	0.791	29%	0.286	S	S	*	.	S	Bend	trans	-141.1	96.6	177.4	-72.2	-92.9	0	0	0	110.8	H432	H432-N434 PolarHBondContact O-ND2 3.12Å
435	P	92.5	Very high	94	Very high	103 Å²	103	48.6 Å²	48.6	67%	0.669	27%	0.265	S	S	*	.	S	Bend	cis	-67.6	151.7	1.6	31.8	-36.8	0	0	0	112.1	G433	G433-P435 VanDerWaalsContact C-C 3.49Å; G433-P435 CarbonylContact C-O 3.56Å; G433-P435 CarbonylContact O-C 3.57Å
436	S	94	Very high	93.9	Very high	41 Å²	41	50 Å²	50	29%	0.287	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-86.3	129.7	177.4	63.4	0	0	0	0	111.9	K430 D431 G433	K430-S436 WeakPolarHBondContact CE-OG 3.47Å; K430-S436 PolarHBondContact NZ-OG 3.19Å; D431-S436 WeakPolarHBondContact OD1-CA 3.43Å; D431-S436 WeakPolarHBondContact OD1-CB 3.18Å; G433-S436 WeakPolarHBondContact O-CA 3.19Å; G433-S436 WeakPolarHBondContact O-CB 2.93Å; G433-S436 PolarHBondContact O-N 3Å
437	L	94.6	Very high	93.8	Very high	56 Å²	56	47.2 Å²	47.2	29%	0.293	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-91.2	161	175.1	-55.1	175.5	0	0	0	111.1	N340 H342 A343 D431	N340-L437 WeakPolarHBondContact ND2-CD1 3.16Å; N340-L437 WeakPolarHBondContact ND2-CG 3.12Å; H342-L437 WeakPolarHBondContact O-CD1 3.11Å; A343-L437 HydrophobicContact CB-CB 3.93Å; A343-L437 HydrophobicContact CB-CD1 4.34Å; D431-L437 VanDerWaalsContact CG-N 3.29Å; D431-L437 PolarHBondContact N-O 3Å; D431-L437 PolarHBondContact OD1-N 3.27Å; D431-L437 VanDerWaalsContact OD1-N 3.13Å; D431-L437 VanDerWaalsContact OD2-CA 3.25Å; D431-L437 WeakPolarHBondContact OD2-CA 3.27Å; D431-L437 WeakPolarHBondContact OD2-CB 3.47Å; D431-L437 PolarHBondContact OD2-N 3.39Å
438	V	94.9	Very high	93.7	Very high	69 Å²	69	50.6 Å²	50.6	42%	0.418	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	128.2	-169.7	-176.3	0	0	0	0	110.1	I428 A429 K430 I440	I428-V438 HydrophobicContact CG2-CG1 3.57Å; A429-V438 CarbonylContact O-C 3.56Å; A429-V438 WeakPolarHBondContact O-CA 3.46Å; K430-V438 HydrophobicContact CB-CG2 4.07Å; K430-V438 HydrophobicContact CD-CG2 4.13Å; K430-V438 HydrophobicContact CG-CG2 4.14Å; V438-I440 HydrophobicContact CG1-CG1 4.38Å
439	T	95.9	Very high	93.7	Very high	41 Å²	41	50.6 Å²	50.6	25%	0.252	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	142.6	173.4	-68.2	0	0	0	0	110.6	P344 I346 A429	P344-T439 WeakPolarHBondContact O-CB 3.45Å; P344-T439 VanDerWaalsContact O-CG2 3.27Å; P344-T439 WeakPolarHBondContact O-CG2 3.17Å; P344-T439 PolarHBondContact O-OG1 2.9Å; I346-T439 HydrophobicContact CD1-CG2 4.29Å; I346-T439 HydrophobicContact CG1-CG2 4.32Å; A429-T439 PolarHBondContact N-O 2.91Å; A429-T439 PolarHBondContact O-N 3.34Å
440	I	95	Very high	93.6	Very high	88 Å²	88	53.4 Å²	53.4	45%	0.451	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120.9	-177.3	-60.1	-177.4	0	0	0	109.2	K426 L427 I428 V438	K426-I440 HydrophobicContact CD-CG2 4.15Å; K426-I440 HydrophobicContact CG-CG2 3.81Å; L427-I440 VanDerWaalsContact O-CA 3.3Å; L427-I440 WeakPolarHBondContact O-CA 3.48Å; I428-I440 HydrophobicContact CG1-CG1 4.35Å; V438-I440 HydrophobicContact CG1-CG1 4.38Å
441	E	94	Very high	93.7	Very high	49 Å²	49	50.7 Å²	50.7	23%	0.229	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	136.2	172.5	-174.1	177.5	149.6	0	0	109.7	I346 T348 L427	I346-E441 VanDerWaalsContact CB-OE2 3.27Å; I346-E441 WeakPolarHBondContact CB-OE2 3.2Å; I346-E441 HydrophobicContact CD1-CB 3.95Å; I346-E441 WeakPolarHBondContact CG2-OE2 3.44Å; T348-E441 WeakPolarHBondContact CG2-OE1 3.23Å; T348-E441 PolarHBondContact OG1-OE1 3.14Å; L427-E441 HydrophobicContact CB-CB 4.39Å; L427-E441 PolarHBondContact N-O 2.88Å; L427-E441 PolarHBondContact O-N 2.68Å; L427-E441 VanDerWaalsContact O-N 3.07Å
442	N	93.8	Very high	93.6	Very high	94 Å²	94	55.7 Å²	55.7	50%	0.503	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	110.6	174.4	-71.6	-32.8	0	0	0	108.3	N424 K426 P444	N424-N442 WeakPolarHBondContact OD1-CB 3.28Å; K426-N442 WeakPolarHBondContact CG-OD1 3.34Å; N442-P444 VanDerWaalsContact O-CD 3.25Å; N442-P444 WeakPolarHBondContact O-CD 3.46Å
443	L	93.7	Very high	93.6	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.026	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	98.9	-177.8	179.7	67.1	0	0	0	109.8	T348 W350 P358 V371 I409 I425 L427	T348-L443 HydrophobicContact CG2-CD1 4.4Å; W350-L443 HydrophobicContact CZ3-CD1 4.4Å; P358-L443 HydrophobicContact CG-CD1 3.9Å; P358-L443 HydrophobicContact CG-CG 4.13Å; V371-L443 HydrophobicContact CB-CD2 4.23Å; V371-L443 HydrophobicContact CG1-CD2 4.22Å; V371-L443 HydrophobicContact CG2-CD2 3.84Å; I409-L443 HydrophobicContact CD1-CD2 3.53Å; I425-L443 HydrophobicContact CB-CB 4.31Å; I425-L443 PolarHBondContact N-O 3.47Å; I425-L443 PolarHBondContact O-N 2.78Å; L427-L443 HydrophobicContact CD1-CD2 4.48Å
444	P	94	Very high	93.7	Very high	65 Å²	65	56.2 Å²	56.2	42%	0.422	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	136.4	173.8	28.8	-34.7	0	0	0	110.4	V357 P358 Y423 N442	V357-P444 HydrophobicContact CG1-CB 4.33Å; V357-P444 HydrophobicContact CG1-CG 3.84Å; P358-P444 VanDerWaalsContact CD-O 3.26Å; P358-P444 WeakPolarHBondContact CD-O 3.18Å; P358-P444 VanDerWaalsContact CG-O 3.29Å; P358-P444 WeakPolarHBondContact CG-O 3.16Å; Y423-P444 CarbonylContact O-C 3.59Å; Y423-P444 WeakPolarHBondContact O-CA 3.36Å; N442-P444 VanDerWaalsContact O-CD 3.25Å; N442-P444 WeakPolarHBondContact O-CD 3.46Å
445	V	93.4	Very high	94.1	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128.7	179.7	-173.9	0	0	0	0	108.5	P358 V360 L370 F397 N422 Y423 I425	P358-V445 HydrophobicContact CG-CG2 4.07Å; V360-V445 HydrophobicContact CG1-CG1 4.02Å; L370-V445 HydrophobicContact CD1-CG1 3.8Å; L370-V445 HydrophobicContact CD2-CB 4.44Å; L370-V445 HydrophobicContact CD2-CG1 3.78Å; L370-V445 HydrophobicContact CD2-CG2 3.73Å; L370-V445 HydrophobicContact CG-CG1 4.41Å; F397-V445 HydrophobicContact CZ-CG1 4.39Å; N422-V445 CarbonylContact C-O 3.54Å; N422-V445 VanDerWaalsContact CA-O 3.32Å; N422-V445 WeakPolarHBondContact CA-O 3.27Å; Y423-V445 PolarHBondContact N-O 2.6Å; Y423-V445 PolarHBondContact O-N 3.41Å; I425-V445 HydrophobicContact CD1-CG2 3.65Å; I425-V445 HydrophobicContact CG1-CG2 3.87Å
446	S	93.4	Very high	94.2	Very high	30 Å²	30	49 Å²	49	21%	0.21	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132.2	177.6	-150.6	0	0	0	0	110.8	P358 T359 V360 N422	P358-S446 PolarHBondContact O-N 2.83Å; P358-S446 VanDerWaalsContact O-N 3.1Å; T359-S446 WeakPolarHBondContact CA-O 3.23Å; V360-S446 PolarHBondContact N-O 3.37Å; N422-S446 WeakPolarHBondContact OD1-CA 3.42Å; N422-S446 WeakPolarHBondContact OD1-CB 3.38Å; N422-S446 PolarHBondContact OD1-OG 2.89Å
447	V	94.3	Very high	94.3	Very high	4 Å²	4	48 Å²	48	2%	0.024	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	129.6	173.8	-170.7	0	0	0	0	108.4	V360 E362 R417 V420 N421 Y423	V360-V447 CarbonylContact O-C 3.37Å; V360-V447 VanDerWaalsContact O-CA 3.3Å; V360-V447 WeakPolarHBondContact O-CA 3.36Å; E362-V447 HydrophobicContact CB-CG1 3.87Å; R417-V447 HydrophobicContact CB-CB 4.22Å; R417-V447 HydrophobicContact CB-CG1 3.82Å; R417-V447 HydrophobicContact CG-CB 4.21Å; R417-V447 HydrophobicContact CG-CG1 4.27Å; V420-V447 WeakPolarHBondContact O-CG2 3.13Å; N421-V447 PolarHBondContact O-N 3.12Å; Y423-V447 HydrophobicContact CD2-CG2 3.98Å; Y423-V447 HydrophobicContact CE2-CG2 3.82Å
448	L	92.7	Very high	94.2	Very high	72 Å²	72	51 Å²	51	38%	0.377	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	127.8	178.8	-61.7	179.8	0	0	0	110.2	T359 V360 R361 E362	T359-L448 HydrophobicContact CG2-CD2 4.12Å; T359-L448 HydrophobicContact CG2-CG 4.45Å; V360-L448 PolarHBondContact O-N 2.83Å; R361-L448 WeakPolarHBondContact CA-O 3.29Å; R361-L448 HydrophobicContact CG-CB 4.19Å; R361-L448 HydrophobicContact CG-CD1 4.47Å; E362-L448 PolarHBondContact N-O 3.48Å
449	D	94.3	Very high	94.1	Very high	35 Å²	35	53.5 Å²	53.5	19%	0.187	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-50.8	125	174	-152	82.6	0	0	0	113.4	E362 R417 Q486 N489	E362-D449 WeakPolarHBondContact OE1-CA 3.22Å; R417-D449 WeakPolarHBondContact CD-OD1 3.23Å; R417-D449 IonicContact CZ-OD1 2.65Å; R417-D449 IonicContact NE-OD1 3.12Å; R417-D449 PolarHBondContact NE-OD1 3.43Å; R417-D449 IonicContact NH1-OD1 3.79Å; R417-D449 PolarHBondContact NH1-OD1 3.28Å; R417-D449 IonicContact NH2-OD1 2.74Å; D449-Q486 HydrophobicContact CB-CB 4.05Å; D449-Q486 WeakPolarHBondContact OD1-CA 3.24Å; D449-Q486 WeakPolarHBondContact OD1-CB 3.43Å; D449-Q486 PolarHBondContact OD1-N 2.99Å; D449-Q486 PolarHBondContact OD2-N 2.87Å; D449-N489 WeakPolarHBondContact OD2-CB 3.01Å; D449-N489 PolarHBondContact OD2-ND2 3.23Å
450	E	93.4	Very high	93.8	Very high	60 Å²	60	56.5 Å²	56.5	28%	0.28	31%	0.313	S	S	.	.			trans	-115.4	152.7	158	-59.7	-154.3	116.8	0	0	110.1	R361 E362 G363 D452	R361-E450 HydrophobicContact CB-CG 4.09Å; R361-E450 VanDerWaalsContact CD-CD 3.41Å; R361-E450 WeakPolarHBondContact CD-OE1 3.28Å; R361-E450 HydrophobicContact CG-CG 4.45Å; R361-E450 IonicContact CZ-OE1 2.69Å; R361-E450 IonicContact NE-OE1 3.65Å; R361-E450 IonicContact NH1-OE1 3.84Å; R361-E450 PolarHBondContact NH1-OE1 2.91Å; E362-E450 HydrophobicContact CG-CB 4.4Å; E362-E450 PolarHBondContact OE1-N 3.22Å; G363-E450 WeakPolarHBondContact CA-OE2 3.48Å; E450-D452 PolarHBondContact O-N 3.41Å
451	N	94.8	Very high	93.7	Very high	23 Å²	23	56.2 Å²	56.2	12%	0.123	31%	0.311	C	S	.	.	S	Bend	trans	-85.6	75.4	-171.9	-162.6	117	0	0	0	111.3	D485 N489 D536 G538 L542	N451-D485 VanDerWaalsContact CA-OD2 3.25Å; N451-D485 WeakPolarHBondContact CA-OD2 3.48Å; N451-N489 HydrophobicContact CB-CB 4.11Å; N451-N489 WeakPolarHBondContact OD1-CA 3.39Å; N451-N489 WeakPolarHBondContact OD1-CB 3.38Å; N451-N489 PolarHBondContact OD1-OD1 3.29Å; N451-D536 PolarHBondContact ND2-OD2 2.93Å; N451-D536 PolarHBondContact OD1-OD2 3.26Å; N451-G538 WeakPolarHBondContact OD1-CA 3.22Å; N451-L542 WeakPolarHBondContact O-CD1 3.12Å
452	D	93.1	Very high	93.7	Very high	106 Å²	106	54.5 Å²	54.5	57%	0.567	30%	0.303	S	S	*	.			trans	-109.8	-16.2	-176	92.4	-25	0	0	0	115.1	E450 D485	E450-D452 PolarHBondContact O-N 3.41Å; D452-D485 PolarHBondContact N-OD2 3.42Å
453	N	94.1	Very high	93.7	Very high	52 Å²	52	54.7 Å²	54.7	28%	0.278	30%	0.304	S	S	.	.			trans	-86.9	166.1	166.4	-57.5	-81.1	0	0	0	111.1	D485 L542	N453-D485 VanDerWaalsContact CB-OD1 3.24Å; N453-D485 WeakPolarHBondContact CB-OD1 3.37Å; N453-D485 PolarHBondContact N-OD1 3.41Å; N453-D485 PolarHBondContact ND2-OD1 3.49Å; N453-L542 WeakPolarHBondContact O-CD1 3.29Å
454	A	94.5	Very high	93.6	Very high	38 Å²	38	56.5 Å²	56.5	31%	0.314	32%	0.315	S	S	.	.			trans	-139.2	149.3	-175.3	0	0	0	0	0	111	V456 D483 L542	A454-V456 VanDerWaalsContact O-CG2 3.27Å; A454-V456 WeakPolarHBondContact O-CG2 3.47Å; A454-V456 PolarHBondContact O-N 3.03Å; A454-D483 WeakPolarHBondContact CA-OD2 3.34Å; A454-L542 HydrophobicContact CB-CB 3.77Å; A454-L542 HydrophobicContact CB-CD1 4.44Å
455	P	96.2	Very high	93.5	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.013	31%	0.314	C	S	.	.			trans	-61.5	106.4	-168.5	-28.1	35.5	0	0	0	114.5	A481 D483 V492 A534 D536 G544	P455-A481 HydrophobicContact CB-CB 4.27Å; P455-D483 WeakPolarHBondContact CA-OD2 3.48Å; P455-D483 WeakPolarHBondContact CD-OD2 3.41Å; P455-D483 HydrophobicContact CG-CB 4.47Å; P455-D483 VanDerWaalsContact CG-OD2 3.23Å; P455-D483 WeakPolarHBondContact CG-OD2 3.42Å; P455-V492 HydrophobicContact CB-CG1 4.12Å; P455-V492 HydrophobicContact CB-CG2 3.92Å; P455-V492 HydrophobicContact CG-CG2 4.2Å; P455-A534 HydrophobicContact CB-CB 3.58Å; P455-A534 HydrophobicContact CG-CB 4.41Å; P455-D536 HydrophobicContact CG-CB 4.4Å; P455-G544 WeakPolarHBondContact O-CA 3.48Å
456	V	95	Very high	93.5	Very high	97 Å²	97	57.2 Å²	57.2	59%	0.588	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	118.6	-177.5	-172.6	0	0	0	0	110.9	A454 A481 S482	A454-V456 VanDerWaalsContact O-CG2 3.27Å; A454-V456 WeakPolarHBondContact O-CG2 3.47Å; A454-V456 PolarHBondContact O-N 3.03Å; V456-A481 CarbonylContact O-C 3.49Å; V456-A481 WeakPolarHBondContact O-CA 3.41Å; V456-A481 WeakPolarHBondContact O-CB 3.38Å; V456-S482 PolarHBondContact N-O 3.2Å; V456-S482 PolarHBondContact O-N 3.38Å
457	F	95.6	Very high	93.3	Very high	22 Å²	22	61 Å²	61	10%	0.096	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	141.1	172.9	-77	-84.2	0	0	0	112.6	K459 Y462 V479 K480 A481 Y494 V532 A534 T546	F457-K459 WeakPolarHBondContact CB-O 3.21Å; F457-K459 PolarHBondContact O-N 2.9Å; F457-K459 VanDerWaalsContact O-N 3.09Å; F457-Y462 HydrophobicContact CB-CE2 4.46Å; F457-Y462 HydrophobicContact CD1-CE2 4.2Å; F457-V479 HydrophobicContact CD1-CB 4.41Å; F457-V479 HydrophobicContact CE1-CB 4.11Å; F457-V479 HydrophobicContact CE1-CG2 4.02Å; F457-K480 WeakPolarHBondContact CA-O 3.29Å; F457-A481 HydrophobicContact CD1-CB 3.9Å; F457-A481 HydrophobicContact CD2-CB 4.31Å; F457-A481 HydrophobicContact CE1-CB 4.16Å; F457-A481 HydrophobicContact CG-CB 3.98Å; F457-A481 HydrophobicContact CZ-CB 4.49Å; F457-Y494 AromaticContact CE1-CD1 3.95Å; F457-Y494 HydrophobicContact CE1-CD1 3.95Å; F457-Y494 AromaticContact CE1-CE1 3.78Å; F457-Y494 HydrophobicContact CE1-CE1 3.78Å; F457-Y494 HydrophobicContact CZ-CD1 4.07Å; F457-Y494 HydrophobicContact CZ-CE1 4.22Å; F457-V532 HydrophobicContact CE1-CG1 4.45Å; F457-V532 HydrophobicContact CZ-CB 4.49Å; F457-V532 HydrophobicContact CZ-CG1 4.04Å; F457-A534 HydrophobicContact CD2-CB 4.35Å; F457-A534 HydrophobicContact CE1-CB 4.32Å; F457-A534 HydrophobicContact CE2-CB 3.47Å; F457-A534 VanDerWaalsContact CE2-CB 3.47Å; F457-A534 HydrophobicContact CZ-CB 3.45Å; F457-A534 VanDerWaalsContact CZ-CB 3.45Å; F457-T546 HydrophobicContact CB-CG2 4.36Å; F457-T546 HydrophobicContact CD1-CG2 3.51Å; F457-T546 HydrophobicContact CD2-CG2 3.84Å; F457-T546 HydrophobicContact CE1-CG2 3.57Å; F457-T546 HydrophobicContact CE2-CG2 3.89Å; F457-T546 HydrophobicContact CG-CG2 3.64Å; F457-T546 HydrophobicContact CZ-CG2 3.76Å
458	L	93	Very high	93	Very high	118 Å²	118	61 Å²	61	62%	0.618	33%	0.332	S	S	*	.	S	Bend	trans	-62.5	-16.9	176.5	-63.6	-179.9	0	0	0	114	K480	L458-K480 HydrophobicContact CD1-CB 4.04Å; L458-K480 HydrophobicContact CD1-CD 4.08Å; L458-K480 HydrophobicContact CD1-CG 4.09Å; L458-K480 HydrophobicContact CG-CB 4.49Å; L458-K480 PolarHBondContact N-O 3.43Å
459	K	91.5	Very high	92.8	Very high	122 Å²	122	61.9 Å²	61.9	53%	0.53	34%	0.337	S	S	.	.			trans	-141.8	141.6	173.1	-54.4	-179.5	-177.3	175.7	0	110.3	F457 I461 Y462 T546	F457-K459 WeakPolarHBondContact CB-O 3.21Å; F457-K459 PolarHBondContact O-N 2.9Å; F457-K459 VanDerWaalsContact O-N 3.09Å; K459-I461 VanDerWaalsContact C-N 3.34Å; K459-I461 WeakPolarHBondContact CB-O 3.3Å; K459-Y462 HydrophobicContact CB-CD2 3.93Å; K459-Y462 HydrophobicContact CB-CE1 4.41Å; K459-Y462 HydrophobicContact CB-CE2 3.73Å; K459-Y462 HydrophobicContact CB-CG 4.35Å; K459-Y462 HydrophobicContact CD-CD1 3.95Å; K459-Y462 HydrophobicContact CD-CE1 4Å; K459-Y462 HydrophobicContact CD-CG 4.31Å; K459-Y462 HydrophobicContact CG-CE1 4.25Å; K459-Y462 HydrophobicContact CG-CE2 4.41Å; K459-Y462 WeakPolarHBondContact O-CE2 3.5Å; K459-T546 PolarHBondContact O-OG1 3.18Å
460	S	89.1	Confident	92.5	Very high	103 Å²	103	60.9 Å²	60.9	72%	0.72	33%	0.332	S	S	*	.	S	Bend	trans	-72.9	-25.9	173.2	50.8	0	0	0	0	113.5	T546 T547	S460-T546 VanDerWaalsContact C-OG1 3.26Å; S460-T546 PolarHBondContact O-OG1 3.42Å; S460-T546 VanDerWaalsContact O-OG1 3.1Å; S460-T547 PolarHBondContact O-N 2.77Å
461	I	93.6	Very high	92.2	Very high	83 Å²	83	65.6 Å²	65.6	43%	0.426	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	135.3	170.9	-41.5	177.1	0	0	0	108.2	K459 N463 T547 Q549	K459-I461 VanDerWaalsContact C-N 3.34Å; K459-I461 WeakPolarHBondContact CB-O 3.3Å; I461-N463 WeakPolarHBondContact CG2-OD1 3.33Å; I461-T547 CarbonylContact C-O 3.5Å; I461-T547 VanDerWaalsContact CA-O 3.3Å; I461-T547 WeakPolarHBondContact CA-O 3.33Å; I461-T547 HydrophobicContact CG2-CG2 4.3Å; I461-T547 WeakPolarHBondContact CG2-O 3.17Å; I461-Q549 HydrophobicContact CG2-CG 4.24Å
462	Y	93.9	Very high	91.7	Very high	12 Å²	12	70.8 Å²	70.8	5%	0.047	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.3	169.1	-70.8	-107.8	0	0	0	109.8	F457 K459 L477 V479 K480 T546 T547 V548 Q549	F457-Y462 HydrophobicContact CB-CE2 4.46Å; F457-Y462 HydrophobicContact CD1-CE2 4.2Å; K459-Y462 HydrophobicContact CB-CD2 3.93Å; K459-Y462 HydrophobicContact CB-CE1 4.41Å; K459-Y462 HydrophobicContact CB-CE2 3.73Å; K459-Y462 HydrophobicContact CB-CG 4.35Å; K459-Y462 HydrophobicContact CD-CD1 3.95Å; K459-Y462 HydrophobicContact CD-CE1 4Å; K459-Y462 HydrophobicContact CD-CG 4.31Å; K459-Y462 HydrophobicContact CG-CE1 4.25Å; K459-Y462 HydrophobicContact CG-CE2 4.41Å; K459-Y462 WeakPolarHBondContact O-CE2 3.5Å; Y462-L477 HydrophobicContact CD1-CD1 4.21Å; Y462-L477 HydrophobicContact CD1-CD2 4.19Å; Y462-L477 HydrophobicContact CG-CD2 4.2Å; Y462-V479 HydrophobicContact CD1-CG1 3.97Å; Y462-V479 HydrophobicContact CD2-CB 4.49Å; Y462-V479 HydrophobicContact CD2-CG1 3.85Å; Y462-V479 HydrophobicContact CE1-CB 4.32Å; Y462-V479 HydrophobicContact CE1-CG1 4.12Å; Y462-V479 HydrophobicContact CE2-CB 4.14Å; Y462-V479 HydrophobicContact CE2-CG1 4Å; Y462-V479 HydrophobicContact CG-CG1 3.84Å; Y462-K480 PolarHBondContact OH-N 2.81Å; Y462-K480 VanDerWaalsContact OH-N 3.14Å; Y462-K480 PolarHBondContact OH-O 2.85Å; Y462-K480 VanDerWaalsContact OH-O 3.08Å; Y462-T546 HydrophobicContact CD2-CG2 3.97Å; Y462-T546 HydrophobicContact CE2-CG2 3.98Å; Y462-T547 PolarHBondContact N-O 2.67Å; Y462-V548 WeakPolarHBondContact O-CA 3.23Å; Y462-Q549 PolarHBondContact O-N 3.45Å
463	N	93.3	Very high	91.3	Very high	98 Å²	98	69 Å²	69	52%	0.524	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.7	175.8	-68.7	42.3	0	0	0	109.7	I461 Q549	I461-N463 WeakPolarHBondContact CG2-OD1 3.33Å; N463-Q549 WeakPolarHBondContact CA-O 3.34Å; N463-Q549 PolarHBondContact ND2-OE1 3.28Å; N463-Q549 PolarHBondContact OD1-OE1 3.02Å
464	T	93.3	Very high	91	Very high	43 Å²	43	69.4 Å²	69.4	26%	0.264	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	161	170.1	-166.7	0	0	0	0	110.2	V476 L477 Q549 I550 N551	T464-V476 HydrophobicContact CG2-CG1 3.85Å; T464-L477 HydrophobicContact CG2-CB 4.32Å; T464-Q549 PolarHBondContact N-O 3.19Å; T464-Q549 VanDerWaalsContact N-O 3.08Å; T464-I550 HydrophobicContact CG2-CG1 4.11Å; T464-I550 WeakPolarHBondContact O-CA 3.22Å; T464-N551 PolarHBondContact O-N 3.41Å
465	S	91.9	Very high	90.8	Very high	58 Å²	58	70.5 Å²	70.5	41%	0.406	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	157.2	164.3	59.7	0	0	0	0	110.7	N551 E553	S465-N551 CarbonylContact C-O 3.53Å; S465-N551 VanDerWaalsContact CA-O 3.28Å; S465-N551 WeakPolarHBondContact CA-O 3.45Å; S465-E553 WeakPolarHBondContact CB-OE1 3.03Å; S465-E553 PolarHBondContact OG-OE1 2.92Å
466	I	91.9	Very high	90.5	Very high	24 Å²	24	71.3 Å²	71.3	12%	0.123	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	141.9	168.3	-172.8	167.7	0	0	0	108.1	N470 V476 V516 L520 I550 N551 V552 E553	I466-N470 HydrophobicContact CD1-CB 4.29Å; I466-V476 HydrophobicContact CB-CG1 4.11Å; I466-V476 HydrophobicContact CD1-CB 4.4Å; I466-V476 HydrophobicContact CD1-CG1 4.04Å; I466-V476 HydrophobicContact CD1-CG2 3.92Å; I466-V476 HydrophobicContact CG2-CG1 4.27Å; I466-V516 HydrophobicContact CD1-CG2 3.88Å; I466-L520 HydrophobicContact CG2-CD1 3.77Å; I466-I550 HydrophobicContact CG2-CG2 3.54Å; I466-N551 PolarHBondContact N-O 3.4Å; I466-V552 CarbonylContact O-C 3.6Å; I466-V552 WeakPolarHBondContact O-CA 3.14Å; I466-E553 PolarHBondContact O-N 2.81Å
467	K	89.9	Confident	90.4	Very high	108 Å²	108	68.2 Å²	68.2	47%	0.47	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	143.7	173.8	-69.7	174.7	-176.6	-54.8	0	110.4	E553 L555	K467-E553 WeakPolarHBondContact CE-OE2 3.16Å; K467-E553 HydrophobicContact CG-CB 4.02Å; K467-E553 HydrophobicContact CG-CG 4.5Å; K467-E553 WeakPolarHBondContact CG-OE2 3.28Å; K467-E553 IonicContact NZ-OE2 2.7Å; K467-E553 PolarHBondContact NZ-OE2 3.19Å; K467-L555 HydrophobicContact CB-CD1 4.39Å; K467-L555 HydrophobicContact CD-CD2 4.25Å; K467-L555 HydrophobicContact CG-CD2 4.39Å
468	E	88.8	Confident	90.3	Very high	5 Å²	5	72.5 Å²	72.5	2%	0.023	38%	0.378	C	S	.	.	S	Bend	trans	-64.2	178.4	164.6	72.3	-173.4	161.5	0	0	112.1	N470 L520 H522 V552 E553 L555	E468-N470 PolarHBondContact O-N 2.87Å; E468-L520 WeakPolarHBondContact CB-O 3.36Å; E468-H522 WeakPolarHBondContact OE2-CB 3.32Å; E468-H522 PolarHBondContact OE2-N 2.61Å; E468-V552 HydrophobicContact CB-CG1 3.66Å; E468-E553 PolarHBondContact N-O 3.35Å; E468-E553 VanDerWaalsContact N-O 3.16Å; E468-L555 HydrophobicContact CG-CB 4.22Å; E468-L555 HydrophobicContact CG-CD1 4Å; E468-L555 HydrophobicContact CG-CG 3.98Å; E468-L555 WeakPolarHBondContact OE1-CA 3.24Å; E468-L555 WeakPolarHBondContact OE1-CB 3.27Å; E468-L555 PolarHBondContact OE1-N 2.78Å
469	N	87.4	Confident	90.4	Very high	90 Å²	90	66.9 Å²	66.9	48%	0.481	35%	0.349	S	S	.	.	S	Bend	trans	54.8	19.6	-174.5	-82	-64.8	0	0	0	113.2	L520 D557	N469-L520 PolarHBondContact N-O 2.86Å; N469-D557 PolarHBondContact ND2-OD2 2.86Å
470	N	88.1	Confident	90.6	Very high	15 Å²	15	66.3 Å²	66.3	8%	0.08	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-60.1	155.9	176.9	67.4	-87.9	0	0	0	111.6	I466 E468 R518 S519 L520	I466-N470 HydrophobicContact CD1-CB 4.29Å; E468-N470 PolarHBondContact O-N 2.87Å; N470-R518 PolarHBondContact ND2-O 2.94Å; N470-S519 WeakPolarHBondContact O-CB 3.42Å; N470-L520 WeakPolarHBondContact OD1-CG 3.46Å; N470-L520 PolarHBondContact OD1-N 3.5Å
471	F	87	Confident	90.9	Very high	159 Å²	159	61.8 Å²	61.8	70%	0.697	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-73	150.6	174.1	-59.1	-75.2	0	0	0	110.8	D474	F471-D474 WeakPolarHBondContact CA-OD2 3.44Å; F471-D474 WeakPolarHBondContact CB-OD2 3.39Å; F471-D474 PolarHBondContact N-OD2 2.79Å; F471-D474 WeakPolarHBondContact O-CB 3.49Å; F471-D474 PolarHBondContact O-N 3.3Å
472	K	84.5	Confident	90.9	Very high	131 Å²	131	60.5 Å²	60.5	57%	0.57	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	139.5	172.2	-164.6	-169.2	-176.6	-99.5	0	109.9	D474 L517	K472-D474 VanDerWaalsContact C-N 3.26Å; K472-L517 WeakPolarHBondContact CE-O 3.19Å
473	E	85.1	Confident	91	Very high	70 Å²	70	60.8 Å²	60.8	33%	0.327	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	7.8	-174.1	-47.4	-60.6	152.1	0	0	115.2	A475 R515 V516	E473-A475 PolarHBondContact O-N 2.9Å; E473-R515 WeakPolarHBondContact O-CD 3.44Å; E473-R515 PolarHBondContact O-NH1 2.84Å; E473-V516 VanDerWaalsContact CA-O 3.31Å; E473-V516 WeakPolarHBondContact CA-O 3.35Å; E473-V516 PolarHBondContact N-O 2.91Å
474	D	88.1	Confident	91.1	Very high	60 Å²	60	61.3 Å²	61.3	32%	0.321	32%	0.318	S	S	.	.			trans	-56.8	138.9	172.6	-84.5	-18.9	0	0	0	111.3	F471 K472 R515 V516	F471-D474 WeakPolarHBondContact CA-OD2 3.44Å; F471-D474 WeakPolarHBondContact CB-OD2 3.39Å; F471-D474 PolarHBondContact N-OD2 2.79Å; F471-D474 WeakPolarHBondContact O-CB 3.49Å; F471-D474 PolarHBondContact O-N 3.3Å; K472-D474 VanDerWaalsContact C-N 3.26Å; D474-R515 VanDerWaalsContact O-CA 3.22Å; D474-R515 WeakPolarHBondContact O-CA 3.34Å; D474-V516 PolarHBondContact O-N 2.92Å
475	A	90	Very high	91.2	Very high	61 Å²	61	59.7 Å²	59.7	50%	0.504	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.2	-178.3	0	0	0	0	0	110.3	E473 I513 R515	E473-A475 PolarHBondContact O-N 2.9Å; A475-I513 HydrophobicContact CB-CG2 3.91Å; A475-R515 HydrophobicContact CB-CG 4.49Å
476	V	90.4	Very high	91.3	Very high	19 Å²	19	62.4 Å²	62.4	12%	0.115	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-43.2	-172.6	-162.2	0	0	0	0	111.8	T464 I466 F505 I514 V516 I550	T464-V476 HydrophobicContact CG2-CG1 3.85Å; I466-V476 HydrophobicContact CB-CG1 4.11Å; I466-V476 HydrophobicContact CD1-CB 4.4Å; I466-V476 HydrophobicContact CD1-CG1 4.04Å; I466-V476 HydrophobicContact CD1-CG2 3.92Å; I466-V476 HydrophobicContact CG2-CG1 4.27Å; V476-F505 HydrophobicContact CG2-CD1 4.35Å; V476-F505 HydrophobicContact CG2-CE1 4.23Å; V476-I514 HydrophobicContact CG2-CG2 4.48Å; V476-I514 PolarHBondContact N-O 2.88Å; V476-V516 HydrophobicContact CG2-CG2 3.4Å; V476-V516 VanDerWaalsContact CG2-CG2 3.4Å; V476-I550 HydrophobicContact CG1-CD1 4Å; V476-I550 HydrophobicContact CG1-CG1 4.21Å; V476-I550 HydrophobicContact CG1-CG2 4.1Å
477	L	92.5	Very high	91.4	Very high	32 Å²	32	64.2 Å²	64.2	17%	0.168	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	145	-167	179.6	64.6	0	0	0	110.5	Y462 T464 V479 I513 I514 V548	Y462-L477 HydrophobicContact CD1-CD1 4.21Å; Y462-L477 HydrophobicContact CD1-CD2 4.19Å; Y462-L477 HydrophobicContact CG-CD2 4.2Å; T464-L477 HydrophobicContact CG2-CB 4.32Å; L477-V479 HydrophobicContact CD2-CG1 3.78Å; L477-V479 HydrophobicContact CG-CG1 4.2Å; L477-I513 WeakPolarHBondContact O-CA 3.4Å; L477-I514 HydrophobicContact CD2-CD1 4.28Å; L477-I514 PolarHBondContact O-N 3.33Å; L477-V548 HydrophobicContact CD2-CG1 3.79Å; L477-V548 HydrophobicContact CD2-CG2 4.39Å
478	E	93.9	Very high	91.5	Very high	112 Å²	112	64.2 Å²	64.2	52%	0.523	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	119.4	161.2	-172.8	-176.2	137.9	0	0	109	I513	E478-I513 HydrophobicContact CB-CG1 4.41Å; E478-I513 HydrophobicContact CG-CG1 4.25Å
479	V	94.8	Very high	91.7	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.35	C	S	.	.			trans	-97.3	145.5	164.4	-61.6	0	0	0	0	109.6	F457 Y462 L477 Y494 I507 G512 I514 V532 V548	F457-V479 HydrophobicContact CD1-CB 4.41Å; F457-V479 HydrophobicContact CE1-CB 4.11Å; F457-V479 HydrophobicContact CE1-CG2 4.02Å; Y462-V479 HydrophobicContact CD1-CG1 3.97Å; Y462-V479 HydrophobicContact CD2-CB 4.49Å; Y462-V479 HydrophobicContact CD2-CG1 3.85Å; Y462-V479 HydrophobicContact CE1-CB 4.32Å; Y462-V479 HydrophobicContact CE1-CG1 4.12Å; Y462-V479 HydrophobicContact CE2-CB 4.14Å; Y462-V479 HydrophobicContact CE2-CG1 4Å; Y462-V479 HydrophobicContact CG-CG1 3.84Å; L477-V479 HydrophobicContact CD2-CG1 3.78Å; L477-V479 HydrophobicContact CG-CG1 4.2Å; V479-Y494 HydrophobicContact CG2-CD1 4.37Å; V479-I507 HydrophobicContact CG2-CD1 3.63Å; V479-G512 WeakPolarHBondContact CG2-O 3.31Å; V479-G512 PolarHBondContact N-O 2.91Å; V479-G512 WeakPolarHBondContact O-CA 3.14Å; V479-I514 HydrophobicContact CG1-CD1 4.07Å; V479-I514 HydrophobicContact CG2-CD1 4.48Å; V479-V532 HydrophobicContact CG2-CG1 4.09Å; V479-V548 HydrophobicContact CG1-CG2 3.81Å
480	K	94.7	Very high	92	Very high	109 Å²	109	62.1 Å²	62.1	47%	0.474	34%	0.338	S	S	.	.			trans	-141.4	128.1	-175	-176	168.2	-179	173	0	110.7	F457 L458 Y462	F457-K480 WeakPolarHBondContact CA-O 3.29Å; L458-K480 HydrophobicContact CD1-CB 4.04Å; L458-K480 HydrophobicContact CD1-CD 4.08Å; L458-K480 HydrophobicContact CD1-CG 4.09Å; L458-K480 HydrophobicContact CG-CB 4.49Å; L458-K480 PolarHBondContact N-O 3.43Å; Y462-K480 PolarHBondContact OH-N 2.81Å; Y462-K480 VanDerWaalsContact OH-N 3.14Å; Y462-K480 PolarHBondContact OH-O 2.85Å; Y462-K480 VanDerWaalsContact OH-O 3.08Å
481	A	95.2	Very high	92.3	Very high	8 Å²	8	66 Å²	66	7%	0.066	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	154.5	167	0	0	0	0	0	110.2	P455 V456 F457 V492 Y494 A534	P455-A481 HydrophobicContact CB-CB 4.27Å; V456-A481 CarbonylContact O-C 3.49Å; V456-A481 WeakPolarHBondContact O-CA 3.41Å; V456-A481 WeakPolarHBondContact O-CB 3.38Å; F457-A481 HydrophobicContact CD1-CB 3.9Å; F457-A481 HydrophobicContact CD2-CB 4.31Å; F457-A481 HydrophobicContact CE1-CB 4.16Å; F457-A481 HydrophobicContact CG-CB 3.98Å; F457-A481 HydrophobicContact CZ-CB 4.49Å; A481-V492 HydrophobicContact CB-CG1 4.27Å; A481-Y494 HydrophobicContact CB-CE1 4.05Å; A481-Y494 PolarHBondContact N-OH 2.98Å; A481-Y494 PolarHBondContact O-OH 3.36Å; A481-A534 HydrophobicContact CB-CB 3.92Å
482	S	94.5	Very high	92.7	Very high	56 Å²	56	59.5 Å²	59.5	39%	0.392	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	150.2	169.5	47	0	0	0	0	108.6	V456	V456-S482 PolarHBondContact N-O 3.2Å; V456-S482 PolarHBondContact O-N 3.38Å
483	D	96.4	Very high	93.2	Very high	18 Å²	18	54.4 Å²	54.4	10%	0.096	31%	0.308	C	S	.	.			trans	-133.6	139.9	172.3	-158.1	-36.2	0	0	0	106.3	A454 P455 V492	A454-D483 WeakPolarHBondContact CA-OD2 3.34Å; P455-D483 WeakPolarHBondContact CA-OD2 3.48Å; P455-D483 WeakPolarHBondContact CD-OD2 3.41Å; P455-D483 HydrophobicContact CG-CB 4.47Å; P455-D483 VanDerWaalsContact CG-OD2 3.23Å; P455-D483 WeakPolarHBondContact CG-OD2 3.42Å; D483-V492 HydrophobicContact CB-CG2 3.9Å
484	D	94.8	Very high	93.6	Very high	109 Å²	109	52 Å²	52	58%	0.583	30%	0.296	S	S	*	.			trans	-93.1	-18.6	-166	-70.8	-32.2	0	0	0	112.1	R417 E418	R417-D484 PolarHBondContact NH2-O 3.26Å; E418-D484 HydrophobicContact CG-CB 4.11Å
485	D	96.1	Very high	93.9	Very high	10 Å²	10	53.5 Å²	53.5	5%	0.053	30%	0.299	C	S	.	.	S	Bend	trans	-60.1	174.5	176	-66.2	-1	0	0	0	113.4	N451 D452 N453 N489 G490	N451-D485 VanDerWaalsContact CA-OD2 3.25Å; N451-D485 WeakPolarHBondContact CA-OD2 3.48Å; D452-D485 PolarHBondContact N-OD2 3.42Å; N453-D485 VanDerWaalsContact CB-OD1 3.24Å; N453-D485 WeakPolarHBondContact CB-OD1 3.37Å; N453-D485 PolarHBondContact N-OD1 3.41Å; N453-D485 PolarHBondContact ND2-OD1 3.49Å; D485-N489 HydrophobicContact CB-CB 3.54Å; D485-G490 VanDerWaalsContact O-CA 3.27Å; D485-G490 WeakPolarHBondContact O-CA 3.48Å
486	Q	93.8	Very high	93.9	Very high	115 Å²	115	51.3 Å²	51.3	54%	0.537	28%	0.279	S	S	.	.			trans	-102	138.8	-174.1	-156.6	166.4	-4.2	0	0	115.3	D449 L488 N489	D449-Q486 HydrophobicContact CB-CB 4.05Å; D449-Q486 WeakPolarHBondContact OD1-CA 3.24Å; D449-Q486 WeakPolarHBondContact OD1-CB 3.43Å; D449-Q486 PolarHBondContact OD1-N 2.99Å; D449-Q486 PolarHBondContact OD2-N 2.87Å; Q486-L488 PolarHBondContact O-N 3.33Å; Q486-N489 PolarHBondContact O-N 2.92Å; Q486-N489 VanDerWaalsContact O-N 3.12Å
487	G	92.8	Very high	93.6	Very high	62 Å²	62	55.7 Å²	55.7	64%	0.639	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	-82.7	156.2	0	0	0	0	0	115.4
488	L	93.2	Very high	92.8	Very high	107 Å²	107	56.2 Å²	56.2	56%	0.56	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-28.4	172.9	-71.4	-178.6	0	0	0	112.2	Q486 K491 Y537	Q486-L488 PolarHBondContact O-N 3.33Å; L488-K491 HydrophobicContact CD2-CD 4.25Å; L488-K491 PolarHBondContact O-N 3Å; L488-Y537 CarbonylContact O-C 3.56Å; L488-Y537 WeakPolarHBondContact O-CA 3.5Å; L488-Y537 WeakPolarHBondContact O-CB 3.49Å; L488-Y537 PolarHBondContact O-N 2.96Å; L488-Y537 VanDerWaalsContact O-N 3.13Å
489	N	93.2	Very high	91.1	Very high	31 Å²	31	57.7 Å²	57.7	17%	0.166	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-58.6	176.9	-63.5	-6.5	0	0	0	108.4	D449 N451 D485 Q486 K491 D536	D449-N489 WeakPolarHBondContact OD2-CB 3.01Å; D449-N489 PolarHBondContact OD2-ND2 3.23Å; N451-N489 HydrophobicContact CB-CB 4.11Å; N451-N489 WeakPolarHBondContact OD1-CA 3.39Å; N451-N489 WeakPolarHBondContact OD1-CB 3.38Å; N451-N489 PolarHBondContact OD1-OD1 3.29Å; D485-N489 HydrophobicContact CB-CB 3.54Å; Q486-N489 PolarHBondContact O-N 2.92Å; Q486-N489 VanDerWaalsContact O-N 3.12Å; N489-K491 PolarHBondContact O-N 3.01Å; N489-D536 WeakPolarHBondContact O-CB 3.22Å
490	G	92.6	Very high	89.5	Confident	21 Å²	21	62.3 Å²	62.3	22%	0.216	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	14.1	174.9	0	0	0	0	0	116.6	D485	D485-G490 VanDerWaalsContact O-CA 3.27Å; D485-G490 WeakPolarHBondContact O-CA 3.48Å
491	K	94.3	Very high	87.8	Confident	96 Å²	96	58.4 Å²	58.4	42%	0.417	33%	0.325	S	S	.	.			trans	-102.5	100	-175	-173.4	-175.1	173.4	-171.5	0	111.7	L488 N489 D536 Y537	L488-K491 HydrophobicContact CD2-CD 4.25Å; L488-K491 PolarHBondContact O-N 3Å; N489-K491 PolarHBondContact O-N 3.01Å; K491-D536 CarbonylContact O-C 3.46Å; K491-D536 WeakPolarHBondContact O-CA 3.17Å; K491-Y537 HydrophobicContact CB-CD2 3.98Å; K491-Y537 HydrophobicContact CD-CD2 3.67Å; K491-Y537 HydrophobicContact CD-CE2 3.88Å; K491-Y537 HydrophobicContact CG-CD2 3.76Å; K491-Y537 HydrophobicContact CG-CE2 3.97Å; K491-Y537 WeakPolarHBondContact O-CD2 3.44Å; K491-Y537 PolarHBondContact O-N 3.27Å
492	V	95.2	Very high	86.1	Confident	23 Å²	23	62.2 Å²	62.2	14%	0.139	34%	0.341	C	S	.	.			trans	-74.2	143	-178.1	-172.3	0	0	0	0	114	P455 A481 D483 Y494 A534 V535	P455-V492 HydrophobicContact CB-CG1 4.12Å; P455-V492 HydrophobicContact CB-CG2 3.92Å; P455-V492 HydrophobicContact CG-CG2 4.2Å; A481-V492 HydrophobicContact CB-CG1 4.27Å; D483-V492 HydrophobicContact CB-CG2 3.9Å; V492-Y494 HydrophobicContact CG1-CD1 4.38Å; V492-Y494 HydrophobicContact CG1-CE1 3.91Å; V492-Y494 HydrophobicContact CG1-CE2 4.2Å; V492-A534 HydrophobicContact CG1-CB 3.69Å; V492-V535 CarbonylContact C-O 3.59Å
493	S	95	Very high	84.8	Confident	23 Å²	23	67.7 Å²	67.7	16%	0.161	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136.2	169.7	-179.9	0	0	0	0	110.7	P509 A534 V535	S493-P509 CarbonylContact C-O 3.52Å; S493-P509 VanDerWaalsContact CA-O 3.28Å; S493-P509 WeakPolarHBondContact CA-O 3.47Å; S493-A534 WeakPolarHBondContact O-CA 3.3Å; S493-V535 PolarHBondContact N-O 3.27Å; S493-V535 PolarHBondContact O-N 3.47Å
494	Y	95.1	Very high	84.1	Confident	20 Å²	20	67 Å²	67	8%	0.078	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	143.8	-173.3	-54.5	-85.8	0	0	0	113.6	F457 V479 A481 V492 I507 P509 A534	F457-Y494 AromaticContact CE1-CD1 3.95Å; F457-Y494 HydrophobicContact CE1-CD1 3.95Å; F457-Y494 AromaticContact CE1-CE1 3.78Å; F457-Y494 HydrophobicContact CE1-CE1 3.78Å; F457-Y494 HydrophobicContact CZ-CD1 4.07Å; F457-Y494 HydrophobicContact CZ-CE1 4.22Å; V479-Y494 HydrophobicContact CG2-CD1 4.37Å; A481-Y494 HydrophobicContact CB-CE1 4.05Å; A481-Y494 PolarHBondContact N-OH 2.98Å; A481-Y494 PolarHBondContact O-OH 3.36Å; V492-Y494 HydrophobicContact CG1-CD1 4.38Å; V492-Y494 HydrophobicContact CG1-CE1 3.91Å; V492-Y494 HydrophobicContact CG1-CE2 4.2Å; Y494-I507 HydrophobicContact CG-CD1 4.39Å; Y494-P509 WeakPolarHBondContact CD2-O 3.36Å; Y494-P509 PolarHBondContact N-O 3.43Å; Y494-A534 HydrophobicContact CD1-CB 4.14Å; Y494-A534 HydrophobicContact CE1-CB 4.21Å
495	K	92.8	Very high	83.9	Confident	91 Å²	91	61.9 Å²	61.9	40%	0.396	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	150.4	173.9	67.9	-169	179.8	-170.8	0	112.3	E533 V535	K495-E533 WeakPolarHBondContact CE-OE1 3.16Å; K495-E533 HydrophobicContact CG-CB 4.02Å; K495-E533 PolarHBondContact N-O 2.85Å; K495-E533 IonicContact NZ-OE1 3.61Å; K495-E533 PolarHBondContact NZ-OE1 3.35Å; K495-E533 IonicContact NZ-OE2 2.73Å; K495-E533 PolarHBondContact O-N 3.2Å; K495-V535 HydrophobicContact CD-CG2 3.95Å; K495-V535 VanDerWaalsContact CE-CG2 3.45Å; K495-V535 VanDerWaalsContact NZ-CG2 3.34Å
496	I	91.1	Very high	83.6	Confident	15 Å²	15	63.2 Å²	63.2	8%	0.077	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	120.8	170.8	-65.3	166.2	0	0	0	108.8	Q502 F505 I507 F530 V532	I496-Q502 HydrophobicContact CG2-CG 4.21Å; I496-Q502 PolarHBondContact O-NE2 2.67Å; I496-F505 HydrophobicContact CD1-CB 4.11Å; I496-I507 HydrophobicContact CD1-CB 4.25Å; I496-I507 HydrophobicContact CD1-CG2 4.31Å; I496-I507 HydrophobicContact CG1-CB 4.18Å; I496-I507 HydrophobicContact CG1-CG2 3.86Å; I496-F530 HydrophobicContact CD1-CD2 4.41Å; I496-F530 HydrophobicContact CD1-CE2 4.06Å; I496-F530 HydrophobicContact CG1-CD2 4.17Å; I496-F530 HydrophobicContact CG1-CE2 4.1Å; I496-F530 HydrophobicContact CG2-CB 4.34Å; I496-F530 HydrophobicContact CG2-CD2 3.92Å; I496-F530 HydrophobicContact CG2-CG 4.29Å; I496-V532 HydrophobicContact CG1-CG2 4.34Å
497	K	84.1	Confident	83.6	Confident	111 Å²	111	58.9 Å²	58.9	48%	0.483	32%	0.317	S	S	.	.			trans	-80.4	-33.4	-173.5	-166.1	-173.1	-170.1	108.3	0	113.1	I531 E533	K497-I531 HydrophobicContact CB-CB 4.25Å; K497-I531 HydrophobicContact CB-CG2 4.21Å; K497-I531 HydrophobicContact CD-CG2 4.06Å; K497-I531 PolarHBondContact N-O 3.12Å; K497-E533 HydrophobicContact CB-CB 4.42Å; K497-E533 VanDerWaalsContact CD-OE2 3.24Å; K497-E533 WeakPolarHBondContact CD-OE2 3.24Å; K497-E533 WeakPolarHBondContact CE-OE2 3.43Å; K497-E533 WeakPolarHBondContact CG-OE2 3.45Å; K497-E533 IonicContact NZ-OE2 3.93Å; K497-E533 PolarHBondContact NZ-OE2 3Å
498	T	74.6	Confident	83.6	Confident	43 Å²	43	60.3 Å²	60.3	26%	0.264	31%	0.307	S	S	.	.			trans	-83.7	125.8	-174.1	-44.4	0	0	0	0	111.8	T500 I531	T498-T500 WeakPolarHBondContact CG2-OG1 3.43Å; T498-I531 PolarHBondContact OG1-N 3.43Å
499	L	59.8	Low	83.6	Confident	143 Å²	143	58.1 Å²	58.1	75%	0.749	30%	0.299	S	S	*	.	S	Bend	trans	-80.6	-13.4	-173	-77.9	162.7	0	0	0	115.6
500	T	60.1	Low	83.6	Confident	98 Å²	98	60.8 Å²	60.8	60%	0.601	32%	0.317	S	S	*	.	S	Bend	trans	-70.6	-44.4	179.6	46.3	0	0	0	0	112	T498	T498-T500 WeakPolarHBondContact CG2-OG1 3.43Å
501	D	58.6	Low	83.6	Confident	27 Å²	27	62.7 Å²	62.7	14%	0.144	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-97.7	-4.6	-163	-59.1	16.8	0	0	0	112.8	K503 S504 F505 F530	D501-K503 PolarHBondContact O-N 2.86Å; D501-S504 PolarHBondContact O-N 2.74Å; D501-F505 PolarHBondContact O-N 3.19Å; D501-F505 VanDerWaalsContact O-N 3.14Å; D501-F530 HydrophobicContact CB-CB 4.37Å; D501-F530 HydrophobicContact CB-CD1 4.11Å
502	Q	59.7	Low	83.5	Confident	87 Å²	87	58.1 Å²	58.1	41%	0.407	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-60.4	-5.8	174.4	-76.1	-177.4	-1.2	0	0	114.1	I496 L517	I496-Q502 HydrophobicContact CG2-CG 4.21Å; I496-Q502 PolarHBondContact O-NE2 2.67Å; Q502-L517 WeakPolarHBondContact O-CD1 3.31Å
503	K	68.7	Low	83.5	Confident	171 Å²	171	59.2 Å²	59.2	74%	0.743	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-82.9	-29.3	169.5	-62.8	177.7	-175.7	171.8	0	113.1	D501	D501-K503 PolarHBondContact O-N 2.86Å
504	S	81.7	Confident	83.4	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.021	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-32	-178.3	-68.3	0	0	0	0	112.3	D501 V516 L517 R518 Y528	D501-S504 PolarHBondContact O-N 2.74Å; S504-V516 CarbonylContact O-C 3.24Å; S504-V516 WeakPolarHBondContact O-CA 3.25Å; S504-V516 VanDerWaalsContact O-CG1 3.25Å; S504-V516 WeakPolarHBondContact O-CG1 3.26Å; S504-L517 PolarHBondContact O-N 3.02Å; S504-R518 PolarHBondContact OG-NE 3.47Å; S504-R518 VanDerWaalsContact OG-NE 3.12Å; S504-R518 PolarHBondContact OG-NH2 3.32Å; S504-Y528 PolarHBondContact OG-OH 2.87Å
505	F	89.6	Confident	83.2	Confident	3 Å²	3	61.9 Å²	61.9	1%	0.013	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	147	-175.3	-55.2	-83.5	0	0	0	113.8	V476 I496 D501 I514 R515 V516 L520 Y528 F530 I550	V476-F505 HydrophobicContact CG2-CD1 4.35Å; V476-F505 HydrophobicContact CG2-CE1 4.23Å; I496-F505 HydrophobicContact CD1-CB 4.11Å; D501-F505 PolarHBondContact O-N 3.19Å; D501-F505 VanDerWaalsContact O-N 3.14Å; F505-I514 HydrophobicContact CB-CG2 4.23Å; F505-I514 HydrophobicContact CD1-CG2 4.13Å; F505-R515 WeakPolarHBondContact CA-O 3.23Å; F505-V516 HydrophobicContact CD1-CG1 4.28Å; F505-V516 HydrophobicContact CD1-CG2 4.48Å; F505-V516 HydrophobicContact CE1-CG1 4.01Å; F505-V516 HydrophobicContact CE1-CG2 4.2Å; F505-L520 HydrophobicContact CE1-CD1 4.08Å; F505-L520 HydrophobicContact CZ-CD1 3.75Å; F505-L520 HydrophobicContact CZ-CD2 4.06Å; F505-Y528 AromaticContact CE2-CD1 3.73Å; F505-Y528 HydrophobicContact CE2-CD1 3.73Å; F505-Y528 AromaticContact CE2-CD2 3.82Å; F505-Y528 HydrophobicContact CE2-CD2 3.82Å; F505-Y528 HydrophobicContact CE2-CE1 4.23Å; F505-Y528 HydrophobicContact CE2-CE2 4.33Å; F505-Y528 AromaticContact CE2-CG 3.48Å; F505-Y528 HydrophobicContact CE2-CG 3.48Å; F505-Y528 VanDerWaalsContact CE2-CG 3.48Å; F505-Y528 AromaticContact CZ-CD2 3.86Å; F505-Y528 HydrophobicContact CZ-CD2 3.86Å; F505-Y528 HydrophobicContact CZ-CE2 4.35Å; F505-Y528 AromaticContact CZ-CG 3.98Å; F505-Y528 HydrophobicContact CZ-CG 3.98Å; F505-F530 HydrophobicContact CB-CE1 4.17Å; F505-F530 HydrophobicContact CB-CZ 4.08Å; F505-F530 HydrophobicContact CD2-CD1 4.17Å; F505-F530 AromaticContact CD2-CE1 3.44Å; F505-F530 HydrophobicContact CD2-CE1 3.44Å; F505-F530 VanDerWaalsContact CD2-CE1 3.44Å; F505-F530 HydrophobicContact CD2-CZ 4.15Å; F505-F530 AromaticContact CE2-CE1 3.94Å; F505-F530 HydrophobicContact CE2-CE1 3.94Å; F505-F530 AromaticContact CG-CE1 3.77Å; F505-F530 HydrophobicContact CG-CE1 3.77Å; F505-F530 HydrophobicContact CG-CZ 4.01Å; F505-I550 HydrophobicContact CD1-CD1 3.89Å; F505-I550 HydrophobicContact CE1-CD1 3.53Å; F505-I550 HydrophobicContact CE1-CG2 4.48Å; F505-I550 HydrophobicContact CE2-CD1 4.4Å; F505-I550 HydrophobicContact CG-CD1 4.45Å; F505-I550 HydrophobicContact CZ-CD1 3.82Å; F505-I550 HydrophobicContact CZ-CG2 4.31Å
506	S	90.7	Very high	83.2	Confident	38 Å²	38	57.6 Å²	57.6	27%	0.266	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	160.8	165.3	65.7	0	0	0	0	110.4	I514 R515	S506-I514 CarbonylContact O-C 3.57Å; S506-I514 VanDerWaalsContact O-CA 3.29Å; S506-I514 WeakPolarHBondContact O-CA 3.3Å; S506-R515 PolarHBondContact N-O 3.45Å; S506-R515 PolarHBondContact O-N 3.38Å
507	I	93.1	Very high	83	Confident	24 Å²	24	59.4 Å²	59.4	12%	0.123	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137	171.9	-169	165.5	0	0	0	109.8	V479 Y494 I496 I513 I514 V532	V479-I507 HydrophobicContact CG2-CD1 3.63Å; Y494-I507 HydrophobicContact CG-CD1 4.39Å; I496-I507 HydrophobicContact CD1-CB 4.25Å; I496-I507 HydrophobicContact CD1-CG2 4.31Å; I496-I507 HydrophobicContact CG1-CB 4.18Å; I496-I507 HydrophobicContact CG1-CG2 3.86Å; I507-I513 WeakPolarHBondContact CA-O 3.17Å; I507-I514 HydrophobicContact CB-CG1 4.24Å; I507-I514 HydrophobicContact CD1-CD1 4.39Å; I507-I514 HydrophobicContact CD1-CG1 3.83Å; I507-I514 HydrophobicContact CG1-CG1 3.93Å; I507-V532 HydrophobicContact CD1-CG1 3.55Å; I507-V532 HydrophobicContact CD1-CG2 4.28Å
508	H	93.3	Very high	83.2	Confident	91 Å²	91	57.9 Å²	57.9	42%	0.421	30%	0.298	S	S	.	.			trans	-80.2	120.2	177.2	-173.7	-102.4	0	0	0	110.4	T510 T511 G512 I513	H508-T510 VanDerWaalsContact C-N 3.29Å; H508-T510 PolarHBondContact CE1-OG1 3.43Å; H508-T510 PolarHBondContact O-N 3.34Å; H508-T510 VanDerWaalsContact O-N 3.12Å; H508-T511 PolarHBondContact ND1-OG1 3.19Å; H508-T511 PolarHBondContact O-N 3.24Å; H508-G512 PolarHBondContact O-N 3.39Å; H508-I513 PolarHBondContact N-O 3.14Å
509	P	92.5	Very high	83.8	Confident	62 Å²	62	59 Å²	59	40%	0.403	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-22.2	-160.2	24.6	-35.2	0	0	0	114.6	S493 Y494	S493-P509 CarbonylContact C-O 3.52Å; S493-P509 VanDerWaalsContact CA-O 3.28Å; S493-P509 WeakPolarHBondContact CA-O 3.47Å; Y494-P509 WeakPolarHBondContact CD2-O 3.36Å; Y494-P509 PolarHBondContact N-O 3.43Å
510	T	92.3	Very high	85.3	Confident	87 Å²	87	52.2 Å²	52.2	53%	0.534	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-8.3	-179.6	57.6	0	0	0	0	114.8	H508	H508-T510 VanDerWaalsContact C-N 3.29Å; H508-T510 PolarHBondContact CE1-OG1 3.43Å; H508-T510 PolarHBondContact O-N 3.34Å; H508-T510 VanDerWaalsContact O-N 3.12Å
511	T	92.5	Very high	86.6	Confident	61 Å²	61	51 Å²	51	37%	0.374	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-8.2	-177.8	63.7	0	0	0	0	114	H508 I513	H508-T511 PolarHBondContact ND1-OG1 3.19Å; H508-T511 PolarHBondContact O-N 3.24Å; T511-I513 PolarHBondContact O-N 3.16Å
512	G	92.5	Very high	88.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.			trans	67.1	7.4	178.5	0	0	0	0	0	114.8	V479 H508 I514	V479-G512 WeakPolarHBondContact CG2-O 3.31Å; V479-G512 PolarHBondContact N-O 2.91Å; V479-G512 WeakPolarHBondContact O-CA 3.14Å; H508-G512 PolarHBondContact O-N 3.39Å; G512-I514 PolarHBondContact O-N 2.85Å
513	I	94.9	Very high	89.5	Confident	46 Å²	46	49.6 Å²	49.6	24%	0.236	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.3	176.6	-60	172.8	0	0	0	109	A475 L477 E478 I507 H508 T511 R515	A475-I513 HydrophobicContact CB-CG2 3.91Å; L477-I513 WeakPolarHBondContact O-CA 3.4Å; E478-I513 HydrophobicContact CB-CG1 4.41Å; E478-I513 HydrophobicContact CG-CG1 4.25Å; I507-I513 WeakPolarHBondContact CA-O 3.17Å; H508-I513 PolarHBondContact N-O 3.14Å; T511-I513 PolarHBondContact O-N 3.16Å; I513-R515 HydrophobicContact CG2-CG 4.39Å
514	I	93.2	Very high	90.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.7	175.2	-62.1	171.8	0	0	0	108.8	V476 L477 V479 F505 S506 I507 G512 F530 V532 V548	V476-I514 HydrophobicContact CG2-CG2 4.48Å; V476-I514 PolarHBondContact N-O 2.88Å; L477-I514 HydrophobicContact CD2-CD1 4.28Å; L477-I514 PolarHBondContact O-N 3.33Å; V479-I514 HydrophobicContact CG1-CD1 4.07Å; V479-I514 HydrophobicContact CG2-CD1 4.48Å; F505-I514 HydrophobicContact CB-CG2 4.23Å; F505-I514 HydrophobicContact CD1-CG2 4.13Å; S506-I514 CarbonylContact O-C 3.57Å; S506-I514 VanDerWaalsContact O-CA 3.29Å; S506-I514 WeakPolarHBondContact O-CA 3.3Å; I507-I514 HydrophobicContact CB-CG1 4.24Å; I507-I514 HydrophobicContact CD1-CD1 4.39Å; I507-I514 HydrophobicContact CD1-CG1 3.83Å; I507-I514 HydrophobicContact CG1-CG1 3.93Å; G512-I514 PolarHBondContact O-N 2.85Å; I514-F530 HydrophobicContact CD1-CE2 4.16Å; I514-F530 HydrophobicContact CD1-CZ 4.37Å; I514-F530 HydrophobicContact CG2-CZ 4.22Å; I514-V532 HydrophobicContact CD1-CG2 4.21Å; I514-V548 HydrophobicContact CD1-CB 4.48Å; I514-V548 HydrophobicContact CD1-CG1 3.98Å; I514-V548 HydrophobicContact CD1-CG2 3.98Å
515	R	92.3	Very high	90.6	Very high	99 Å²	99	48.2 Å²	48.2	37%	0.374	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.8	178.5	-68.6	-177.2	-177.5	-85.3	-2.5	112	E473 D474 A475 F505 S506 I513	E473-R515 WeakPolarHBondContact O-CD 3.44Å; E473-R515 PolarHBondContact O-NH1 2.84Å; D474-R515 VanDerWaalsContact O-CA 3.22Å; D474-R515 WeakPolarHBondContact O-CA 3.34Å; A475-R515 HydrophobicContact CB-CG 4.49Å; F505-R515 WeakPolarHBondContact CA-O 3.23Å; S506-R515 PolarHBondContact N-O 3.45Å; S506-R515 PolarHBondContact O-N 3.38Å; I513-R515 HydrophobicContact CG2-CG 4.39Å
516	V	91.7	Very high	90.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	132.3	175.6	-149.1	0	0	0	0	111.4	I466 E473 D474 V476 S504 F505 R518 L520	I466-V516 HydrophobicContact CD1-CG2 3.88Å; E473-V516 VanDerWaalsContact CA-O 3.31Å; E473-V516 WeakPolarHBondContact CA-O 3.35Å; E473-V516 PolarHBondContact N-O 2.91Å; D474-V516 PolarHBondContact O-N 2.92Å; V476-V516 HydrophobicContact CG2-CG2 3.4Å; V476-V516 VanDerWaalsContact CG2-CG2 3.4Å; S504-V516 CarbonylContact O-C 3.24Å; S504-V516 WeakPolarHBondContact O-CA 3.25Å; S504-V516 VanDerWaalsContact O-CG1 3.25Å; S504-V516 WeakPolarHBondContact O-CG1 3.26Å; F505-V516 HydrophobicContact CD1-CG1 4.28Å; F505-V516 HydrophobicContact CD1-CG2 4.48Å; F505-V516 HydrophobicContact CE1-CG1 4.01Å; F505-V516 HydrophobicContact CE1-CG2 4.2Å; V516-R518 WeakPolarHBondContact CG1-O 3.38Å; V516-L520 HydrophobicContact CG1-CD1 4.26Å; V516-L520 HydrophobicContact CG1-CD2 3.59Å; V516-L520 HydrophobicContact CG1-CG 3.76Å
517	L	88	Confident	90.6	Very high	53 Å²	53	55 Å²	55	28%	0.277	29%	0.29	S	S	.	.	S	Bend	trans	-90.6	-11.3	-179	-68.6	174.3	0	0	0	114	K472 Q502 S504	K472-L517 WeakPolarHBondContact CE-O 3.19Å; Q502-L517 WeakPolarHBondContact O-CD1 3.31Å; S504-L517 PolarHBondContact O-N 3.02Å
518	R	86.8	Confident	90.4	Very high	80 Å²	80	54.7 Å²	54.7	30%	0.302	29%	0.287	S	S	.	.	S	Bend	trans	-142.1	172.9	173	54.5	171.3	-178.2	162.7	4	109.3	N470 S504 V516 E524 Y528	N470-R518 PolarHBondContact ND2-O 2.94Å; S504-R518 PolarHBondContact OG-NE 3.47Å; S504-R518 VanDerWaalsContact OG-NE 3.12Å; S504-R518 PolarHBondContact OG-NH2 3.32Å; V516-R518 WeakPolarHBondContact CG1-O 3.38Å; R518-E524 IonicContact CZ-OE1 3.15Å; R518-E524 IonicContact CZ-OE2 3.66Å; R518-E524 VanDerWaalsContact NH1-CD 3.32Å; R518-E524 IonicContact NH1-OE1 3.78Å; R518-E524 PolarHBondContact NH1-OE1 3.39Å; R518-E524 VanDerWaalsContact NH1-OE1 3.12Å; R518-E524 IonicContact NH1-OE2 2.72Å; R518-E524 PolarHBondContact NH1-OE2 2.67Å; R518-E524 VanDerWaalsContact NH2-CD 3.26Å; R518-E524 IonicContact NH2-OE1 2.76Å; R518-E524 PolarHBondContact NH2-OE1 3.27Å; R518-E524 IonicContact NH2-OE2 3.99Å; R518-E524 PolarHBondContact NH2-OE2 3.31Å; R518-Y528 PolarHBondContact NH2-OH 3.41Å
519	S	88.6	Confident	90.2	Very high	65 Å²	65	53.7 Å²	53.7	46%	0.455	29%	0.291	S	S	.	.			trans	-64.8	140.9	157.3	45.8	0	0	0	0	108.7	N470	N470-S519 WeakPolarHBondContact O-CB 3.42Å
520	L	89.8	Confident	90.1	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	27%	0.272	C	S	.	.			trans	-85.8	162	165.8	-54.7	-176.7	0	0	0	109.7	I466 E468 N469 N470 F505 V516 Y528 V552	I466-L520 HydrophobicContact CG2-CD1 3.77Å; E468-L520 WeakPolarHBondContact CB-O 3.36Å; N469-L520 PolarHBondContact N-O 2.86Å; N470-L520 WeakPolarHBondContact OD1-CG 3.46Å; N470-L520 PolarHBondContact OD1-N 3.5Å; F505-L520 HydrophobicContact CE1-CD1 4.08Å; F505-L520 HydrophobicContact CZ-CD1 3.75Å; F505-L520 HydrophobicContact CZ-CD2 4.06Å; V516-L520 HydrophobicContact CG1-CD1 4.26Å; V516-L520 HydrophobicContact CG1-CD2 3.59Å; V516-L520 HydrophobicContact CG1-CG 3.76Å; L520-Y528 HydrophobicContact CD1-CD2 4.46Å; L520-Y528 HydrophobicContact CD1-CE2 4.19Å; L520-Y528 HydrophobicContact CD2-CE2 3.83Å; L520-Y528 HydrophobicContact CG-CE2 4.47Å; L520-V552 HydrophobicContact CB-CG1 4.39Å; L520-V552 HydrophobicContact CB-CG2 4.3Å; L520-V552 HydrophobicContact CD1-CG2 3.95Å
521	D	89.1	Confident	90	Very high	73 Å²	73	49.8 Å²	49.8	39%	0.39	26%	0.262	S	S	.	.			trans	-151	116.1	-165.7	-178.2	110.1	0	0	0	104.1	E523 E524 S525	D521-E523 VanDerWaalsContact C-N 3.29Å; D521-E524 HydrophobicContact CB-CB 4.14Å; D521-E524 VanDerWaalsContact OD2-CB 3.26Å; D521-E524 WeakPolarHBondContact OD2-CB 3.2Å; D521-E524 PolarHBondContact OD2-N 2.81Å; D521-S525 PolarHBondContact O-N 3.04Å; D521-S525 VanDerWaalsContact O-N 3.09Å
522	H	89.4	Confident	90.1	Very high	19 Å²	19	46.9 Å²	46.9	9%	0.088	24%	0.244	C	C	.	.	H	α-helix	trans	-68.6	-34.7	-172	-174.6	91	0	0	0	110.7	E468 S525 Q526 V552 D554 S625	E468-H522 WeakPolarHBondContact OE2-CB 3.32Å; E468-H522 PolarHBondContact OE2-N 2.61Å; H522-S525 CarbonylContact O-C 3.48Å; H522-S525 VanDerWaalsContact O-C 3.3Å; H522-S525 PolarHBondContact O-N 2.94Å; H522-Q526 WeakPolarHBondContact NE2-CG 3.33Å; H522-Q526 PolarHBondContact NE2-NE2 2.9Å; H522-Q526 VanDerWaalsContact O-CG 3.3Å; H522-Q526 WeakPolarHBondContact O-CG 3.48Å; H522-Q526 PolarHBondContact O-N 2.85Å; H522-V552 HydrophobicContact CB-CG1 4Å; H522-V552 PolarHBondContact CE1-O 3.16Å; H522-V552 PolarHBondContact ND1-O 2.59Å; H522-D554 HydrophobicContact CB-CB 3.96Å; H522-D554 VanDerWaalsContact CG-CB 3.48Å; H522-S625 PolarHBondContact NE2-OG 3Å
523	E	89	Confident	90.2	Very high	64 Å²	64	47.5 Å²	47.5	30%	0.299	25%	0.247	S	C	.	.	H	α-helix	trans	-71.9	-34.9	-177.9	-71.4	51.5	-112.1	0	0	111.5	D521 P623	D521-E523 VanDerWaalsContact C-N 3.29Å; E523-P623 HydrophobicContact CG-CB 3.7Å
524	E	86.9	Confident	90.2	Very high	107 Å²	107	45.3 Å²	45.3	50%	0.5	24%	0.236	S	C	.	.	H	α-helix	trans	-70.2	-43.5	166.1	-167.3	-170.1	155.3	0	0	111.4	R518 D521	R518-E524 IonicContact CZ-OE1 3.15Å; R518-E524 IonicContact CZ-OE2 3.66Å; R518-E524 VanDerWaalsContact NH1-CD 3.32Å; R518-E524 IonicContact NH1-OE1 3.78Å; R518-E524 PolarHBondContact NH1-OE1 3.39Å; R518-E524 VanDerWaalsContact NH1-OE1 3.12Å; R518-E524 IonicContact NH1-OE2 2.72Å; R518-E524 PolarHBondContact NH1-OE2 2.67Å; R518-E524 VanDerWaalsContact NH2-CD 3.26Å; R518-E524 IonicContact NH2-OE1 2.76Å; R518-E524 PolarHBondContact NH2-OE1 3.27Å; R518-E524 IonicContact NH2-OE2 3.99Å; R518-E524 PolarHBondContact NH2-OE2 3.31Å; D521-E524 HydrophobicContact CB-CB 4.14Å; D521-E524 VanDerWaalsContact OD2-CB 3.26Å; D521-E524 WeakPolarHBondContact OD2-CB 3.2Å; D521-E524 PolarHBondContact OD2-N 2.81Å
525	S	87.3	Confident	90.3	Very high	38 Å²	38	46.4 Å²	46.4	27%	0.266	24%	0.243	S	C	.	.	H	α-helix	trans	-162.8	94.4	-174.8	-72.7	0	0	0	0	115.3	D521 H522 S527 V552	D521-S525 PolarHBondContact O-N 3.04Å; D521-S525 VanDerWaalsContact O-N 3.09Å; H522-S525 CarbonylContact O-C 3.48Å; H522-S525 VanDerWaalsContact O-C 3.3Å; H522-S525 PolarHBondContact O-N 2.94Å; S525-S527 PolarHBondContact O-N 2.97Å; S525-S527 VanDerWaalsContact O-N 3.08Å; S525-V552 VanDerWaalsContact O-CG2 3.29Å; S525-V552 WeakPolarHBondContact O-CG2 3.28Å
526	Q	89.1	Confident	90.5	Very high	110 Å²	110	41.9 Å²	41.9	51%	0.514	23%	0.226	S	C	.	.	S	Bend	trans	-55.7	-25	177.2	-51.4	-171.6	-56.3	0	0	115.4	H522 V552	H522-Q526 WeakPolarHBondContact NE2-CG 3.33Å; H522-Q526 PolarHBondContact NE2-NE2 2.9Å; H522-Q526 VanDerWaalsContact O-CG 3.3Å; H522-Q526 WeakPolarHBondContact O-CG 3.48Å; H522-Q526 PolarHBondContact O-N 2.85Å; Q526-V552 PolarHBondContact O-N 3.44Å
527	S	90.1	Very high	90.5	Very high	75 Å²	75	46.6 Å²	46.6	52%	0.524	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	150.6	176.3	66.1	0	0	0	0	113.1	S525 I550	S525-S527 PolarHBondContact O-N 2.97Å; S525-S527 VanDerWaalsContact O-N 3.08Å; S527-I550 CarbonylContact C-O 3.58Å; S527-I550 WeakPolarHBondContact CA-O 3.17Å
528	Y	88.9	Confident	90.7	Very high	16 Å²	16	44.1 Å²	44.1	6%	0.063	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.8	176.5	-66.8	-91.4	0	0	0	110.4	S504 F505 R518 L520 Q549 I550 V552	S504-Y528 PolarHBondContact OG-OH 2.87Å; F505-Y528 AromaticContact CE2-CD1 3.73Å; F505-Y528 HydrophobicContact CE2-CD1 3.73Å; F505-Y528 AromaticContact CE2-CD2 3.82Å; F505-Y528 HydrophobicContact CE2-CD2 3.82Å; F505-Y528 HydrophobicContact CE2-CE1 4.23Å; F505-Y528 HydrophobicContact CE2-CE2 4.33Å; F505-Y528 AromaticContact CE2-CG 3.48Å; F505-Y528 HydrophobicContact CE2-CG 3.48Å; F505-Y528 VanDerWaalsContact CE2-CG 3.48Å; F505-Y528 AromaticContact CZ-CD2 3.86Å; F505-Y528 HydrophobicContact CZ-CD2 3.86Å; F505-Y528 HydrophobicContact CZ-CE2 4.35Å; F505-Y528 AromaticContact CZ-CG 3.98Å; F505-Y528 HydrophobicContact CZ-CG 3.98Å; R518-Y528 PolarHBondContact NH2-OH 3.41Å; L520-Y528 HydrophobicContact CD1-CD2 4.46Å; L520-Y528 HydrophobicContact CD1-CE2 4.19Å; L520-Y528 HydrophobicContact CD2-CE2 3.83Å; L520-Y528 HydrophobicContact CG-CE2 4.47Å; Y528-Q549 WeakPolarHBondContact O-CA 3.45Å; Y528-I550 PolarHBondContact N-O 3.48Å; Y528-I550 PolarHBondContact O-N 3.07Å; Y528-V552 HydrophobicContact CD2-CG2 4.14Å; Y528-V552 HydrophobicContact CE2-CG2 4.04Å
529	S	89.6	Confident	90.6	Very high	71 Å²	71	48.9 Å²	48.9	50%	0.497	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	96.8	-174.2	172.1	0	0	0	0	111.5	V548	S529-V548 WeakPolarHBondContact CA-O 3.24Å
530	F	90.1	Very high	90.8	Very high	1 Å²	1	50.3 Å²	50.3	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	158.2	-176.9	53.8	-96.5	0	0	0	112.9	I496 D501 F505 I514 V532 V548 I550	I496-F530 HydrophobicContact CD1-CD2 4.41Å; I496-F530 HydrophobicContact CD1-CE2 4.06Å; I496-F530 HydrophobicContact CG1-CD2 4.17Å; I496-F530 HydrophobicContact CG1-CE2 4.1Å; I496-F530 HydrophobicContact CG2-CB 4.34Å; I496-F530 HydrophobicContact CG2-CD2 3.92Å; I496-F530 HydrophobicContact CG2-CG 4.29Å; D501-F530 HydrophobicContact CB-CB 4.37Å; D501-F530 HydrophobicContact CB-CD1 4.11Å; F505-F530 HydrophobicContact CB-CE1 4.17Å; F505-F530 HydrophobicContact CB-CZ 4.08Å; F505-F530 HydrophobicContact CD2-CD1 4.17Å; F505-F530 AromaticContact CD2-CE1 3.44Å; F505-F530 HydrophobicContact CD2-CE1 3.44Å; F505-F530 VanDerWaalsContact CD2-CE1 3.44Å; F505-F530 HydrophobicContact CD2-CZ 4.15Å; F505-F530 AromaticContact CE2-CE1 3.94Å; F505-F530 HydrophobicContact CE2-CE1 3.94Å; F505-F530 AromaticContact CG-CE1 3.77Å; F505-F530 HydrophobicContact CG-CE1 3.77Å; F505-F530 HydrophobicContact CG-CZ 4.01Å; I514-F530 HydrophobicContact CD1-CE2 4.16Å; I514-F530 HydrophobicContact CD1-CZ 4.37Å; I514-F530 HydrophobicContact CG2-CZ 4.22Å; F530-V532 HydrophobicContact CD2-CG2 4.03Å; F530-V532 HydrophobicContact CE2-CG2 3.86Å; F530-V548 HydrophobicContact CD2-CB 4.24Å; F530-V548 HydrophobicContact CE2-CB 3.86Å; F530-V548 HydrophobicContact CE2-CG1 4.05Å; F530-V548 HydrophobicContact CE2-CG2 4.39Å; F530-V548 HydrophobicContact CZ-CB 4.23Å; F530-V548 HydrophobicContact CZ-CG1 3.95Å; F530-V548 PolarHBondContact N-O 3.14Å; F530-V548 VanDerWaalsContact N-O 3.12Å; F530-V548 PolarHBondContact O-N 2.74Å; F530-I550 HydrophobicContact CE1-CD1 3.84Å; F530-I550 HydrophobicContact CZ-CD1 3.8Å
531	I	91.4	Very high	91	Very high	65 Å²	65	53.9 Å²	53.9	33%	0.333	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	125.4	177.7	-61.2	173.3	0	0	0	108.8	K497 T498	K497-I531 HydrophobicContact CB-CB 4.25Å; K497-I531 HydrophobicContact CB-CG2 4.21Å; K497-I531 HydrophobicContact CD-CG2 4.06Å; K497-I531 PolarHBondContact N-O 3.12Å; T498-I531 PolarHBondContact OG1-N 3.43Å
532	V	93.3	Very high	91.2	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	134.4	165.2	-177.5	0	0	0	0	108.6	F457 V479 I496 I507 I514 F530 S545 T546 V548	F457-V532 HydrophobicContact CE1-CG1 4.45Å; F457-V532 HydrophobicContact CZ-CB 4.49Å; F457-V532 HydrophobicContact CZ-CG1 4.04Å; V479-V532 HydrophobicContact CG2-CG1 4.09Å; I496-V532 HydrophobicContact CG1-CG2 4.34Å; I507-V532 HydrophobicContact CD1-CG1 3.55Å; I507-V532 HydrophobicContact CD1-CG2 4.28Å; I514-V532 HydrophobicContact CD1-CG2 4.21Å; F530-V532 HydrophobicContact CD2-CG2 4.03Å; F530-V532 HydrophobicContact CE2-CG2 3.86Å; V532-S545 CarbonylContact O-C 3.56Å; V532-S545 VanDerWaalsContact O-CA 3.28Å; V532-S545 WeakPolarHBondContact O-CA 3.32Å; V532-T546 HydrophobicContact CB-CG2 4.23Å; V532-T546 PolarHBondContact N-O 3.4Å; V532-T546 PolarHBondContact O-N 2.81Å; V532-V548 HydrophobicContact CB-CG2 4.39Å; V532-V548 HydrophobicContact CG2-CB 4.43Å; V532-V548 HydrophobicContact CG2-CG2 3.6Å
533	E	94.3	Very high	91.5	Very high	13 Å²	13	55.4 Å²	55.4	6%	0.061	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	129.6	177.9	-170.6	178.3	137.7	0	0	108.9	K495 K497 V535 T543 G544	K495-E533 WeakPolarHBondContact CE-OE1 3.16Å; K495-E533 HydrophobicContact CG-CB 4.02Å; K495-E533 PolarHBondContact N-O 2.85Å; K495-E533 IonicContact NZ-OE1 3.61Å; K495-E533 PolarHBondContact NZ-OE1 3.35Å; K495-E533 IonicContact NZ-OE2 2.73Å; K495-E533 PolarHBondContact O-N 3.2Å; K497-E533 HydrophobicContact CB-CB 4.42Å; K497-E533 VanDerWaalsContact CD-OE2 3.24Å; K497-E533 WeakPolarHBondContact CD-OE2 3.24Å; K497-E533 WeakPolarHBondContact CE-OE2 3.43Å; K497-E533 WeakPolarHBondContact CG-OE2 3.45Å; K497-E533 IonicContact NZ-OE2 3.93Å; K497-E533 PolarHBondContact NZ-OE2 3Å; E533-V535 HydrophobicContact CG-CG2 4.31Å; E533-T543 HydrophobicContact CG-CG2 4.48Å; E533-T543 WeakPolarHBondContact OE1-CG2 3.27Å; E533-G544 CarbonylContact C-O 3.19Å; E533-G544 WeakPolarHBondContact CA-O 3.38Å
534	A	95.9	Very high	91.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	136.9	169.5	0	0	0	0	0	108.1	P455 F457 A481 V492 S493 Y494 T543 G544	P455-A534 HydrophobicContact CB-CB 3.58Å; P455-A534 HydrophobicContact CG-CB 4.41Å; F457-A534 HydrophobicContact CD2-CB 4.35Å; F457-A534 HydrophobicContact CE1-CB 4.32Å; F457-A534 HydrophobicContact CE2-CB 3.47Å; F457-A534 VanDerWaalsContact CE2-CB 3.47Å; F457-A534 HydrophobicContact CZ-CB 3.45Å; F457-A534 VanDerWaalsContact CZ-CB 3.45Å; A481-A534 HydrophobicContact CB-CB 3.92Å; V492-A534 HydrophobicContact CG1-CB 3.69Å; S493-A534 WeakPolarHBondContact O-CA 3.3Å; Y494-A534 HydrophobicContact CD1-CB 4.14Å; Y494-A534 HydrophobicContact CE1-CB 4.21Å; A534-T543 CarbonylContact O-C 3.57Å; A534-T543 WeakPolarHBondContact O-CA 3.42Å; A534-T543 WeakPolarHBondContact O-CB 3.15Å; A534-G544 PolarHBondContact N-O 3.42Å; A534-G544 PolarHBondContact O-N 3.37Å
535	V	95	Very high	92.1	Very high	23 Å²	23	51.8 Å²	51.8	14%	0.139	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	137	-175.2	-170.4	0	0	0	0	107.3	V492 S493 K495 E533 P541 T543	V492-V535 CarbonylContact C-O 3.59Å; S493-V535 PolarHBondContact N-O 3.27Å; S493-V535 PolarHBondContact O-N 3.47Å; K495-V535 HydrophobicContact CD-CG2 3.95Å; K495-V535 VanDerWaalsContact CE-CG2 3.45Å; K495-V535 VanDerWaalsContact NZ-CG2 3.34Å; E533-V535 HydrophobicContact CG-CG2 4.31Å; V535-P541 HydrophobicContact CG1-CB 4.24Å; V535-T543 HydrophobicContact CB-CG2 4.22Å; V535-T543 HydrophobicContact CG1-CG2 3.95Å; V535-T543 HydrophobicContact CG2-CG2 3.89Å
536	D	96.1	Very high	92.4	Very high	5 Å²	5	50 Å²	50	3%	0.027	28%	0.283	C	S	.	.			trans	-71.5	-171.1	169.9	56.3	34.4	0	0	0	112.6	N451 P455 N489 K491 G538 P541 L542	N451-D536 PolarHBondContact ND2-OD2 2.93Å; N451-D536 PolarHBondContact OD1-OD2 3.26Å; P455-D536 HydrophobicContact CG-CB 4.4Å; N489-D536 WeakPolarHBondContact O-CB 3.22Å; K491-D536 CarbonylContact O-C 3.46Å; K491-D536 WeakPolarHBondContact O-CA 3.17Å; D536-G538 VanDerWaalsContact CG-N 3.31Å; D536-G538 WeakPolarHBondContact OD1-CA 3.32Å; D536-G538 PolarHBondContact OD1-N 3Å; D536-P541 WeakPolarHBondContact OD1-CA 3.31Å; D536-P541 WeakPolarHBondContact OD1-CB 3.26Å; D536-L542 VanDerWaalsContact CG-N 3.35Å; D536-L542 PolarHBondContact N-O 2.92Å; D536-L542 PolarHBondContact OD1-N 3.09Å; D536-L542 WeakPolarHBondContact OD2-CA 3.2Å; D536-L542 WeakPolarHBondContact OD2-CB 3.41Å; D536-L542 PolarHBondContact OD2-N 2.9Å
537	Y	93.1	Very high	92.6	Very high	99 Å²	99	47 Å²	47	39%	0.388	27%	0.272	S	S	.	.	S	Bend	trans	-107.8	26.3	158	-66.6	-84.8	0	0	0	111.9	L488 K491	L488-Y537 CarbonylContact O-C 3.56Å; L488-Y537 WeakPolarHBondContact O-CA 3.5Å; L488-Y537 WeakPolarHBondContact O-CB 3.49Å; L488-Y537 PolarHBondContact O-N 2.96Å; L488-Y537 VanDerWaalsContact O-N 3.13Å; K491-Y537 HydrophobicContact CB-CD2 3.98Å; K491-Y537 HydrophobicContact CD-CD2 3.67Å; K491-Y537 HydrophobicContact CD-CE2 3.88Å; K491-Y537 HydrophobicContact CG-CD2 3.76Å; K491-Y537 HydrophobicContact CG-CE2 3.97Å; K491-Y537 WeakPolarHBondContact O-CD2 3.44Å; K491-Y537 PolarHBondContact O-N 3.27Å
538	G	90.8	Very high	92.7	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.01	25%	0.247	C	C	.	.			trans	-69	161.1	-178.3	0	0	0	0	0	114.9	N451 D536 P540 P541	N451-G538 WeakPolarHBondContact OD1-CA 3.22Å; D536-G538 VanDerWaalsContact CG-N 3.31Å; D536-G538 WeakPolarHBondContact OD1-CA 3.32Å; D536-G538 PolarHBondContact OD1-N 3Å; G538-P540 VanDerWaalsContact C-C 3.46Å; G538-P540 CarbonylContact C-O 3.3Å; G538-P540 CarbonylContact O-C 3.56Å; G538-P541 WeakPolarHBondContact O-CA 3.4Å; G538-P541 WeakPolarHBondContact O-CB 3.42Å; G538-P541 WeakPolarHBondContact O-CD 3.16Å; G538-P541 VanDerWaalsContact O-N 3.12Å
539	H	86.1	Confident	92.9	Very high	179 Å²	179	45.8 Å²	45.8	83%	0.829	26%	0.259	S	S	*	.	S	Bend	trans	-136.1	96.5	178.6	-78.8	8.7	0	0	0	111.1
540	P	91.9	Very high	93	Very high	96 Å²	96	42.4 Å²	42.4	62%	0.623	24%	0.235	S	C	*	.	S	Bend	cis	-69.5	150.7	2.5	32	-36.6	0	0	0	112.3	G538	G538-P540 VanDerWaalsContact C-C 3.46Å; G538-P540 CarbonylContact C-O 3.3Å; G538-P540 CarbonylContact O-C 3.56Å
541	P	93.6	Very high	93	Very high	76 Å²	76	46.4 Å²	46.4	49%	0.494	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-79.4	132.5	177.2	30.3	-33.3	0	0	0	111.6	V535 D536 G538	V535-P541 HydrophobicContact CG1-CB 4.24Å; D536-P541 WeakPolarHBondContact OD1-CA 3.31Å; D536-P541 WeakPolarHBondContact OD1-CB 3.26Å; G538-P541 WeakPolarHBondContact O-CA 3.4Å; G538-P541 WeakPolarHBondContact O-CB 3.42Å; G538-P541 WeakPolarHBondContact O-CD 3.16Å; G538-P541 VanDerWaalsContact O-N 3.12Å
542	L	94.5	Very high	93.1	Very high	56 Å²	56	43.6 Å²	43.6	29%	0.293	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-99	157.8	174.4	-60.3	-179	0	0	0	110.6	N451 N453 A454 D536	N451-L542 WeakPolarHBondContact O-CD1 3.12Å; N453-L542 WeakPolarHBondContact O-CD1 3.29Å; A454-L542 HydrophobicContact CB-CB 3.77Å; A454-L542 HydrophobicContact CB-CD1 4.44Å; D536-L542 VanDerWaalsContact CG-N 3.35Å; D536-L542 PolarHBondContact N-O 2.92Å; D536-L542 PolarHBondContact OD1-N 3.09Å; D536-L542 WeakPolarHBondContact OD2-CA 3.2Å; D536-L542 WeakPolarHBondContact OD2-CB 3.41Å; D536-L542 PolarHBondContact OD2-N 2.9Å
543	T	94.7	Very high	92.9	Very high	69 Å²	69	46.9 Å²	46.9	42%	0.423	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	133.4	-170.1	64.5	0	0	0	0	112.6	E533 A534 V535	E533-T543 HydrophobicContact CG-CG2 4.48Å; E533-T543 WeakPolarHBondContact OE1-CG2 3.27Å; A534-T543 CarbonylContact O-C 3.57Å; A534-T543 WeakPolarHBondContact O-CA 3.42Å; A534-T543 WeakPolarHBondContact O-CB 3.15Å; V535-T543 HydrophobicContact CB-CG2 4.22Å; V535-T543 HydrophobicContact CG1-CG2 3.95Å; V535-T543 HydrophobicContact CG2-CG2 3.89Å
544	G	94.3	Very high	92.6	Very high	16 Å²	16	48.1 Å²	48.1	17%	0.165	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	161	166.1	0	0	0	0	0	111.2	P455 E533 A534	P455-G544 WeakPolarHBondContact O-CA 3.48Å; E533-G544 CarbonylContact C-O 3.19Å; E533-G544 WeakPolarHBondContact CA-O 3.38Å; A534-G544 PolarHBondContact N-O 3.42Å; A534-G544 PolarHBondContact O-N 3.37Å
545	S	94.1	Very high	92.3	Very high	78 Å²	78	50.9 Å²	50.9	55%	0.545	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	141.8	178.1	61.6	0	0	0	0	112.8	V532	V532-S545 CarbonylContact O-C 3.56Å; V532-S545 VanDerWaalsContact O-CA 3.28Å; V532-S545 WeakPolarHBondContact O-CA 3.32Å
546	T	94.4	Very high	92	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.7	174.8	-168.7	0	0	0	0	110.4	F457 K459 S460 Y462 V532	F457-T546 HydrophobicContact CB-CG2 4.36Å; F457-T546 HydrophobicContact CD1-CG2 3.51Å; F457-T546 HydrophobicContact CD2-CG2 3.84Å; F457-T546 HydrophobicContact CE1-CG2 3.57Å; F457-T546 HydrophobicContact CE2-CG2 3.89Å; F457-T546 HydrophobicContact CG-CG2 3.64Å; F457-T546 HydrophobicContact CZ-CG2 3.76Å; K459-T546 PolarHBondContact O-OG1 3.18Å; S460-T546 VanDerWaalsContact C-OG1 3.26Å; S460-T546 PolarHBondContact O-OG1 3.42Å; S460-T546 VanDerWaalsContact O-OG1 3.1Å; Y462-T546 HydrophobicContact CD2-CG2 3.97Å; Y462-T546 HydrophobicContact CE2-CG2 3.98Å; V532-T546 HydrophobicContact CB-CG2 4.23Å; V532-T546 PolarHBondContact N-O 3.4Å; V532-T546 PolarHBondContact O-N 2.81Å
547	T	92.6	Very high	91.5	Very high	45 Å²	45	53.7 Å²	53.7	28%	0.276	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129.6	175	-60.4	0	0	0	0	109.6	S460 I461 Y462 Q549	S460-T547 PolarHBondContact O-N 2.77Å; I461-T547 CarbonylContact C-O 3.5Å; I461-T547 VanDerWaalsContact CA-O 3.3Å; I461-T547 WeakPolarHBondContact CA-O 3.33Å; I461-T547 HydrophobicContact CG2-CG2 4.3Å; I461-T547 WeakPolarHBondContact CG2-O 3.17Å; Y462-T547 PolarHBondContact N-O 2.67Å; T547-Q549 HydrophobicContact CG2-CG 4.16Å
548	V	92.9	Very high	91.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.9	173.3	176.9	0	0	0	0	108.8	Y462 L477 V479 I514 S529 F530 V532 I550	Y462-V548 WeakPolarHBondContact O-CA 3.23Å; L477-V548 HydrophobicContact CD2-CG1 3.79Å; L477-V548 HydrophobicContact CD2-CG2 4.39Å; V479-V548 HydrophobicContact CG1-CG2 3.81Å; I514-V548 HydrophobicContact CD1-CB 4.48Å; I514-V548 HydrophobicContact CD1-CG1 3.98Å; I514-V548 HydrophobicContact CD1-CG2 3.98Å; S529-V548 WeakPolarHBondContact CA-O 3.24Å; F530-V548 HydrophobicContact CD2-CB 4.24Å; F530-V548 HydrophobicContact CE2-CB 3.86Å; F530-V548 HydrophobicContact CE2-CG1 4.05Å; F530-V548 HydrophobicContact CE2-CG2 4.39Å; F530-V548 HydrophobicContact CZ-CB 4.23Å; F530-V548 HydrophobicContact CZ-CG1 3.95Å; F530-V548 PolarHBondContact N-O 3.14Å; F530-V548 VanDerWaalsContact N-O 3.12Å; F530-V548 PolarHBondContact O-N 2.74Å; V532-V548 HydrophobicContact CB-CG2 4.39Å; V532-V548 HydrophobicContact CG2-CB 4.43Å; V532-V548 HydrophobicContact CG2-CG2 3.6Å; V548-I550 HydrophobicContact CG1-CD1 4.14Å; V548-I550 HydrophobicContact CG1-CG1 3.98Å
549	Q	92.3	Very high	91	Very high	66 Å²	66	53.8 Å²	53.8	31%	0.308	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.3	175.7	-62.3	-174.6	-22.9	0	0	109	I461 Y462 N463 T464 Y528 T547	I461-Q549 HydrophobicContact CG2-CG 4.24Å; Y462-Q549 PolarHBondContact O-N 3.45Å; N463-Q549 WeakPolarHBondContact CA-O 3.34Å; N463-Q549 PolarHBondContact ND2-OE1 3.28Å; N463-Q549 PolarHBondContact OD1-OE1 3.02Å; T464-Q549 PolarHBondContact N-O 3.19Å; T464-Q549 VanDerWaalsContact N-O 3.08Å; Y528-Q549 WeakPolarHBondContact O-CA 3.45Å; T547-Q549 HydrophobicContact CG2-CG 4.16Å
550	I	91.4	Very high	91.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	113.2	179	-62.5	167.2	0	0	0	107.3	T464 I466 V476 F505 S527 Y528 F530 V548	T464-I550 HydrophobicContact CG2-CG1 4.11Å; T464-I550 WeakPolarHBondContact O-CA 3.22Å; I466-I550 HydrophobicContact CG2-CG2 3.54Å; V476-I550 HydrophobicContact CG1-CD1 4Å; V476-I550 HydrophobicContact CG1-CG1 4.21Å; V476-I550 HydrophobicContact CG1-CG2 4.1Å; F505-I550 HydrophobicContact CD1-CD1 3.89Å; F505-I550 HydrophobicContact CE1-CD1 3.53Å; F505-I550 HydrophobicContact CE1-CG2 4.48Å; F505-I550 HydrophobicContact CE2-CD1 4.4Å; F505-I550 HydrophobicContact CG-CD1 4.45Å; F505-I550 HydrophobicContact CZ-CD1 3.82Å; F505-I550 HydrophobicContact CZ-CG2 4.31Å; S527-I550 CarbonylContact C-O 3.58Å; S527-I550 WeakPolarHBondContact CA-O 3.17Å; Y528-I550 PolarHBondContact N-O 3.48Å; Y528-I550 PolarHBondContact O-N 3.07Å; F530-I550 HydrophobicContact CE1-CD1 3.84Å; F530-I550 HydrophobicContact CZ-CD1 3.8Å; V548-I550 HydrophobicContact CG1-CD1 4.14Å; V548-I550 HydrophobicContact CG1-CG1 3.98Å
551	N	91.6	Very high	91	Very high	85 Å²	85	44 Å²	44	46%	0.455	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	134.8	172.7	-64.7	-1.3	0	0	0	108.9	T464 S465 I466	T464-N551 PolarHBondContact O-N 3.41Å; S465-N551 CarbonylContact C-O 3.53Å; S465-N551 VanDerWaalsContact CA-O 3.28Å; S465-N551 WeakPolarHBondContact CA-O 3.45Å; I466-N551 PolarHBondContact N-O 3.4Å
552	V	91.7	Very high	90.7	Very high	7 Å²	7	40.8 Å²	40.8	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.7	174	-175.7	0	0	0	0	108.3	I466 E468 L520 H522 S525 Q526 Y528	I466-V552 CarbonylContact O-C 3.6Å; I466-V552 WeakPolarHBondContact O-CA 3.14Å; E468-V552 HydrophobicContact CB-CG1 3.66Å; L520-V552 HydrophobicContact CB-CG1 4.39Å; L520-V552 HydrophobicContact CB-CG2 4.3Å; L520-V552 HydrophobicContact CD1-CG2 3.95Å; H522-V552 HydrophobicContact CB-CG1 4Å; H522-V552 PolarHBondContact CE1-O 3.16Å; H522-V552 PolarHBondContact ND1-O 2.59Å; S525-V552 VanDerWaalsContact O-CG2 3.29Å; S525-V552 WeakPolarHBondContact O-CG2 3.28Å; Q526-V552 PolarHBondContact O-N 3.44Å; Y528-V552 HydrophobicContact CD2-CG2 4.14Å; Y528-V552 HydrophobicContact CE2-CG2 4.04Å
553	E	89.3	Confident	90.3	Very high	69 Å²	69	41.5 Å²	41.5	32%	0.322	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	118.3	171	-53.1	-177.1	176	0	0	108.9	S465 I466 K467 E468	S465-E553 WeakPolarHBondContact CB-OE1 3.03Å; S465-E553 PolarHBondContact OG-OE1 2.92Å; I466-E553 PolarHBondContact O-N 2.81Å; K467-E553 WeakPolarHBondContact CE-OE2 3.16Å; K467-E553 HydrophobicContact CG-CB 4.02Å; K467-E553 HydrophobicContact CG-CG 4.5Å; K467-E553 WeakPolarHBondContact CG-OE2 3.28Å; K467-E553 IonicContact NZ-OE2 2.7Å; K467-E553 PolarHBondContact NZ-OE2 3.19Å; E468-E553 PolarHBondContact N-O 3.35Å; E468-E553 VanDerWaalsContact N-O 3.16Å
554	D	89	Confident	89.6	Confident	38 Å²	38	42.8 Å²	42.8	20%	0.203	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-68.8	142.1	175	116.8	79.9	0	0	0	111.2	H522 S625 N628	H522-D554 HydrophobicContact CB-CB 3.96Å; H522-D554 VanDerWaalsContact CG-CB 3.48Å; D554-S625 PolarHBondContact OD1-N 2.78Å; D554-S625 WeakPolarHBondContact OD2-CB 3.11Å; D554-N628 VanDerWaalsContact CG-ND2 3.34Å; D554-N628 PolarHBondContact OD1-ND2 2.92Å
555	L	88.9	Confident	89	Confident	59 Å²	59	43.8 Å²	43.8	31%	0.309	24%	0.239	S	C	.	.			trans	-123.7	148.1	177.8	-60.8	176.8	0	0	0	107.5	K467 E468 D557 N628	K467-L555 HydrophobicContact CB-CD1 4.39Å; K467-L555 HydrophobicContact CD-CD2 4.25Å; K467-L555 HydrophobicContact CG-CD2 4.39Å; E468-L555 HydrophobicContact CG-CB 4.22Å; E468-L555 HydrophobicContact CG-CD1 4Å; E468-L555 HydrophobicContact CG-CG 3.98Å; E468-L555 WeakPolarHBondContact OE1-CA 3.24Å; E468-L555 WeakPolarHBondContact OE1-CB 3.27Å; E468-L555 PolarHBondContact OE1-N 2.78Å; L555-D557 WeakPolarHBondContact O-CB 3.47Å; L555-D557 PolarHBondContact O-N 3.11Å; L555-N628 VanDerWaalsContact C-ND2 3.27Å
556	N	88.4	Confident	88.3	Confident	15 Å²	15	48.2 Å²	48.2	8%	0.08	25%	0.249	C	C	.	.	S	Bend	trans	-67.8	107.8	171.9	-147.2	64.5	0	0	0	107.5	D624 N628 D676 P680 Y682	N556-D624 WeakPolarHBondContact CA-OD2 3.25Å; N556-N628 HydrophobicContact CB-CB 4.17Å; N556-N628 PolarHBondContact N-ND2 2.87Å; N556-N628 VanDerWaalsContact N-ND2 3.19Å; N556-N628 WeakPolarHBondContact OD1-CA 3.28Å; N556-N628 WeakPolarHBondContact OD1-CB 3.03Å; N556-D676 VanDerWaalsContact ND2-CG 3.29Å; N556-D676 PolarHBondContact ND2-OD2 3.18Å; N556-P680 PolarHBondContact ND2-O 3.32Å; N556-Y682 HydrophobicContact CB-CE2 4.47Å; N556-Y682 WeakPolarHBondContact ND2-CD2 3.28Å; N556-Y682 WeakPolarHBondContact O-CE2 2.89Å
557	D	85.6	Confident	87.7	Confident	72 Å²	72	50.9 Å²	50.9	39%	0.385	27%	0.266	S	S	.	.			trans	-134.2	-42.4	-165.8	171	-82	0	0	0	110.6	N469 L555 D624	N469-D557 PolarHBondContact ND2-OD2 2.86Å; L555-D557 WeakPolarHBondContact O-CB 3.47Å; L555-D557 PolarHBondContact O-N 3.11Å; D557-D624 PolarHBondContact N-OD2 2.86Å
558	N	87.4	Confident	86.9	Confident	54 Å²	54	58.3 Å²	58.3	29%	0.289	29%	0.289	S	S	.	.	S	Bend	trans	-85.8	-158.1	173.1	-65.6	-87.4	0	0	0	110.8	P623 D624 Y682	N558-P623 HydrophobicContact CB-CB 4.27Å; N558-P623 HydrophobicContact CB-CG 3.86Å; N558-D624 WeakPolarHBondContact CB-OD1 3.2Å; N558-D624 PolarHBondContact N-OD1 2.91Å; N558-D624 PolarHBondContact N-OD2 2.84Å; N558-D624 PolarHBondContact ND2-OD1 3.03Å; N558-Y682 WeakPolarHBondContact O-CD2 3.33Å
559	S	86.6	Confident	86.2	Confident	48 Å²	48	66.6 Å²	66.6	34%	0.336	33%	0.333	S	S	.	.			trans	-164.6	154.6	-179.2	53.5	0	0	0	0	111.8	V561 D622	S559-V561 WeakPolarHBondContact O-CG2 3.33Å; S559-V561 PolarHBondContact O-N 3.34Å; S559-D622 PolarHBondContact N-OD1 3.08Å
560	P	90.2	Very high	85.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.339	C	S	.	.			trans	-64.2	117.6	-165.9	-27.1	33.3	0	0	0	113.8	D622 L631 V674 D676 T684	P560-D622 WeakPolarHBondContact CA-OD2 3.26Å; P560-D622 WeakPolarHBondContact CD-OD2 3.41Å; P560-D622 WeakPolarHBondContact CG-OD2 3.31Å; P560-L631 HydrophobicContact CB-CD2 3.61Å; P560-L631 HydrophobicContact CG-CD2 3.55Å; P560-V674 HydrophobicContact CB-CB 4.05Å; P560-V674 HydrophobicContact CB-CG1 3.69Å; P560-V674 HydrophobicContact CG-CG1 4.33Å; P560-D676 HydrophobicContact CG-CB 4.31Å; P560-T684 WeakPolarHBondContact O-CB 3.45Å; P560-T684 PolarHBondContact O-OG1 3.38Å
561	V	88.1	Confident	84.9	Confident	69 Å²	69	67 Å²	67	42%	0.418	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	111.4	-179.6	-175.2	0	0	0	0	111.3	S559 K563 A620 E621	S559-V561 WeakPolarHBondContact O-CG2 3.33Å; S559-V561 PolarHBondContact O-N 3.34Å; V561-K563 HydrophobicContact CB-CD 4.45Å; V561-K563 HydrophobicContact CG1-CD 4.03Å; V561-K563 VanDerWaalsContact CG1-CE 3.48Å; V561-K563 WeakPolarHBondContact O-CE 3.3Å; V561-K563 WeakPolarHBondContact O-CG 3.26Å; V561-K563 PolarHBondContact O-N 3.43Å; V561-K563 VanDerWaalsContact O-N 3.14Å; V561-A620 VanDerWaalsContact O-CA 3.28Å; V561-A620 WeakPolarHBondContact O-CA 3.06Å; V561-E621 PolarHBondContact N-O 3.24Å; V561-E621 PolarHBondContact O-N 2.8Å
562	I	87.2	Confident	84.6	Confident	9 Å²	9	63 Å²	63	5%	0.046	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	113.1	174.4	-57.2	168.7	0	0	0	110.1	P567 V572 I618 A620 L672 V674 T684 A686	I562-P567 WeakPolarHBondContact O-CD 3.46Å; I562-V572 HydrophobicContact CD1-CG2 4.21Å; I562-V572 HydrophobicContact CG2-CG2 4.16Å; I562-I618 HydrophobicContact CG2-CG2 3.87Å; I562-A620 HydrophobicContact CG1-CB 4.18Å; I562-L672 HydrophobicContact CD1-CD2 3.83Å; I562-V674 HydrophobicContact CD1-CG2 4.15Å; I562-V674 HydrophobicContact CG1-CG2 3.99Å; I562-T684 HydrophobicContact CD1-CG2 4.2Å; I562-T684 HydrophobicContact CG1-CG2 4.4Å; I562-A686 HydrophobicContact CD1-CB 3.8Å
563	K	84.8	Confident	84	Confident	70 Å²	70	65.8 Å²	65.8	30%	0.304	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-38	-179.2	-54.2	-58.6	168.7	78.5	0	112.6	V561 K566 K619 E621	V561-K563 HydrophobicContact CB-CD 4.45Å; V561-K563 HydrophobicContact CG1-CD 4.03Å; V561-K563 VanDerWaalsContact CG1-CE 3.48Å; V561-K563 WeakPolarHBondContact O-CE 3.3Å; V561-K563 WeakPolarHBondContact O-CG 3.26Å; V561-K563 PolarHBondContact O-N 3.43Å; V561-K563 VanDerWaalsContact O-N 3.14Å; K563-K566 WeakPolarHBondContact O-CG 3.5Å; K563-K566 PolarHBondContact O-N 3.09Å; K563-K619 PolarHBondContact N-O 2.93Å; K563-E621 HydrophobicContact CG-CB 4.04Å; K563-E621 HydrophobicContact CG-CG 3.87Å; K563-E621 WeakPolarHBondContact CG-OE2 3.36Å; K563-E621 IonicContact NZ-OE2 3.26Å; K563-E621 PolarHBondContact NZ-OE2 2.85Å
564	E	81.4	Confident	83.7	Confident	96 Å²	96	62.7 Å²	62.7	45%	0.449	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	124.1	-176.6	-58.2	-166.7	140.7	0	0	111.4	I618 K619	E564-I618 CarbonylContact O-C 3.58Å; E564-I618 WeakPolarHBondContact O-CA 3.5Å; E564-K619 HydrophobicContact CB-CB 4.25Å; E564-K619 PolarHBondContact N-O 2.86Å; E564-K619 VanDerWaalsContact N-O 3.08Å; E564-K619 PolarHBondContact O-N 2.9Å; E564-K619 WeakPolarHBondContact OE2-CD 3.31Å; E564-K619 WeakPolarHBondContact OE2-CE 3.15Å; E564-K619 IonicContact OE2-NZ 2.69Å; E564-K619 PolarHBondContact OE2-NZ 3.2Å
565	P	81.1	Confident	83.2	Confident	38 Å²	38	63.6 Å²	63.6	25%	0.247	34%	0.342	C	S	.	.	S	Bend	cis	-65.9	141.2	-11.3	-13	26.7	0	0	0	112.1	P567 V572 V574	P565-P567 WeakPolarHBondContact O-CD 3.28Å; P565-V572 HydrophobicContact CB-CG1 4.14Å; P565-V572 HydrophobicContact CG-CG1 3.87Å; P565-V574 HydrophobicContact CG-CG2 3.94Å
566	K	79	Confident	82.6	Confident	171 Å²	171	60.8 Å²	60.8	74%	0.743	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-60.1	117.9	179.1	-70.8	-174.6	178.6	-175.8	0	111.1	K563	K563-K566 WeakPolarHBondContact O-CG 3.5Å; K563-K566 PolarHBondContact O-N 3.09Å
567	P	81.6	Confident	81.8	Confident	57 Å²	57	60.4 Å²	60.4	37%	0.37	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-64.6	144.9	-178.6	24.5	-33	0	0	0	111.7	I562 P565 V571 V572	I562-P567 WeakPolarHBondContact O-CD 3.46Å; P565-P567 WeakPolarHBondContact O-CD 3.28Å; P567-V571 CarbonylContact C-O 3.54Å; P567-V571 WeakPolarHBondContact CA-O 3.36Å; P567-V572 HydrophobicContact CB-CG2 3.9Å
568	R	77	Confident	81.1	Confident	201 Å²	201	57 Å²	57	76%	0.758	31%	0.308	S	S	*	.	B	Isolated β-bridge	trans	-119.1	115.2	173.1	-63.5	-175.8	-178.6	-170.5	1.1	108.5	G570 V571	R568-G570 VanDerWaalsContact C-N 3.27Å; R568-G570 PolarHBondContact O-N 2.92Å; R568-V571 PolarHBondContact N-O 2.72Å; R568-V571 WeakPolarHBondContact O-CB 3.39Å; R568-V571 PolarHBondContact O-N 3.04Å
569	N	77.9	Confident	80	Confident	174 Å²	174	56.1 Å²	56.1	93%	0.93	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	43.7	-176.5	-58.2	-1.8	0	0	0	113.2	V571	N569-V571 VanDerWaalsContact C-N 3.26Å; N569-V571 PolarHBondContact O-N 2.88Å
570	G	75.9	Confident	78.7	Confident	42 Å²	42	56 Å²	56	43%	0.433	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	2	-177.5	0	0	0	0	0	115.4	R568 A686 T687	R568-G570 VanDerWaalsContact C-N 3.27Å; R568-G570 PolarHBondContact O-N 2.92Å; G570-A686 CarbonylContact O-C 3.6Å; G570-A686 WeakPolarHBondContact O-CA 3.28Å; G570-T687 PolarHBondContact O-N 3.15Å
571	V	80.9	Confident	77.1	Confident	34 Å²	34	63.6 Å²	63.6	21%	0.206	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.7	177.1	-172.6	0	0	0	0	110.7	P567 R568 N569 T687 E689	P567-V571 CarbonylContact C-O 3.54Å; P567-V571 WeakPolarHBondContact CA-O 3.36Å; R568-V571 PolarHBondContact N-O 2.72Å; R568-V571 WeakPolarHBondContact O-CB 3.39Å; R568-V571 PolarHBondContact O-N 3.04Å; N569-V571 VanDerWaalsContact C-N 3.26Å; N569-V571 PolarHBondContact O-N 2.88Å; V571-T687 CarbonylContact C-O 3.5Å; V571-T687 VanDerWaalsContact CA-O 3.32Å; V571-T687 WeakPolarHBondContact CA-O 3.19Å; V571-T687 WeakPolarHBondContact CG1-O 3.29Å; V571-E689 HydrophobicContact CG1-CB 3.68Å; V571-E689 WeakPolarHBondContact CG1-OE2 3.33Å
572	V	84.2	Confident	75.6	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	99.3	169.4	177	0	0	0	0	107.5	I562 P565 P567 V574 I618 A686 T687 L688 E689	I562-V572 HydrophobicContact CD1-CG2 4.21Å; I562-V572 HydrophobicContact CG2-CG2 4.16Å; P565-V572 HydrophobicContact CB-CG1 4.14Å; P565-V572 HydrophobicContact CG-CG1 3.87Å; P567-V572 HydrophobicContact CB-CG2 3.9Å; V572-V574 HydrophobicContact CG1-CG2 4.38Å; V572-I618 HydrophobicContact CG1-CD1 4.5Å; V572-A686 HydrophobicContact CG2-CB 3.93Å; V572-T687 PolarHBondContact N-O 3.12Å; V572-L688 HydrophobicContact CB-CD1 4.41Å; V572-L688 HydrophobicContact CG1-CD1 4.12Å; V572-L688 WeakPolarHBondContact O-CA 2.92Å; V572-E689 PolarHBondContact O-N 2.7Å
573	S	80.4	Confident	74.1	Confident	65 Å²	65	69 Å²	69	46%	0.455	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	119.8	178.9	-53.8	0	0	0	0	110.9	E689	S573-E689 CarbonylContact C-O 3.56Å; S573-E689 WeakPolarHBondContact CA-O 3.5Å
574	V	82.9	Confident	73.1	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.024	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.3	174.4	174	0	0	0	0	109.3	P565 V572 I576 L688 E689 V690 T691	P565-V574 HydrophobicContact CG-CG2 3.94Å; V572-V574 HydrophobicContact CG1-CG2 4.38Å; V574-I576 HydrophobicContact CG1-CG1 4.13Å; V574-L688 HydrophobicContact CB-CD1 4.32Å; V574-L688 HydrophobicContact CG2-CD1 3.66Å; V574-E689 PolarHBondContact N-O 2.71Å; V574-V690 WeakPolarHBondContact O-CA 3.34Å; V574-T691 PolarHBondContact O-N 2.68Å; V574-T691 PolarHBondContact O-OG1 3.4Å
575	S	76.9	Confident	72.3	Confident	58 Å²	58	65.8 Å²	65.8	41%	0.406	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119	175.1	-60.9	0	0	0	0	109.5	P577	S575-P577 WeakPolarHBondContact O-CD 3.43Å
576	I	77.7	Confident	71.4	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	110	177.9	-56.7	179.1	0	0	0	108.5	V574 V578 I585 A615 V655 V690 T691 F692 I693	V574-I576 HydrophobicContact CG1-CG1 4.13Å; I576-V578 PolarHBondContact O-N 2.95Å; I576-I585 HydrophobicContact CG2-CB 4.33Å; I576-I585 HydrophobicContact CG2-CD1 4.06Å; I576-I585 HydrophobicContact CG2-CG1 3.91Å; I576-I585 HydrophobicContact CG2-CG2 3.52Å; I576-A615 HydrophobicContact CD1-CB 3.55Å; I576-A615 HydrophobicContact CG1-CB 4.02Å; I576-A615 HydrophobicContact CG2-CB 4.4Å; I576-V655 HydrophobicContact CD1-CG2 3.73Å; I576-V690 HydrophobicContact CD1-CG1 3.25Å; I576-V690 HydrophobicContact CG1-CG1 3.82Å; I576-T691 PolarHBondContact N-O 3.2Å; I576-F692 HydrophobicContact CB-CD1 3.86Å; I576-F692 HydrophobicContact CB-CE1 4.09Å; I576-F692 HydrophobicContact CD1-CD1 4.25Å; I576-F692 HydrophobicContact CD1-CE1 3.66Å; I576-F692 HydrophobicContact CD1-CZ 3.9Å; I576-F692 HydrophobicContact CG1-CE1 4.46Å; I576-F692 HydrophobicContact CG2-CD1 3.9Å; I576-F692 HydrophobicContact CG2-CE1 3.93Å; I576-F692 WeakPolarHBondContact O-CA 3.04Å; I576-I693 PolarHBondContact O-N 3.18Å
577	P	71	Confident	70.3	Confident	7 Å²	7	60.9 Å²	60.9	5%	0.045	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	123	174.5	27.7	-28.1	0	0	0	111.2	S575 V586 I693 L695	S575-P577 WeakPolarHBondContact O-CD 3.43Å; P577-V586 WeakPolarHBondContact CG-O 3.3Å; P577-V586 PolarHBondContact O-N 3.26Å; P577-I693 CarbonylContact C-O 3.42Å; P577-I693 WeakPolarHBondContact CA-O 3.32Å; P577-L695 HydrophobicContact CB-CB 4.42Å; P577-L695 HydrophobicContact CB-CD1 3.85Å
578	V	70	Confident	68.9	Low	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	133.4	175.6	-178.2	0	0	0	0	109.7	I576 A580 I585 A660 I664 F692 I693 L695	I576-V578 PolarHBondContact O-N 2.95Å; V578-A580 PolarHBondContact O-N 3.03Å; V578-I585 HydrophobicContact CG2-CG1 4.33Å; V578-A660 HydrophobicContact CG1-CB 3.63Å; V578-A660 HydrophobicContact CG2-CB 4.06Å; V578-I664 HydrophobicContact CB-CD1 3.99Å; V578-I664 HydrophobicContact CB-CG1 3.85Å; V578-I664 HydrophobicContact CG1-CD1 3.83Å; V578-I664 HydrophobicContact CG1-CG1 3.97Å; V578-I664 HydrophobicContact CG2-CG1 4.17Å; V578-F692 HydrophobicContact CG2-CB 4.29Å; V578-F692 HydrophobicContact CG2-CD1 3.81Å; V578-I693 PolarHBondContact N-O 2.8Å; V578-L695 WeakPolarHBondContact O-CB 3.44Å; V578-L695 PolarHBondContact O-N 3.2Å; V578-L695 VanDerWaalsContact O-N 3.09Å
579	N	66.1	Low	67.1	Low	36 Å²	36	62.5 Å²	62.5	19%	0.193	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	96.8	171.6	-174.4	-18.9	0	0	0	110.2	H581 R582 G583 E584 V586 L695	N579-H581 PolarHBondContact O-N 3.21Å; N579-H581 PolarHBondContact OD1-N 2.87Å; N579-R582 PolarHBondContact O-N 2.8Å; N579-G583 PolarHBondContact O-N 2.99Å; N579-E584 PolarHBondContact N-O 2.86Å; N579-V586 HydrophobicContact CB-CG2 4.02Å; N579-L695 HydrophobicContact CB-CD2 4.44Å
580	A	59.1	Low	65	Low	44 Å²	44	57.2 Å²	57.2	36%	0.364	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.4	-179.1	0	0	0	0	0	115	V578 I664	V578-A580 PolarHBondContact O-N 3.03Å; A580-I664 HydrophobicContact CB-CD1 4.1Å
581	H	56	Low	62.8	Low	161 Å²	161	62.8 Å²	62.8	75%	0.745	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-8.3	176.5	-62.3	-52.3	0	0	0	114.4	N579	N579-H581 PolarHBondContact O-N 3.21Å; N579-H581 PolarHBondContact OD1-N 2.87Å
582	R	57.1	Low	60.3	Low	184 Å²	184	68.9 Å²	68.9	69%	0.694	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128	-18.9	178	-70.4	-166.9	175.2	-175.4	-3.1	115.1	N579 E584	N579-R582 PolarHBondContact O-N 2.8Å; R582-E584 HydrophobicContact CB-CB 4.35Å; R582-E584 HydrophobicContact CB-CG 4.04Å; R582-E584 WeakPolarHBondContact CB-OE2 3.02Å; R582-E584 WeakPolarHBondContact CD-OE2 3.43Å; R582-E584 IonicContact NH1-OE2 3.55Å; R582-E584 PolarHBondContact O-N 3.27Å
583	G	56.1	Low	57.7	Low	8 Å²	8	74.9 Å²	74.9	8%	0.082	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	7.2	-174	0	0	0	0	0	114.4	N579 N659 A660	N579-G583 PolarHBondContact O-N 2.99Å; G583-N659 WeakPolarHBondContact CA-OD1 3.37Å; G583-A660 WeakPolarHBondContact O-CB 3.29Å; G583-A660 PolarHBondContact O-N 2.92Å
584	E	63.6	Low	55.4	Low	82 Å²	82	81.3 Å²	81.3	38%	0.383	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	146.2	179.1	-62.5	170.9	147.2	0	0	110.9	N579 R582	N579-E584 PolarHBondContact N-O 2.86Å; R582-E584 HydrophobicContact CB-CB 4.35Å; R582-E584 HydrophobicContact CB-CG 4.04Å; R582-E584 WeakPolarHBondContact CB-OE2 3.02Å; R582-E584 WeakPolarHBondContact CD-OE2 3.43Å; R582-E584 IonicContact NH1-OE2 3.55Å; R582-E584 PolarHBondContact O-N 3.27Å
585	I	63.5	Low	53.1	Low	16 Å²	16	89.8 Å²	89.8	8%	0.082	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	138.4	166.3	-72.8	164.9	0	0	0	108.6	I576 V578 F613 V655 A660 F692	I576-I585 HydrophobicContact CG2-CB 4.33Å; I576-I585 HydrophobicContact CG2-CD1 4.06Å; I576-I585 HydrophobicContact CG2-CG1 3.91Å; I576-I585 HydrophobicContact CG2-CG2 3.52Å; V578-I585 HydrophobicContact CG2-CG1 4.33Å; I585-F613 HydrophobicContact CB-CB 4.24Å; I585-F613 HydrophobicContact CD1-CB 4.09Å; I585-V655 HydrophobicContact CD1-CB 3.72Å; I585-V655 HydrophobicContact CD1-CG1 3.97Å; I585-V655 HydrophobicContact CD1-CG2 4.03Å; I585-A660 HydrophobicContact CD1-CB 4.39Å; I585-A660 HydrophobicContact CG1-CB 3.96Å; I585-F692 HydrophobicContact CD1-CE1 4.09Å
586	V	61.7	Low	50.8	Low	51 Å²	51	97 Å²	97	31%	0.309	50%	0.5	S	S	.	.			trans	-104	108.8	175.7	-178.8	0	0	0	0	108.8	P577 N579 E588 L695	P577-V586 WeakPolarHBondContact CG-O 3.3Å; P577-V586 PolarHBondContact O-N 3.26Å; N579-V586 HydrophobicContact CB-CG2 4.02Å; V586-E588 PolarHBondContact O-N 2.92Å; V586-L695 HydrophobicContact CB-CD1 4.48Å; V586-L695 HydrophobicContact CG2-CD2 4.14Å
587	T	57.5	Low	48.8	Very low	55 Å²	55	102.4 Å²	102.4	34%	0.337	54%	0.536	S	S	.	.			trans	-69.6	124.8	167.2	48.5	0	0	0	0	109.8	L589 P614	T587-L589 PolarHBondContact O-N 3.46Å; T587-P614 HydrophobicContact CG2-CB 4.11Å; T587-P614 HydrophobicContact CG2-CG 3.92Å; T587-P614 WeakPolarHBondContact CG2-O 3.29Å
588	E	51	Low	46.8	Very low	140 Å²	140	108.5 Å²	108.5	65%	0.654	57%	0.573	S	S	*	*			trans	-71.3	76.7	160.6	-69	-166.8	150.3	0	0	109.1	V586 G590	V586-E588 PolarHBondContact O-N 2.92Å; E588-G590 PolarHBondContact O-N 2.84Å
589	L	39.7	Very low	44.9	Very low	152 Å²	152	112.9 Å²	112.9	80%	0.796	60%	0.604	S	S	*	*			trans	-67.7	114.4	160.6	-119.3	75.7	0	0	0	106.9	T587	T587-L589 PolarHBondContact O-N 3.46Å
590	G	34.3	Very low	43	Very low	62 Å²	62	119 Å²	119	64%	0.639	64%	0.636	S	S	*	*			trans	-61.4	150.9	-178.6	0	0	0	0	0	112.8	E588 D592	E588-G590 PolarHBondContact O-N 2.84Å; G590-D592 VanDerWaalsContact C-N 3.34Å; G590-D592 PolarHBondContact O-N 3.26Å
591	N	28.5	Very low	42	Very low	160 Å²	160	122.5 Å²	122.5	86%	0.856	66%	0.655	S	S	*	*			trans	-71.2	88.5	168.7	-80.2	-17.5	0	0	0	110.1
592	D	29.9	Very low	40.9	Very low	161 Å²	161	122 Å²	122	86%	0.861	66%	0.656	S	S	*	*			trans	-113.5	100.1	158.2	-80.4	-53	0	0	0	108.5	G590	G590-D592 VanDerWaalsContact C-N 3.34Å; G590-D592 PolarHBondContact O-N 3.26Å
593	T	29.1	Very low	39.4	Very low	127 Å²	127	118.4 Å²	118.4	78%	0.779	66%	0.659	S	S	*	*			trans	-118	86.8	-180	-42.5	0	0	0	0	110.5
594	E	30.8	Very low	38.4	Very low	199 Å²	199	129 Å²	129	93%	0.93	70%	0.696	S	S	*	*			trans	-148.2	141.3	145.9	-123.9	174.6	-141.4	0	0	110.4
595	E	34.8	Very low	36.7	Very low	182 Å²	182	129.9 Å²	129.9	85%	0.85	71%	0.712	S	S	*	*			trans	-93.1	146.8	-161.4	-57.8	-178.6	137.2	0	0	113.6
596	K	28.4	Very low	35.5	Very low	209 Å²	209	134.7 Å²	134.7	91%	0.909	74%	0.742	S	S	*	*			trans	-151.6	116.1	146.1	-121.5	167.9	-171.9	170.8	0	112.5
597	P	37.2	Very low	34.3	Very low	114 Å²	114	140.4 Å²	140.4	74%	0.74	77%	0.77	S	S	*	*			trans	-99.5	131.5	-171.6	35	-32.6	0	0	0	113.9
598	T	28.8	Very low	33.3	Very low	135 Å²	135	144.1 Å²	144.1	83%	0.828	79%	0.787	S	S	*	*			trans	-145.6	98.7	157.9	-11.5	0	0	0	0	113.2
599	S	29.4	Very low	32.8	Very low	92 Å²	92	140.9 Å²	140.9	64%	0.643	79%	0.791	S	S	*	*			trans	14.1	119.1	152.5	58.8	0	0	0	0	122.7
600	L	27.4	Very low	33	Very low	166 Å²	166	140.5 Å²	140.5	87%	0.869	78%	0.784	S	S	*	*				70.5	157.4	126.9	-61.9	171.9	0	0	0	120.9
601	P	36.3	Very low	33.7	Very low	117 Å²	117	144 Å²	144	76%	0.76	79%	0.787	S	S	*	*			cis	-120.7	166.3	-15	37.7	-23.7	0	0	0	114.1
602	I	32.9	Very low	35.2	Very low	151 Å²	151	137.7 Å²	137.7	77%	0.774	76%	0.76	S	S	*	*			trans	-75.5	128.7	176	-64.5	162.1	0	0	0	110.9	R604	I602-R604 HydrophobicContact CG2-CB 4.14Å; I602-R604 HydrophobicContact CG2-CG 3.86Å
603	S	26.6	Very low	36.9	Very low	108 Å²	108	133.5 Å²	133.5	76%	0.755	74%	0.735	S	S	*	*			trans	-119.2	79.3	159.7	-176.7	0	0	0	0	110.6	S605	S603-S605 VanDerWaalsContact C-N 3.29Å; S603-S605 PolarHBondContact O-N 2.81Å
604	R	34	Very low	39	Very low	229 Å²	229	130.3 Å²	130.3	86%	0.864	72%	0.716	S	S	*	*			trans	-75.8	81.4	167.8	-86.3	-179	170	173.3	-3.8	109.6	I602 V606	I602-R604 HydrophobicContact CG2-CB 4.14Å; I602-R604 HydrophobicContact CG2-CG 3.86Å; R604-V606 PolarHBondContact O-N 2.96Å
605	S	28.7	Very low	41	Very low	101 Å²	101	121.4 Å²	121.4	71%	0.706	68%	0.677	S	S	*	*			trans	-72.1	117.6	158.3	48	0	0	0	0	108.5	S603 L607	S603-S605 VanDerWaalsContact C-N 3.29Å; S603-S605 PolarHBondContact O-N 2.81Å; S605-L607 PolarHBondContact O-N 2.76Å
606	V	37.8	Very low	43.1	Very low	118 Å²	118	114.6 Å²	114.6	72%	0.715	65%	0.649	S	S	*	*			trans	-62.2	127	175.3	175.7	0	0	0	0	109.3	R604	R604-V606 PolarHBondContact O-N 2.96Å
607	L	37.9	Very low	45.7	Very low	171 Å²	171	107.5 Å²	107.5	90%	0.895	62%	0.624	S	S	*	*			trans	-112.1	123.6	159.2	-120.3	162.4	0	0	0	106	S605	S605-L607 PolarHBondContact O-N 2.76Å
608	D	36.1	Very low	48	Very low	132 Å²	132	102.1 Å²	102.1	71%	0.706	59%	0.588	S	S	*	*			trans	-71.3	145.5	-158.4	-73.4	-61.4	0	0	0	115
609	G	40.9	Very low	50.7	Low	72 Å²	72	100.6 Å²	100.6	74%	0.742	57%	0.57	S	S	*	*	S	Bend	trans	101.1	-15.7	148.8	0	0	0	0	0	118.8
610	F	43.5	Very low	53.5	Low	145 Å²	145	96.7 Å²	96.7	64%	0.636	54%	0.544	S	S	*	.			trans	-105.2	98.4	-172.2	-71.4	-87.4	0	0	0	113.8	G612	F610-G612 PolarHBondContact O-N 2.9Å
611	N	49.7	Very low	56.4	Low	134 Å²	134	94 Å²	94	72%	0.717	53%	0.527	S	S	*	.			trans	-81.4	62.3	168.9	-75.2	-18.7	0	0	0	110.7
612	G	59.3	Low	59	Low	28 Å²	28	89.5 Å²	89.5	29%	0.289	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-82.5	128	178.2	0	0	0	0	0	112.8	F610 V655	F610-G612 PolarHBondContact O-N 2.9Å; G612-V655 WeakPolarHBondContact CA-O 3.4Å
613	F	65.7	Low	61.6	Low	74 Å²	74	85.5 Å²	85.5	33%	0.325	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	132.6	166.2	-69.7	-90.7	0	0	0	109.7	I585 F654 V655	I585-F613 HydrophobicContact CB-CB 4.24Å; I585-F613 HydrophobicContact CD1-CB 4.09Å; F613-F654 CarbonylContact O-C 3.6Å; F613-F654 VanDerWaalsContact O-CA 3.25Å; F613-F654 WeakPolarHBondContact O-CA 3.34Å; F613-V655 PolarHBondContact N-O 2.91Å; F613-V655 PolarHBondContact O-N 2.9Å
614	P	72.5	Confident	64.6	Low	59 Å²	59	80.7 Å²	80.7	38%	0.383	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	142.8	167.5	27	-33.1	0	0	0	109.6	T587 F654	T587-P614 HydrophobicContact CG2-CB 4.11Å; T587-P614 HydrophobicContact CG2-CG 3.92Å; T587-P614 WeakPolarHBondContact CG2-O 3.29Å; P614-F654 HydrophobicContact CB-CD1 4.04Å; P614-F654 HydrophobicContact CB-CE1 3.77Å; P614-F654 HydrophobicContact CB-CZ 4.48Å; P614-F654 HydrophobicContact CG-CE1 4.45Å
615	A	73.3	Confident	67.1	Low	13 Å²	13	71.3 Å²	71.3	11%	0.107	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	-45.9	-174.3	0	0	0	0	0	113.7	I576 L653 V655	I576-A615 HydrophobicContact CD1-CB 3.55Å; I576-A615 HydrophobicContact CG1-CB 4.02Å; I576-A615 HydrophobicContact CG2-CB 4.4Å; A615-L653 WeakPolarHBondContact CB-O 3.2Å; A615-L653 PolarHBondContact N-O 2.7Å; A615-V655 HydrophobicContact CB-CG2 3.93Å
616	S	78.2	Confident	69.8	Low	39 Å²	39	69.6 Å²	69.6	27%	0.273	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	164.9	176.9	-168	0	0	0	0	109.9	L653	S616-L653 PolarHBondContact N-O 3.34Å; S616-L653 PolarHBondContact O-N 2.81Å
617	T	82.7	Confident	72	Confident	60 Å²	60	68.8 Å²	68.8	37%	0.368	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.2	170.4	-48.8	0	0	0	0	108.5	K619 Q652	T617-K619 HydrophobicContact CG2-CG 4.45Å; T617-Q652 HydrophobicContact CG2-CG 3.98Å
618	I	86.1	Confident	74.3	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	37%	0.368	C	S	.	.			trans	-100.3	116.8	172.7	-52.3	-176.6	0	0	0	107.3	I562 E564 V572 Y633 M646 G651 L672 L688	I562-I618 HydrophobicContact CG2-CG2 3.87Å; E564-I618 CarbonylContact O-C 3.58Å; E564-I618 WeakPolarHBondContact O-CA 3.5Å; V572-I618 HydrophobicContact CG1-CD1 4.5Å; I618-Y633 VanDerWaalsContact O-CE1 3.23Å; I618-Y633 WeakPolarHBondContact O-CE1 3.31Å; I618-M646 HydrophobicContact CD1-CE 3.74Å; I618-M646 HydrophobicContact CG1-CE 4.33Å; I618-G651 PolarHBondContact N-O 3.37Å; I618-L672 HydrophobicContact CD1-CD2 3.76Å; I618-L672 HydrophobicContact CG2-CD2 3.97Å; I618-L688 HydrophobicContact CD1-CD1 3.7Å; I618-L688 HydrophobicContact CD1-CD2 3.8Å; I618-L688 HydrophobicContact CD1-CG 4.34Å
619	K	86.5	Confident	76.6	Confident	103 Å²	103	56.7 Å²	56.7	45%	0.448	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.9	176.1	-55.4	-179	-164.8	156.7	0	109.7	K563 E564 T617	K563-K619 PolarHBondContact N-O 2.93Å; E564-K619 HydrophobicContact CB-CB 4.25Å; E564-K619 PolarHBondContact N-O 2.86Å; E564-K619 VanDerWaalsContact N-O 3.08Å; E564-K619 PolarHBondContact O-N 2.9Å; E564-K619 WeakPolarHBondContact OE2-CD 3.31Å; E564-K619 WeakPolarHBondContact OE2-CE 3.15Å; E564-K619 IonicContact OE2-NZ 2.69Å; E564-K619 PolarHBondContact OE2-NZ 3.2Å; T617-K619 HydrophobicContact CG2-CG 4.45Å
620	A	87.6	Confident	78.8	Confident	11 Å²	11	57.2 Å²	57.2	9%	0.091	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	161.7	158.2	0	0	0	0	0	109.7	V561 I562 L631 Y633 V674	V561-A620 VanDerWaalsContact O-CA 3.28Å; V561-A620 WeakPolarHBondContact O-CA 3.06Å; I562-A620 HydrophobicContact CG1-CB 4.18Å; A620-L631 VanDerWaalsContact C-CD1 3.44Å; A620-L631 HydrophobicContact CB-CD1 3.68Å; A620-L631 WeakPolarHBondContact O-CD1 3.39Å; A620-Y633 HydrophobicContact CB-CE1 4.09Å; A620-Y633 PolarHBondContact N-OH 2.91Å; A620-Y633 PolarHBondContact O-OH 2.91Å; A620-V674 HydrophobicContact CB-CB 4.47Å; A620-V674 HydrophobicContact CB-CG1 3.91Å; A620-V674 HydrophobicContact CB-CG2 4.31Å
621	E	88.9	Confident	81	Confident	109 Å²	109	51.4 Å²	51.4	51%	0.509	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	131	173.4	-68.9	167.2	-170.3	0	0	106.8	V561 K563	V561-E621 PolarHBondContact N-O 3.24Å; V561-E621 PolarHBondContact O-N 2.8Å; K563-E621 HydrophobicContact CG-CB 4.04Å; K563-E621 HydrophobicContact CG-CG 3.87Å; K563-E621 WeakPolarHBondContact CG-OE2 3.36Å; K563-E621 IonicContact NZ-OE2 3.26Å; K563-E621 PolarHBondContact NZ-OE2 2.85Å
622	D	89.7	Confident	82.8	Confident	23 Å²	23	47.7 Å²	47.7	12%	0.123	28%	0.283	C	S	.	.			trans	-97.1	145.4	161.4	-128.7	-59.9	0	0	0	109.3	S559 P560 L631	S559-D622 PolarHBondContact N-OD1 3.08Å; P560-D622 WeakPolarHBondContact CA-OD2 3.26Å; P560-D622 WeakPolarHBondContact CD-OD2 3.41Å; P560-D622 WeakPolarHBondContact CG-OD2 3.31Å; D622-L631 HydrophobicContact CB-CD2 4.05Å
623	P	87.8	Confident	84.2	Confident	66 Å²	66	47.1 Å²	47.1	43%	0.429	27%	0.273	S	S	.	.	S	Bend	trans	-67.7	-35.9	166.7	-23.1	36.4	0	0	0	113.8	E523 N558	E523-P623 HydrophobicContact CG-CB 3.7Å; N558-P623 HydrophobicContact CB-CB 4.27Å; N558-P623 HydrophobicContact CB-CG 3.86Å
624	D	90.1	Very high	85.2	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.037	27%	0.273	C	S	.	.	S	Bend	trans	-65.6	169.5	-169.4	-60.5	1.1	0	0	0	112.5	N556 D557 N558 N628 G629	N556-D624 WeakPolarHBondContact CA-OD2 3.25Å; D557-D624 PolarHBondContact N-OD2 2.86Å; N558-D624 WeakPolarHBondContact CB-OD1 3.2Å; N558-D624 PolarHBondContact N-OD1 2.91Å; N558-D624 PolarHBondContact N-OD2 2.84Å; N558-D624 PolarHBondContact ND2-OD1 3.03Å; D624-N628 HydrophobicContact CB-CB 3.59Å; D624-G629 WeakPolarHBondContact O-CA 3.45Å; D624-G629 PolarHBondContact O-N 2.91Å
625	S	85.4	Confident	85.7	Confident	32 Å²	32	45.4 Å²	45.4	22%	0.224	26%	0.262	C	S	.	.			trans	-112	168.7	-170	-81.1	0	0	0	0	114.7	H522 D554 L627 N628 G629	H522-S625 PolarHBondContact NE2-OG 3Å; D554-S625 PolarHBondContact OD1-N 2.78Å; D554-S625 WeakPolarHBondContact OD2-CB 3.11Å; S625-L627 PolarHBondContact O-N 2.93Å; S625-L627 VanDerWaalsContact O-N 3.09Å; S625-N628 WeakPolarHBondContact O-CA 3.47Å; S625-N628 VanDerWaalsContact O-CB 3.29Å; S625-N628 WeakPolarHBondContact O-CB 3.42Å; S625-N628 PolarHBondContact O-N 3.05Å; S625-G629 PolarHBondContact O-N 3.37Å
626	G	85.9	Confident	85.9	Confident	65 Å²	65	47.1 Å²	47.1	67%	0.67	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	-114.1	174.4	0	0	0	0	0	114.4
627	L	84.6	Confident	85.8	Confident	102 Å²	102	49.8 Å²	49.8	53%	0.534	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-25.2	175.7	-71.1	174.3	0	0	0	112.8	S625 Q630 M677 G678	S625-L627 PolarHBondContact O-N 2.93Å; S625-L627 VanDerWaalsContact O-N 3.09Å; L627-Q630 PolarHBondContact O-N 2.89Å; L627-M677 CarbonylContact O-C 3.55Å; L627-M677 WeakPolarHBondContact O-CA 3.25Å; L627-M677 WeakPolarHBondContact O-CB 3.42Å; L627-M677 PolarHBondContact O-N 3.03Å; L627-G678 PolarHBondContact O-N 2.89Å
628	N	85.6	Confident	85.3	Confident	22 Å²	22	49 Å²	49	12%	0.118	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-46.1	174.9	-57.4	-19.9	0	0	0	108.6	D554 L555 N556 D624 S625 Q630 D676 G678	D554-N628 VanDerWaalsContact CG-ND2 3.34Å; D554-N628 PolarHBondContact OD1-ND2 2.92Å; L555-N628 VanDerWaalsContact C-ND2 3.27Å; N556-N628 HydrophobicContact CB-CB 4.17Å; N556-N628 PolarHBondContact N-ND2 2.87Å; N556-N628 VanDerWaalsContact N-ND2 3.19Å; N556-N628 WeakPolarHBondContact OD1-CA 3.28Å; N556-N628 WeakPolarHBondContact OD1-CB 3.03Å; D624-N628 HydrophobicContact CB-CB 3.59Å; S625-N628 WeakPolarHBondContact O-CA 3.47Å; S625-N628 VanDerWaalsContact O-CB 3.29Å; S625-N628 WeakPolarHBondContact O-CB 3.42Å; S625-N628 PolarHBondContact O-N 3.05Å; N628-Q630 VanDerWaalsContact C-N 3.25Å; N628-Q630 PolarHBondContact O-N 2.87Å; N628-D676 WeakPolarHBondContact O-CB 3.11Å; N628-G678 WeakPolarHBondContact OD1-CA 3.46Å
629	G	83.7	Confident	85	Confident	26 Å²	26	51.4 Å²	51.4	27%	0.268	30%	0.301	S	S	.	.	S	Bend	trans	-69.6	-7.7	170.7	0	0	0	0	0	116.8	D624 S625 L631	D624-G629 WeakPolarHBondContact O-CA 3.45Å; D624-G629 PolarHBondContact O-N 2.91Å; S625-G629 PolarHBondContact O-N 3.37Å; G629-L631 PolarHBondContact O-N 2.7Å
630	Q	87.9	Confident	84	Confident	84 Å²	84	50.8 Å²	50.8	39%	0.393	31%	0.306	S	S	.	.			trans	-87	114.9	-174.8	-176.2	171.8	-10.2	0	0	111.3	L627 N628 D676 M677	L627-Q630 PolarHBondContact O-N 2.89Å; N628-Q630 VanDerWaalsContact C-N 3.25Å; N628-Q630 PolarHBondContact O-N 2.87Å; Q630-D676 CarbonylContact O-C 3.59Å; Q630-D676 VanDerWaalsContact O-C 3.24Å; Q630-D676 WeakPolarHBondContact O-CA 3.25Å; Q630-M677 HydrophobicContact CB-CB 4.35Å; Q630-M677 HydrophobicContact CB-CG 4.49Å; Q630-M677 HydrophobicContact CG-CG 4.35Å; Q630-M677 HydrophobicContact CG-SD 3.84Å; Q630-M677 WeakPolarHBondContact O-CG 3.35Å; Q630-M677 PolarHBondContact O-N 2.87Å
631	L	88.9	Confident	83	Confident	23 Å²	23	58.3 Å²	58.3	12%	0.12	35%	0.345	C	S	.	.			trans	-91.5	145	-174.5	-60.9	-175.8	0	0	0	114.1	P560 A620 D622 G629 Y633 V674 A675	P560-L631 HydrophobicContact CB-CD2 3.61Å; P560-L631 HydrophobicContact CG-CD2 3.55Å; A620-L631 VanDerWaalsContact C-CD1 3.44Å; A620-L631 HydrophobicContact CB-CD1 3.68Å; A620-L631 WeakPolarHBondContact O-CD1 3.39Å; D622-L631 HydrophobicContact CB-CD2 4.05Å; G629-L631 PolarHBondContact O-N 2.7Å; L631-Y633 HydrophobicContact CB-CE2 4.02Å; L631-V674 HydrophobicContact CB-CG1 4.28Å; L631-V674 HydrophobicContact CD1-CG1 4.36Å; L631-V674 HydrophobicContact CD2-CG1 4.25Å; L631-A675 CarbonylContact C-O 3.54Å; L631-A675 WeakPolarHBondContact CA-O 3.23Å
632	K	88.4	Confident	82.1	Confident	56 Å²	56	54.7 Å²	54.7	24%	0.243	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.2	172.6	-170.3	-179.4	-175.6	72.6	0	111.1	I634 E648 V674 A675	K632-I634 HydrophobicContact CD-CD1 4.07Å; K632-I634 HydrophobicContact CD-CG1 4.42Å; K632-I634 HydrophobicContact CG-CD1 4.38Å; K632-I634 HydrophobicContact CG-CG1 4.22Å; K632-E648 CarbonylContact C-O 3.6Å; K632-E648 WeakPolarHBondContact CA-O 3.32Å; K632-E648 WeakPolarHBondContact CE-OE2 3.02Å; K632-E648 HydrophobicContact CG-CB 4.33Å; K632-E648 VanDerWaalsContact NZ-CD 3.33Å; K632-E648 IonicContact NZ-OE1 2.64Å; K632-E648 IonicContact NZ-OE2 2.67Å; K632-E648 PolarHBondContact NZ-OE2 3.43Å; K632-V674 WeakPolarHBondContact O-CA 3.48Å; K632-A675 PolarHBondContact N-O 2.79Å; K632-A675 PolarHBondContact O-N 2.83Å
633	Y	88.6	Confident	81.5	Confident	16 Å²	16	55 Å²	55	6%	0.063	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.6	-175.5	-60.8	-96.6	0	0	0	111.2	I618 A620 L631 E648 G651 V674	I618-Y633 VanDerWaalsContact O-CE1 3.23Å; I618-Y633 WeakPolarHBondContact O-CE1 3.31Å; A620-Y633 HydrophobicContact CB-CE1 4.09Å; A620-Y633 PolarHBondContact N-OH 2.91Å; A620-Y633 PolarHBondContact O-OH 2.91Å; L631-Y633 HydrophobicContact CB-CE2 4.02Å; Y633-E648 PolarHBondContact N-O 3.01Å; Y633-E648 WeakPolarHBondContact O-CA 3.4Å; Y633-G651 VanDerWaalsContact CG-CA 3.5Å; Y633-V674 HydrophobicContact CD1-CB 4.47Å; Y633-V674 HydrophobicContact CD1-CG1 4.09Å; Y633-V674 HydrophobicContact CD1-CG2 3.65Å; Y633-V674 HydrophobicContact CE1-CG1 3.95Å; Y633-V674 HydrophobicContact CE1-CG2 3.85Å
634	I	86.1	Confident	81.2	Confident	66 Å²	66	52.2 Å²	52.2	34%	0.338	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.6	-175.7	-54.1	179.6	0	0	0	110.6	K632 S636 S673	K632-I634 HydrophobicContact CD-CD1 4.07Å; K632-I634 HydrophobicContact CD-CG1 4.42Å; K632-I634 HydrophobicContact CG-CD1 4.38Å; K632-I634 HydrophobicContact CG-CG1 4.22Å; I634-S636 PolarHBondContact O-N 3.41Å; I634-S673 PolarHBondContact N-O 2.87Å; I634-S673 PolarHBondContact O-N 2.7Å; I634-S673 VanDerWaalsContact O-O 3.13Å
635	I	83.5	Confident	80.8	Confident	30 Å²	30	57.7 Å²	57.7	15%	0.154	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	104.5	165.5	-59.7	173.4	0	0	0	107.9	N639 F644 M646 L653 M670 E671	I635-N639 HydrophobicContact CG2-CB 4.07Å; I635-F644 HydrophobicContact CD1-CB 4.19Å; I635-M646 HydrophobicContact CD1-CB 3.88Å; I635-M646 HydrophobicContact CD1-CE 4.36Å; I635-M646 HydrophobicContact CG1-CB 4.03Å; I635-M646 HydrophobicContact CG1-CE 4.36Å; I635-M646 HydrophobicContact CG1-SD 4.09Å; I635-L653 HydrophobicContact CD1-CD1 4.02Å; I635-M670 HydrophobicContact CD1-SD 4.09Å; I635-M670 HydrophobicContact CG2-CB 3.98Å; I635-M670 HydrophobicContact CG2-CG 4.32Å; I635-M670 HydrophobicContact CG2-SD 3.96Å; I635-E671 CarbonylContact C-O 3.41Å; I635-E671 WeakPolarHBondContact CA-O 3.09Å
636	S	77.9	Confident	80.7	Confident	50 Å²	50	56.6 Å²	56.6	35%	0.35	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-41.9	-173.2	54.4	0	0	0	0	113.3	I634 E671	I634-S636 PolarHBondContact O-N 3.41Å; S636-E671 PolarHBondContact N-O 2.73Å; S636-E671 WeakPolarHBondContact OG-CB 3.41Å; S636-E671 PolarHBondContact OG-O 2.69Å
637	N	76.7	Confident	80.5	Confident	95 Å²	95	55.5 Å²	55.5	51%	0.508	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	169	-178	-71.9	-61.6	0	0	0	112.8	N639 M670 E671	N637-N639 VanDerWaalsContact C-N 3.33Å; N637-N639 PolarHBondContact O-N 3.18Å; N637-M670 WeakPolarHBondContact O-CA 3.24Å; N637-E671 HydrophobicContact CB-CB 4.1Å; N637-E671 HydrophobicContact CB-CG 4.22Å; N637-E671 WeakPolarHBondContact CB-OE2 3.1Å; N637-E671 PolarHBondContact ND2-OE2 2.75Å; N637-E671 PolarHBondContact O-N 2.96Å
638	G	71.4	Confident	80.5	Confident	43 Å²	43	55 Å²	55	44%	0.443	31%	0.305	S	S	.	.			trans	85.1	-10	171.6	0	0	0	0	0	115.9	T640	G638-T640 PolarHBondContact O-N 3.15Å
639	N	79.7	Confident	80.4	Confident	50 Å²	50	59.1 Å²	59.1	27%	0.267	33%	0.327	S	S	.	.			trans	-74.9	66.4	177.4	-171.7	10.5	0	0	0	112.8	I635 N637 N641 G642 L643 F644 M670	I635-N639 HydrophobicContact CG2-CB 4.07Å; N637-N639 VanDerWaalsContact C-N 3.33Å; N637-N639 PolarHBondContact O-N 3.18Å; N639-N641 PolarHBondContact O-N 2.88Å; N639-G642 PolarHBondContact O-N 3.33Å; N639-G642 WeakPolarHBondContact OD1-CA 3.32Å; N639-L643 PolarHBondContact OD1-N 3.44Å; N639-L643 VanDerWaalsContact OD1-N 3.17Å; N639-F644 PolarHBondContact ND2-O 2.86Å; N639-F644 PolarHBondContact OD1-N 2.89Å; N639-F644 VanDerWaalsContact OD1-N 3.09Å; N639-M670 HydrophobicContact CB-SD 4.15Å
640	T	65.8	Low	80.3	Confident	90 Å²	90	61.1 Å²	61.1	55%	0.552	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-58.1	128.2	178.9	54.1	0	0	0	0	111.2	G638 G642	G638-T640 PolarHBondContact O-N 3.15Å; T640-G642 PolarHBondContact O-N 3.41Å
641	N	65.6	Low	80.1	Confident	170 Å²	170	57.1 Å²	57.1	91%	0.909	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	62.7	12.1	-179.7	-53.9	-17	0	0	0	116.4	N639 L643	N639-N641 PolarHBondContact O-N 2.88Å; N641-L643 VanDerWaalsContact C-N 3.33Å; N641-L643 PolarHBondContact O-N 2.81Å
642	G	71.5	Confident	79.8	Confident	32 Å²	32	59.5 Å²	59.5	33%	0.33	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	66.4	33.8	178.9	0	0	0	0	0	113.6	N639 T640 F644	N639-G642 PolarHBondContact O-N 3.33Å; N639-G642 WeakPolarHBondContact OD1-CA 3.32Å; T640-G642 PolarHBondContact O-N 3.41Å; G642-F644 PolarHBondContact O-N 3.11Å
643	L	75.9	Confident	79.6	Confident	30 Å²	30	56.9 Å²	56.9	16%	0.157	32%	0.315	C	S	.	.			trans	-66.9	-27.2	178.8	-179	61.7	0	0	0	112.3	N639 N641 V655 N656 A657 L663 F668	N639-L643 PolarHBondContact OD1-N 3.44Å; N639-L643 VanDerWaalsContact OD1-N 3.17Å; N641-L643 VanDerWaalsContact C-N 3.33Å; N641-L643 PolarHBondContact O-N 2.81Å; L643-V655 HydrophobicContact CD1-CG1 4.45Å; L643-N656 PolarHBondContact O-N 3.4Å; L643-A657 HydrophobicContact CD1-CB 4.19Å; L643-L663 HydrophobicContact CD1-CD1 4.34Å; L643-L663 HydrophobicContact CD2-CD2 4.15Å; L643-F668 HydrophobicContact CD2-CD1 4.21Å; L643-F668 HydrophobicContact CD2-CE1 3.63Å; L643-F668 HydrophobicContact CD2-CE2 4.05Å; L643-F668 HydrophobicContact CD2-CZ 3.53Å
644	F	82.1	Confident	79.2	Confident	7 Å²	7	57.8 Å²	57.8	3%	0.031	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	147.5	177.2	-57.8	-83.5	0	0	0	110.6	I635 N639 G642 L653 F654 V655 F668 M670 V690 F692	I635-F644 HydrophobicContact CD1-CB 4.19Å; N639-F644 PolarHBondContact ND2-O 2.86Å; N639-F644 PolarHBondContact OD1-N 2.89Å; N639-F644 VanDerWaalsContact OD1-N 3.09Å; G642-F644 PolarHBondContact O-N 3.11Å; F644-L653 HydrophobicContact CB-CD1 4.16Å; F644-L653 HydrophobicContact CD1-CD1 4.12Å; F644-F654 WeakPolarHBondContact CA-O 3.44Å; F644-V655 HydrophobicContact CD1-CG2 3.92Å; F644-V655 HydrophobicContact CE1-CG2 3.87Å; F644-F668 HydrophobicContact CE2-CB 3.68Å; F644-F668 HydrophobicContact CE2-CD1 4.04Å; F644-F668 HydrophobicContact CE2-CD2 4.23Å; F644-F668 AromaticContact CE2-CG 3.72Å; F644-F668 HydrophobicContact CE2-CG 3.72Å; F644-F668 HydrophobicContact CZ-CB 3.81Å; F644-F668 AromaticContact CZ-CD2 3.87Å; F644-F668 HydrophobicContact CZ-CD2 3.87Å; F644-F668 AromaticContact CZ-CG 3.81Å; F644-F668 HydrophobicContact CZ-CG 3.81Å; F644-M670 HydrophobicContact CB-CE 4.07Å; F644-M670 HydrophobicContact CB-SD 3.81Å; F644-M670 HydrophobicContact CD1-CE 3.88Å; F644-M670 HydrophobicContact CD2-CE 3.51Å; F644-M670 HydrophobicContact CD2-SD 3.3Å; F644-M670 WeakPolarHBondContact CD2-SD 3.5Å; F644-M670 HydrophobicContact CE1-CE 4.17Å; F644-M670 HydrophobicContact CE2-CE 3.82Å; F644-M670 HydrophobicContact CE2-SD 3.97Å; F644-M670 HydrophobicContact CG-CE 3.52Å; F644-M670 HydrophobicContact CG-SD 3.64Å; F644-M670 HydrophobicContact CZ-CE 4.13Å; F644-V690 HydrophobicContact CE1-CB 4.14Å; F644-V690 HydrophobicContact CE1-CG1 3.82Å; F644-V690 HydrophobicContact CE1-CG2 4.21Å; F644-V690 HydrophobicContact CZ-CB 4.14Å; F644-V690 HydrophobicContact CZ-CG1 4.16Å; F644-V690 HydrophobicContact CZ-CG2 4.45Å; F644-F692 HydrophobicContact CE1-CE2 4.11Å; F644-F692 AromaticContact CE1-CZ 3.9Å; F644-F692 HydrophobicContact CE1-CZ 3.9Å; F644-F692 AromaticContact CZ-CE2 3.87Å; F644-F692 HydrophobicContact CZ-CE2 3.87Å; F644-F692 HydrophobicContact CZ-CZ 4.1Å
645	W	80.9	Confident	78.8	Confident	123 Å²	123	54.7 Å²	54.7	47%	0.466	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.3	165	177.2	62.7	0	0	0	108.4	D647 F654	W645-D647 HydrophobicContact CH2-CB 3.83Å; W645-D647 HydrophobicContact CZ2-CB 4.3Å; W645-D647 HydrophobicContact CZ3-CB 4.27Å; W645-F654 HydrophobicContact CB-CB 4.43Å; W645-F654 HydrophobicContact CD2-CD2 4.47Å; W645-F654 HydrophobicContact CE3-CB 4.01Å; W645-F654 AromaticContact CE3-CD2 3.38Å; W645-F654 HydrophobicContact CE3-CD2 3.38Å; W645-F654 AromaticContact CE3-CE2 3.97Å; W645-F654 HydrophobicContact CE3-CE2 3.97Å; W645-F654 AromaticContact CE3-CG 3.76Å; W645-F654 HydrophobicContact CE3-CG 3.76Å; W645-F654 HydrophobicContact CH2-CE2 4.45Å; W645-F654 AromaticContact CZ3-CD2 3.47Å; W645-F654 HydrophobicContact CZ3-CD2 3.47Å; W645-F654 VanDerWaalsContact CZ3-CD2 3.47Å; W645-F654 AromaticContact CZ3-CE2 3.53Å; W645-F654 HydrophobicContact CZ3-CE2 3.53Å; W645-F654 HydrophobicContact CZ3-CG 4.09Å; W645-F654 HydrophobicContact CZ3-CZ 4.19Å; W645-F654 PolarHBondContact N-O 3.21Å; W645-F654 PolarHBondContact O-N 3.1Å
646	M	83.4	Confident	78.4	Confident	9 Å²	9	55.8 Å²	55.8	4%	0.044	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.1	176	-175.9	157.7	-80.3	0	0	108.2	I618 I635 E648 Q652 L653 L672 L688	I618-M646 HydrophobicContact CD1-CE 3.74Å; I618-M646 HydrophobicContact CG1-CE 4.33Å; I635-M646 HydrophobicContact CD1-CB 3.88Å; I635-M646 HydrophobicContact CD1-CE 4.36Å; I635-M646 HydrophobicContact CG1-CB 4.03Å; I635-M646 HydrophobicContact CG1-CE 4.36Å; I635-M646 HydrophobicContact CG1-SD 4.09Å; M646-E648 PolarHBondContact O-N 3.2Å; M646-Q652 WeakPolarHBondContact CA-O 3.33Å; M646-L653 HydrophobicContact CE-CB 3.99Å; M646-L653 HydrophobicContact CE-CD1 3.92Å; M646-L672 HydrophobicContact CE-CD1 4.22Å; M646-L672 HydrophobicContact SD-CD1 3.59Å; M646-L672 VanDerWaalsContact SD-CD1 3.59Å; M646-L688 HydrophobicContact CE-CD2 4.19Å
647	D	83.2	Confident	78	Confident	41 Å²	41	54 Å²	54	22%	0.219	30%	0.297	C	S	.	.			trans	-71.8	119.8	171.5	-176.2	-87.8	0	0	0	108.8	W645 D649 T650 G651 Q652 F654	W645-D647 HydrophobicContact CH2-CB 3.83Å; W645-D647 HydrophobicContact CZ2-CB 4.3Å; W645-D647 HydrophobicContact CZ3-CB 4.27Å; D647-D649 VanDerWaalsContact C-N 3.27Å; D647-D649 PolarHBondContact O-N 2.86Å; D647-D649 PolarHBondContact OD1-N 2.86Å; D647-T650 WeakPolarHBondContact CB-OG1 3.12Å; D647-T650 VanDerWaalsContact OD1-CB 3.3Å; D647-T650 WeakPolarHBondContact OD1-CB 3.4Å; D647-T650 WeakPolarHBondContact OD1-CG2 3.48Å; D647-T650 PolarHBondContact OD1-N 3.12Å; D647-T650 PolarHBondContact OD1-OG1 2.91Å; D647-G651 PolarHBondContact O-N 3.11Å; D647-G651 VanDerWaalsContact O-N 3.08Å; D647-Q652 HydrophobicContact CB-CB 4.24Å; D647-Q652 PolarHBondContact N-O 2.64Å; D647-F654 HydrophobicContact CB-CE2 4.15Å
648	E	83.3	Confident	77.3	Confident	91 Å²	91	56.4 Å²	56.4	43%	0.425	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-24.9	-166.3	-60.3	-168.2	139.4	0	0	113.2	K632 Y633 M646	K632-E648 CarbonylContact C-O 3.6Å; K632-E648 WeakPolarHBondContact CA-O 3.32Å; K632-E648 WeakPolarHBondContact CE-OE2 3.02Å; K632-E648 HydrophobicContact CG-CB 4.33Å; K632-E648 VanDerWaalsContact NZ-CD 3.33Å; K632-E648 IonicContact NZ-OE1 2.64Å; K632-E648 IonicContact NZ-OE2 2.67Å; K632-E648 PolarHBondContact NZ-OE2 3.43Å; Y633-E648 PolarHBondContact N-O 3.01Å; Y633-E648 WeakPolarHBondContact O-CA 3.4Å; M646-E648 PolarHBondContact O-N 3.2Å
649	D	83.6	Confident	76.9	Confident	110 Å²	110	57.7 Å²	57.7	59%	0.588	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-34	-176	-57.9	-38.5	0	0	0	112.1	D647	D647-D649 VanDerWaalsContact C-N 3.27Å; D647-D649 PolarHBondContact O-N 2.86Å; D647-D649 PolarHBondContact OD1-N 2.86Å
650	T	82.3	Confident	76.2	Confident	68 Å²	68	55.4 Å²	55.4	42%	0.417	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-7.5	-175.1	67.2	0	0	0	0	115.1	D647 Q652	D647-T650 WeakPolarHBondContact CB-OG1 3.12Å; D647-T650 VanDerWaalsContact OD1-CB 3.3Å; D647-T650 WeakPolarHBondContact OD1-CB 3.4Å; D647-T650 WeakPolarHBondContact OD1-CG2 3.48Å; D647-T650 PolarHBondContact OD1-N 3.12Å; D647-T650 PolarHBondContact OD1-OG1 2.91Å; T650-Q652 PolarHBondContact O-N 2.98Å; T650-Q652 WeakPolarHBondContact OG1-CG 3.2Å
651	G	82.8	Confident	76.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.			trans	66.5	14.5	-178.6	0	0	0	0	0	114.2	I618 Y633 D647 L653	I618-G651 PolarHBondContact N-O 3.37Å; Y633-G651 VanDerWaalsContact CG-CA 3.5Å; D647-G651 PolarHBondContact O-N 3.11Å; D647-G651 VanDerWaalsContact O-N 3.08Å; G651-L653 PolarHBondContact O-N 2.65Å
652	Q	83.4	Confident	76.1	Confident	73 Å²	73	52.1 Å²	52.1	34%	0.341	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	122.2	177.5	-71.5	-176.9	39.2	0	0	110.8	T617 M646 D647 T650 F654	T617-Q652 HydrophobicContact CG2-CG 3.98Å; M646-Q652 WeakPolarHBondContact CA-O 3.33Å; D647-Q652 HydrophobicContact CB-CB 4.24Å; D647-Q652 PolarHBondContact N-O 2.64Å; T650-Q652 PolarHBondContact O-N 2.98Å; T650-Q652 WeakPolarHBondContact OG1-CG 3.2Å; Q652-F654 HydrophobicContact CB-CD2 4.32Å; Q652-F654 HydrophobicContact CB-CE2 3.53Å; Q652-F654 HydrophobicContact CB-CZ 4.1Å; Q652-F654 WeakPolarHBondContact O-CD2 3.38Å
653	L	83.5	Confident	76.1	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	125.5	174.3	179.8	71.6	0	0	0	109.9	A615 S616 I635 F644 M646 G651 L688 V690	A615-L653 WeakPolarHBondContact CB-O 3.2Å; A615-L653 PolarHBondContact N-O 2.7Å; S616-L653 PolarHBondContact N-O 3.34Å; S616-L653 PolarHBondContact O-N 2.81Å; I635-L653 HydrophobicContact CD1-CD1 4.02Å; F644-L653 HydrophobicContact CB-CD1 4.16Å; F644-L653 HydrophobicContact CD1-CD1 4.12Å; M646-L653 HydrophobicContact CE-CB 3.99Å; M646-L653 HydrophobicContact CE-CD1 3.92Å; G651-L653 PolarHBondContact O-N 2.65Å; L653-L688 HydrophobicContact CD1-CD2 4.28Å; L653-L688 HydrophobicContact CD2-CD2 4.4Å; L653-V690 HydrophobicContact CD2-CG2 3.99Å
654	F	80.2	Confident	75.7	Confident	35 Å²	35	52.6 Å²	52.6	15%	0.154	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	149.2	175.1	-64.4	-98.5	0	0	0	111.2	F613 P614 F644 W645 D647 Q652	F613-F654 CarbonylContact O-C 3.6Å; F613-F654 VanDerWaalsContact O-CA 3.25Å; F613-F654 WeakPolarHBondContact O-CA 3.34Å; P614-F654 HydrophobicContact CB-CD1 4.04Å; P614-F654 HydrophobicContact CB-CE1 3.77Å; P614-F654 HydrophobicContact CB-CZ 4.48Å; P614-F654 HydrophobicContact CG-CE1 4.45Å; F644-F654 WeakPolarHBondContact CA-O 3.44Å; W645-F654 HydrophobicContact CB-CB 4.43Å; W645-F654 HydrophobicContact CD2-CD2 4.47Å; W645-F654 HydrophobicContact CE3-CB 4.01Å; W645-F654 AromaticContact CE3-CD2 3.38Å; W645-F654 HydrophobicContact CE3-CD2 3.38Å; W645-F654 AromaticContact CE3-CE2 3.97Å; W645-F654 HydrophobicContact CE3-CE2 3.97Å; W645-F654 AromaticContact CE3-CG 3.76Å; W645-F654 HydrophobicContact CE3-CG 3.76Å; W645-F654 HydrophobicContact CH2-CE2 4.45Å; W645-F654 AromaticContact CZ3-CD2 3.47Å; W645-F654 HydrophobicContact CZ3-CD2 3.47Å; W645-F654 VanDerWaalsContact CZ3-CD2 3.47Å; W645-F654 AromaticContact CZ3-CE2 3.53Å; W645-F654 HydrophobicContact CZ3-CE2 3.53Å; W645-F654 HydrophobicContact CZ3-CG 4.09Å; W645-F654 HydrophobicContact CZ3-CZ 4.19Å; W645-F654 PolarHBondContact N-O 3.21Å; W645-F654 PolarHBondContact O-N 3.1Å; D647-F654 HydrophobicContact CB-CE2 4.15Å; Q652-F654 HydrophobicContact CB-CD2 4.32Å; Q652-F654 HydrophobicContact CB-CE2 3.53Å; Q652-F654 HydrophobicContact CB-CZ 4.1Å; Q652-F654 WeakPolarHBondContact O-CD2 3.38Å
655	V	79.1	Confident	75	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	116.3	175.6	179.6	0	0	0	0	109.7	I576 I585 G612 F613 A615 L643 F644 A657 L663 F692	I576-V655 HydrophobicContact CD1-CG2 3.73Å; I585-V655 HydrophobicContact CD1-CB 3.72Å; I585-V655 HydrophobicContact CD1-CG1 3.97Å; I585-V655 HydrophobicContact CD1-CG2 4.03Å; G612-V655 WeakPolarHBondContact CA-O 3.4Å; F613-V655 PolarHBondContact N-O 2.91Å; F613-V655 PolarHBondContact O-N 2.9Å; A615-V655 HydrophobicContact CB-CG2 3.93Å; L643-V655 HydrophobicContact CD1-CG1 4.45Å; F644-V655 HydrophobicContact CD1-CG2 3.92Å; F644-V655 HydrophobicContact CE1-CG2 3.87Å; V655-A657 HydrophobicContact CG1-CB 3.9Å; V655-A657 PolarHBondContact O-N 2.99Å; V655-L663 HydrophobicContact CG1-CD1 4.27Å; V655-F692 HydrophobicContact CG1-CE1 4.07Å; V655-F692 HydrophobicContact CG1-CZ 3.81Å; V655-F692 HydrophobicContact CG2-CE1 4.03Å; V655-F692 HydrophobicContact CG2-CZ 3.85Å
656	N	73.8	Confident	74.8	Confident	53 Å²	53	55.7 Å²	55.7	28%	0.283	30%	0.304	S	S	.	.			trans	-88.2	72.5	-179.6	-174.2	29.1	0	0	0	110.4	L643	L643-N656 PolarHBondContact O-N 3.4Å
657	A	69.3	Low	74.6	Confident	12 Å²	12	58.8 Å²	58.8	10%	0.099	32%	0.323	C	S	.	.			trans	-133.1	128.3	-177.6	0	0	0	0	0	111.8	L643 V655 N659 L663	L643-A657 HydrophobicContact CD1-CB 4.19Å; V655-A657 HydrophobicContact CG1-CB 3.9Å; V655-A657 PolarHBondContact O-N 2.99Å; A657-N659 VanDerWaalsContact C-N 3.32Å; A657-N659 PolarHBondContact O-N 3.41Å; A657-L663 HydrophobicContact CB-CD1 4Å
658	T	61.8	Low	74.6	Confident	146 Å²	146	58.6 Å²	58.6	90%	0.896	32%	0.321	S	S	*	.	S	Bend	trans	-77.4	-15.2	-179.9	51	0	0	0	0	114.1
659	N	64.5	Low	74.5	Confident	71 Å²	71	59.9 Å²	59.9	38%	0.38	33%	0.325	S	S	.	.			trans	-154.7	117.5	168.8	176	14.4	0	0	0	109.4	G583 A657 T661	G583-N659 WeakPolarHBondContact CA-OD1 3.37Å; A657-N659 VanDerWaalsContact C-N 3.32Å; A657-N659 PolarHBondContact O-N 3.41Å; N659-T661 VanDerWaalsContact C-N 3.33Å; N659-T661 PolarHBondContact ND2-OG1 3.3Å; N659-T661 PolarHBondContact O-N 2.75Å; N659-T661 WeakPolarHBondContact OD1-CG2 3.44Å; N659-T661 PolarHBondContact OD1-N 2.97Å; N659-T661 VanDerWaalsContact OD1-N 3.16Å; N659-T661 PolarHBondContact OD1-OG1 3.44Å
660	A	63.6	Low	74.7	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.008	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-78.9	-8.9	-175.4	0	0	0	0	0	114.6	V578 G583 I585 E662 L663	V578-A660 HydrophobicContact CG1-CB 3.63Å; V578-A660 HydrophobicContact CG2-CB 4.06Å; G583-A660 WeakPolarHBondContact O-CB 3.29Å; G583-A660 PolarHBondContact O-N 2.92Å; I585-A660 HydrophobicContact CD1-CB 4.39Å; I585-A660 HydrophobicContact CG1-CB 3.96Å; A660-E662 VanDerWaalsContact C-N 3.28Å; A660-E662 PolarHBondContact O-N 3.06Å; A660-L663 PolarHBondContact O-N 3.46Å
661	T	64.4	Low	74.9	Confident	53 Å²	53	55.8 Å²	55.8	33%	0.325	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-62.5	-31.1	-174.9	59.1	0	0	0	0	114	N659 L663	N659-T661 VanDerWaalsContact C-N 3.33Å; N659-T661 PolarHBondContact ND2-OG1 3.3Å; N659-T661 PolarHBondContact O-N 2.75Å; N659-T661 WeakPolarHBondContact OD1-CG2 3.44Å; N659-T661 PolarHBondContact OD1-N 2.97Å; N659-T661 VanDerWaalsContact OD1-N 3.16Å; N659-T661 PolarHBondContact OD1-OG1 3.44Å; T661-L663 PolarHBondContact O-N 2.77Å
662	E	66.3	Low	75.1	Confident	139 Å²	139	55.8 Å²	55.8	65%	0.65	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-75	-13.5	-178.7	-64.3	-169.1	-170	0	0	113.9	A660 R666	A660-E662 VanDerWaalsContact C-N 3.28Å; A660-E662 PolarHBondContact O-N 3.06Å; E662-R666 VanDerWaalsContact O-CZ 3.28Å; E662-R666 PolarHBondContact O-NE 2.7Å; E662-R666 PolarHBondContact O-NH2 2.86Å
663	L	70.2	Confident	75.3	Confident	17 Å²	17	52.9 Å²	52.9	9%	0.089	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-89.2	-19.4	-179	-56.4	177.8	0	0	0	112.3	L643 V655 A657 A660 T661 G665 R666 F668 F692	L643-L663 HydrophobicContact CD1-CD1 4.34Å; L643-L663 HydrophobicContact CD2-CD2 4.15Å; V655-L663 HydrophobicContact CG1-CD1 4.27Å; A657-L663 HydrophobicContact CB-CD1 4Å; A660-L663 PolarHBondContact O-N 3.46Å; T661-L663 PolarHBondContact O-N 2.77Å; L663-G665 PolarHBondContact O-N 3.04Å; L663-R666 VanDerWaalsContact O-CB 3.23Å; L663-R666 WeakPolarHBondContact O-CB 3.3Å; L663-R666 WeakPolarHBondContact O-CG 3.24Å; L663-R666 PolarHBondContact O-N 3.32Å; L663-F668 HydrophobicContact CD2-CE2 4.22Å; L663-F668 HydrophobicContact CD2-CZ 4.02Å; L663-F692 HydrophobicContact CB-CB 4.14Å; L663-F692 HydrophobicContact CB-CD1 4.12Å; L663-F692 HydrophobicContact CB-CD2 3.75Å; L663-F692 HydrophobicContact CB-CE1 4.47Å; L663-F692 HydrophobicContact CB-CE2 4.11Å; L663-F692 HydrophobicContact CB-CG 3.74Å; L663-F692 HydrophobicContact CB-CZ 4.46Å; L663-F692 HydrophobicContact CD1-CD1 4.4Å; L663-F692 HydrophobicContact CD1-CD2 4.43Å; L663-F692 HydrophobicContact CD1-CE1 3.94Å; L663-F692 HydrophobicContact CD1-CE2 3.96Å; L663-F692 HydrophobicContact CD1-CZ 3.7Å; L663-F692 WeakPolarHBondContact O-CB 3.43Å
664	I	68.4	Low	75.6	Confident	54 Å²	54	52.8 Å²	52.8	28%	0.277	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	128.6	-177.2	-58.1	177.2	0	0	0	110.8	V578 A580 R666 N694	V578-I664 HydrophobicContact CB-CD1 3.99Å; V578-I664 HydrophobicContact CB-CG1 3.85Å; V578-I664 HydrophobicContact CG1-CD1 3.83Å; V578-I664 HydrophobicContact CG1-CG1 3.97Å; V578-I664 HydrophobicContact CG2-CG1 4.17Å; A580-I664 HydrophobicContact CB-CD1 4.1Å; I664-R666 VanDerWaalsContact C-N 3.3Å; I664-N694 HydrophobicContact CG2-CB 4.29Å
665	G	66.8	Low	76	Confident	67 Å²	67	52 Å²	52	69%	0.691	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	0.7	-176.6	0	0	0	0	0	114.6	L663 F692	L663-G665 PolarHBondContact O-N 3.04Å; G665-F692 PolarHBondContact N-O 2.75Å
666	R	77.6	Confident	76.5	Confident	129 Å²	129	52.2 Å²	52.2	49%	0.487	29%	0.285	S	S	.	.			trans	-93.3	148.1	171.8	-53.7	-171.4	-161.4	-153.3	8.2	111.4	E662 L663 I664 F668 F692	E662-R666 VanDerWaalsContact O-CZ 3.28Å; E662-R666 PolarHBondContact O-NE 2.7Å; E662-R666 PolarHBondContact O-NH2 2.86Å; L663-R666 VanDerWaalsContact O-CB 3.23Å; L663-R666 WeakPolarHBondContact O-CB 3.3Å; L663-R666 WeakPolarHBondContact O-CG 3.24Å; L663-R666 PolarHBondContact O-N 3.32Å; I664-R666 VanDerWaalsContact C-N 3.3Å; R666-F668 HydrophobicContact CB-CE2 3.8Å; R666-F668 HydrophobicContact CB-CZ 4.3Å; R666-F692 PolarHBondContact O-N 3.22Å; R666-F692 VanDerWaalsContact O-N 3.15Å
667	T	79.5	Confident	77.1	Confident	74 Å²	74	53.8 Å²	53.8	45%	0.454	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.8	174.2	-55.2	0	0	0	0	109.1	E689 V690 T691	T667-E689 HydrophobicContact CG2-CG 3.47Å; T667-E689 VanDerWaalsContact CG2-CG 3.47Å; T667-E689 VanDerWaalsContact CG2-OE1 3.26Å; T667-E689 WeakPolarHBondContact CG2-OE1 3.11Å; T667-V690 CarbonylContact C-O 3.51Å; T667-V690 WeakPolarHBondContact CA-O 3.4Å; T667-T691 HydrophobicContact CG2-CG2 3.8Å
668	F	82.6	Confident	77.8	Confident	37 Å²	37	53.5 Å²	53.5	16%	0.162	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.1	175.1	-63.3	-93.5	0	0	0	108.6	L643 F644 L663 R666 E689 V690 F692	L643-F668 HydrophobicContact CD2-CD1 4.21Å; L643-F668 HydrophobicContact CD2-CE1 3.63Å; L643-F668 HydrophobicContact CD2-CE2 4.05Å; L643-F668 HydrophobicContact CD2-CZ 3.53Å; F644-F668 HydrophobicContact CE2-CB 3.68Å; F644-F668 HydrophobicContact CE2-CD1 4.04Å; F644-F668 HydrophobicContact CE2-CD2 4.23Å; F644-F668 AromaticContact CE2-CG 3.72Å; F644-F668 HydrophobicContact CE2-CG 3.72Å; F644-F668 HydrophobicContact CZ-CB 3.81Å; F644-F668 AromaticContact CZ-CD2 3.87Å; F644-F668 HydrophobicContact CZ-CD2 3.87Å; F644-F668 AromaticContact CZ-CG 3.81Å; F644-F668 HydrophobicContact CZ-CG 3.81Å; L663-F668 HydrophobicContact CD2-CE2 4.22Å; L663-F668 HydrophobicContact CD2-CZ 4.02Å; R666-F668 HydrophobicContact CB-CE2 3.8Å; R666-F668 HydrophobicContact CB-CZ 4.3Å; F668-E689 CarbonylContact O-C 3.59Å; F668-E689 WeakPolarHBondContact O-CA 3.46Å; F668-V690 PolarHBondContact N-O 2.89Å; F668-V690 PolarHBondContact O-N 3.32Å; F668-F692 AromaticContact CD2-CD2 3.98Å; F668-F692 HydrophobicContact CD2-CD2 3.98Å; F668-F692 AromaticContact CD2-CE2 3.69Å; F668-F692 HydrophobicContact CD2-CE2 3.69Å; F668-F692 AromaticContact CE2-CD2 3.84Å; F668-F692 HydrophobicContact CE2-CD2 3.84Å; F668-F692 AromaticContact CE2-CE2 3.66Å; F668-F692 HydrophobicContact CE2-CE2 3.66Å
669	K	81.7	Confident	78.7	Confident	117 Å²	117	51.9 Å²	51.9	51%	0.509	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.8	174.6	-69.5	177.9	-176.6	-83.6	0	108.4	T687 L688 E689	K669-T687 HydrophobicContact CB-CG2 4.12Å; K669-T687 HydrophobicContact CD-CG2 4.5Å; K669-T687 HydrophobicContact CG-CG2 4.28Å; K669-L688 WeakPolarHBondContact CA-O 3.38Å; K669-E689 WeakPolarHBondContact CE-OE1 3.43Å; K669-E689 HydrophobicContact CG-CB 4.42Å; K669-E689 HydrophobicContact CG-CG 4.26Å; K669-E689 IonicContact NZ-OE1 2.67Å; K669-E689 PolarHBondContact NZ-OE1 2.83Å; K669-E689 IonicContact NZ-OE2 2.64Å; K669-E689 PolarHBondContact NZ-OE2 3.5Å
670	M	87.4	Confident	79.7	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	156.6	178	-65.2	178.2	-75.8	0	0	109.3	I635 N637 N639 F644 T687 L688 V690	I635-M670 HydrophobicContact CD1-SD 4.09Å; I635-M670 HydrophobicContact CG2-CB 3.98Å; I635-M670 HydrophobicContact CG2-CG 4.32Å; I635-M670 HydrophobicContact CG2-SD 3.96Å; N637-M670 WeakPolarHBondContact O-CA 3.24Å; N639-M670 HydrophobicContact CB-SD 4.15Å; F644-M670 HydrophobicContact CB-CE 4.07Å; F644-M670 HydrophobicContact CB-SD 3.81Å; F644-M670 HydrophobicContact CD1-CE 3.88Å; F644-M670 HydrophobicContact CD2-CE 3.51Å; F644-M670 HydrophobicContact CD2-SD 3.3Å; F644-M670 WeakPolarHBondContact CD2-SD 3.5Å; F644-M670 HydrophobicContact CE1-CE 4.17Å; F644-M670 HydrophobicContact CE2-CE 3.82Å; F644-M670 HydrophobicContact CE2-SD 3.97Å; F644-M670 HydrophobicContact CG-CE 3.52Å; F644-M670 HydrophobicContact CG-SD 3.64Å; F644-M670 HydrophobicContact CZ-CE 4.13Å; M670-T687 CarbonylContact O-C 3.59Å; M670-T687 WeakPolarHBondContact O-CA 3.45Å; M670-L688 HydrophobicContact CB-CB 4.4Å; M670-L688 HydrophobicContact CE-CD2 3.89Å; M670-L688 HydrophobicContact CE-CG 4.13Å; M670-L688 PolarHBondContact N-O 3.01Å; M670-L688 PolarHBondContact O-N 3.08Å; M670-V690 HydrophobicContact CE-CG2 3.52Å
671	E	85.6	Confident	80.8	Confident	90 Å²	90	55.7 Å²	55.7	42%	0.421	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.8	167	-69.5	169.5	-165.2	0	0	107.8	I635 S636 N637	I635-E671 CarbonylContact C-O 3.41Å; I635-E671 WeakPolarHBondContact CA-O 3.09Å; S636-E671 PolarHBondContact N-O 2.73Å; S636-E671 WeakPolarHBondContact OG-CB 3.41Å; S636-E671 PolarHBondContact OG-O 2.69Å; N637-E671 HydrophobicContact CB-CB 4.1Å; N637-E671 HydrophobicContact CB-CG 4.22Å; N637-E671 WeakPolarHBondContact CB-OE2 3.1Å; N637-E671 PolarHBondContact ND2-OE2 2.75Å; N637-E671 PolarHBondContact O-N 2.96Å
672	L	87.7	Confident	81.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.1	168.3	170.7	69.6	0	0	0	107.5	I562 I618 M646 V674 E685 A686 L688	I562-L672 HydrophobicContact CD1-CD2 3.83Å; I618-L672 HydrophobicContact CD1-CD2 3.76Å; I618-L672 HydrophobicContact CG2-CD2 3.97Å; M646-L672 HydrophobicContact CE-CD1 4.22Å; M646-L672 HydrophobicContact SD-CD1 3.59Å; M646-L672 VanDerWaalsContact SD-CD1 3.59Å; L672-V674 HydrophobicContact CD1-CG2 4.44Å; L672-V674 HydrophobicContact CD2-CG2 4.3Å; L672-V674 HydrophobicContact CG-CG2 4.28Å; L672-E685 CarbonylContact O-C 3.57Å; L672-E685 WeakPolarHBondContact O-CA 3.36Å; L672-A686 PolarHBondContact N-O 2.8Å; L672-A686 PolarHBondContact O-N 2.84Å; L672-L688 HydrophobicContact CB-CB 4.08Å
673	S	87.5	Confident	82.9	Confident	11 Å²	11	57 Å²	57	8%	0.077	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.5	164.5	-170.5	0	0	0	0	108.1	I634 T684	I634-S673 PolarHBondContact N-O 2.87Å; I634-S673 PolarHBondContact O-N 2.7Å; I634-S673 VanDerWaalsContact O-O 3.13Å; S673-T684 WeakPolarHBondContact CA-O 3.05Å
674	V	89.9	Confident	83.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121.8	162.9	-171.2	0	0	0	0	106.3	P560 I562 A620 L631 K632 Y633 L672 K683 T684	P560-V674 HydrophobicContact CB-CB 4.05Å; P560-V674 HydrophobicContact CB-CG1 3.69Å; P560-V674 HydrophobicContact CG-CG1 4.33Å; I562-V674 HydrophobicContact CD1-CG2 4.15Å; I562-V674 HydrophobicContact CG1-CG2 3.99Å; A620-V674 HydrophobicContact CB-CB 4.47Å; A620-V674 HydrophobicContact CB-CG1 3.91Å; A620-V674 HydrophobicContact CB-CG2 4.31Å; L631-V674 HydrophobicContact CB-CG1 4.28Å; L631-V674 HydrophobicContact CD1-CG1 4.36Å; L631-V674 HydrophobicContact CD2-CG1 4.25Å; K632-V674 WeakPolarHBondContact O-CA 3.48Å; Y633-V674 HydrophobicContact CD1-CB 4.47Å; Y633-V674 HydrophobicContact CD1-CG1 4.09Å; Y633-V674 HydrophobicContact CD1-CG2 3.65Å; Y633-V674 HydrophobicContact CE1-CG1 3.95Å; Y633-V674 HydrophobicContact CE1-CG2 3.85Å; L672-V674 HydrophobicContact CD1-CG2 4.44Å; L672-V674 HydrophobicContact CD2-CG2 4.3Å; L672-V674 HydrophobicContact CG-CG2 4.28Å; V674-K683 CarbonylContact O-C 3.57Å; V674-K683 WeakPolarHBondContact O-CA 3.27Å; V674-K683 WeakPolarHBondContact O-CB 3.26Å; V674-T684 PolarHBondContact N-O 3Å; V674-T684 PolarHBondContact O-N 2.96Å
675	A	88.5	Confident	84.7	Confident	17 Å²	17	60.9 Å²	60.9	14%	0.14	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	154	173.6	0	0	0	0	0	109.5	L631 K632 Y682 K683	L631-A675 CarbonylContact C-O 3.54Å; L631-A675 WeakPolarHBondContact CA-O 3.23Å; K632-A675 PolarHBondContact N-O 2.79Å; K632-A675 PolarHBondContact O-N 2.83Å; A675-Y682 WeakPolarHBondContact CA-O 3.49Å; A675-K683 HydrophobicContact CB-CB 3.97Å
676	D	90.2	Very high	85.6	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.027	30%	0.303	C	S	.	.			trans	-75.8	-172.3	162.1	58.4	49.3	0	0	0	111.2	N556 P560 N628 Q630 G678 S681 Y682	N556-D676 VanDerWaalsContact ND2-CG 3.29Å; N556-D676 PolarHBondContact ND2-OD2 3.18Å; P560-D676 HydrophobicContact CG-CB 4.31Å; N628-D676 WeakPolarHBondContact O-CB 3.11Å; Q630-D676 CarbonylContact O-C 3.59Å; Q630-D676 VanDerWaalsContact O-C 3.24Å; Q630-D676 WeakPolarHBondContact O-CA 3.25Å; D676-G678 PolarHBondContact OD1-N 2.72Å; D676-S681 PolarHBondContact O-OG 3.11Å; D676-S681 WeakPolarHBondContact OD1-CA 3.32Å; D676-S681 WeakPolarHBondContact OD1-CB 3.42Å; D676-S681 PolarHBondContact OD1-OG 3.13Å; D676-Y682 PolarHBondContact N-O 2.96Å; D676-Y682 VanDerWaalsContact N-O 3.12Å; D676-Y682 PolarHBondContact OD1-N 3.16Å; D676-Y682 VanDerWaalsContact OD2-CA 3.29Å; D676-Y682 WeakPolarHBondContact OD2-CA 3.47Å; D676-Y682 WeakPolarHBondContact OD2-CB 3.36Å; D676-Y682 PolarHBondContact OD2-N 3.06Å
677	M	85.4	Confident	86	Confident	87 Å²	87	54.4 Å²	54.4	43%	0.429	29%	0.294	S	S	.	.	S	Bend	trans	-117.5	21.1	167.1	-64.2	-172.2	61.9	0	0	112.2	L627 Q630	L627-M677 CarbonylContact O-C 3.55Å; L627-M677 WeakPolarHBondContact O-CA 3.25Å; L627-M677 WeakPolarHBondContact O-CB 3.42Å; L627-M677 PolarHBondContact O-N 3.03Å; Q630-M677 HydrophobicContact CB-CB 4.35Å; Q630-M677 HydrophobicContact CB-CG 4.49Å; Q630-M677 HydrophobicContact CG-CG 4.35Å; Q630-M677 HydrophobicContact CG-SD 3.84Å; Q630-M677 WeakPolarHBondContact O-CG 3.35Å; Q630-M677 PolarHBondContact O-N 2.87Å
678	G	83.4	Confident	86.3	Confident	6 Å²	6	50.9 Å²	50.9	6%	0.062	27%	0.272	C	S	.	.	S	Bend	trans	-77.1	-170.5	179.7	0	0	0	0	0	113.8	L627 N628 D676	L627-G678 PolarHBondContact O-N 2.89Å; N628-G678 WeakPolarHBondContact OD1-CA 3.46Å; D676-G678 PolarHBondContact OD1-N 2.72Å
679	S	81.7	Confident	86.4	Confident	112 Å²	112	51.1 Å²	51.1	78%	0.783	27%	0.274	S	S	*	.	S	Bend	trans	-153.5	105.3	-178.4	-79.2	0	0	0	0	112
680	P	85.9	Confident	86.4	Confident	87 Å²	87	45.6 Å²	45.6	57%	0.565	25%	0.25	S	C	*	.	S	Bend	cis	-68.8	140.9	3.9	31.2	-36	0	0	0	111.9	N556	N556-P680 PolarHBondContact ND2-O 3.32Å
681	S	86.3	Confident	86.1	Confident	65 Å²	65	46.9 Å²	46.9	46%	0.455	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-76.8	127.4	177.7	176	0	0	0	0	111.6	D676	D676-S681 PolarHBondContact O-OG 3.11Å; D676-S681 WeakPolarHBondContact OD1-CA 3.32Å; D676-S681 WeakPolarHBondContact OD1-CB 3.42Å; D676-S681 PolarHBondContact OD1-OG 3.13Å
682	Y	87.7	Confident	85.8	Confident	98 Å²	98	42.7 Å²	42.7	38%	0.384	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-93.2	157.4	170.6	-62.7	-68.6	0	0	0	110.9	N556 N558 A675 D676	N556-Y682 HydrophobicContact CB-CE2 4.47Å; N556-Y682 WeakPolarHBondContact ND2-CD2 3.28Å; N556-Y682 WeakPolarHBondContact O-CE2 2.89Å; N558-Y682 WeakPolarHBondContact O-CD2 3.33Å; A675-Y682 WeakPolarHBondContact CA-O 3.49Å; D676-Y682 PolarHBondContact N-O 2.96Å; D676-Y682 VanDerWaalsContact N-O 3.12Å; D676-Y682 PolarHBondContact OD1-N 3.16Å; D676-Y682 VanDerWaalsContact OD2-CA 3.29Å; D676-Y682 WeakPolarHBondContact OD2-CA 3.47Å; D676-Y682 WeakPolarHBondContact OD2-CB 3.36Å; D676-Y682 PolarHBondContact OD2-N 3.06Å
683	K	87.4	Confident	85.2	Confident	120 Å²	120	45.2 Å²	45.2	52%	0.522	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	140.7	179.7	56	164.5	-176.9	164.3	0	112.3	V674 A675 E685	V674-K683 CarbonylContact O-C 3.57Å; V674-K683 WeakPolarHBondContact O-CA 3.27Å; V674-K683 WeakPolarHBondContact O-CB 3.26Å; A675-K683 HydrophobicContact CB-CB 3.97Å; K683-E685 HydrophobicContact CD-CG 4.44Å; K683-E685 WeakPolarHBondContact CE-OE1 3.22Å; K683-E685 IonicContact NZ-OE1 3.38Å; K683-E685 PolarHBondContact NZ-OE1 2.87Å
684	T	87.9	Confident	84.4	Confident	42 Å²	42	46.6 Å²	46.6	26%	0.258	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124	170.5	-74.3	0	0	0	0	109.4	P560 I562 S673 V674	P560-T684 WeakPolarHBondContact O-CB 3.45Å; P560-T684 PolarHBondContact O-OG1 3.38Å; I562-T684 HydrophobicContact CD1-CG2 4.2Å; I562-T684 HydrophobicContact CG1-CG2 4.4Å; S673-T684 WeakPolarHBondContact CA-O 3.05Å; V674-T684 PolarHBondContact N-O 3Å; V674-T684 PolarHBondContact O-N 2.96Å
685	E	87.4	Confident	83.1	Confident	112 Å²	112	48.3 Å²	48.3	52%	0.523	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	134.8	177.1	-67.4	-179.9	161.9	0	0	110.6	L672 K683	L672-E685 CarbonylContact O-C 3.57Å; L672-E685 WeakPolarHBondContact O-CA 3.36Å; K683-E685 HydrophobicContact CD-CG 4.44Å; K683-E685 WeakPolarHBondContact CE-OE1 3.22Å; K683-E685 IonicContact NZ-OE1 3.38Å; K683-E685 PolarHBondContact NZ-OE1 2.87Å
686	A	86.1	Confident	81.8	Confident	11 Å²	11	52.6 Å²	52.6	9%	0.091	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148.6	179.6	0	0	0	0	0	111.3	I562 G570 V572 L672 L688	I562-A686 HydrophobicContact CD1-CB 3.8Å; G570-A686 CarbonylContact O-C 3.6Å; G570-A686 WeakPolarHBondContact O-CA 3.28Å; V572-A686 HydrophobicContact CG2-CB 3.93Å; L672-A686 PolarHBondContact N-O 2.8Å; L672-A686 PolarHBondContact O-N 2.84Å; A686-L688 PolarHBondContact O-N 2.71Å
687	T	85.6	Confident	80.2	Confident	49 Å²	49	55.6 Å²	55.6	30%	0.301	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	106.6	170.3	-57	0	0	0	0	109.4	G570 V571 V572 K669 M670 E689	G570-T687 PolarHBondContact O-N 3.15Å; V571-T687 CarbonylContact C-O 3.5Å; V571-T687 VanDerWaalsContact CA-O 3.32Å; V571-T687 WeakPolarHBondContact CA-O 3.19Å; V571-T687 WeakPolarHBondContact CG1-O 3.29Å; V572-T687 PolarHBondContact N-O 3.12Å; K669-T687 HydrophobicContact CB-CG2 4.12Å; K669-T687 HydrophobicContact CD-CG2 4.5Å; K669-T687 HydrophobicContact CG-CG2 4.28Å; M670-T687 CarbonylContact O-C 3.59Å; M670-T687 WeakPolarHBondContact O-CA 3.45Å; T687-E689 PolarHBondContact O-N 2.68Å
688	L	85.4	Confident	78.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	106.8	171.4	176.3	55.5	0	0	0	109.1	V572 V574 I618 M646 L653 K669 M670 L672 A686 V690	V572-L688 HydrophobicContact CB-CD1 4.41Å; V572-L688 HydrophobicContact CG1-CD1 4.12Å; V572-L688 WeakPolarHBondContact O-CA 2.92Å; V574-L688 HydrophobicContact CB-CD1 4.32Å; V574-L688 HydrophobicContact CG2-CD1 3.66Å; I618-L688 HydrophobicContact CD1-CD1 3.7Å; I618-L688 HydrophobicContact CD1-CD2 3.8Å; I618-L688 HydrophobicContact CD1-CG 4.34Å; M646-L688 HydrophobicContact CE-CD2 4.19Å; L653-L688 HydrophobicContact CD1-CD2 4.28Å; L653-L688 HydrophobicContact CD2-CD2 4.4Å; K669-L688 WeakPolarHBondContact CA-O 3.38Å; M670-L688 HydrophobicContact CB-CB 4.4Å; M670-L688 HydrophobicContact CE-CD2 3.89Å; M670-L688 HydrophobicContact CE-CG 4.13Å; M670-L688 PolarHBondContact N-O 3.01Å; M670-L688 PolarHBondContact O-N 3.08Å; L672-L688 HydrophobicContact CB-CB 4.08Å; A686-L688 PolarHBondContact O-N 2.71Å; L688-V690 HydrophobicContact CD1-CG2 4.08Å; L688-V690 HydrophobicContact CD2-CG2 4.38Å; L688-V690 HydrophobicContact CG-CG2 3.84Å
689	E	85.4	Confident	77.5	Confident	42 Å²	42	58 Å²	58	20%	0.196	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	99.7	179	-179.4	161.1	-143.3	0	0	110.1	V571 V572 S573 V574 T667 F668 K669 T687 T691	V571-E689 HydrophobicContact CG1-CB 3.68Å; V571-E689 WeakPolarHBondContact CG1-OE2 3.33Å; V572-E689 PolarHBondContact O-N 2.7Å; S573-E689 CarbonylContact C-O 3.56Å; S573-E689 WeakPolarHBondContact CA-O 3.5Å; V574-E689 PolarHBondContact N-O 2.71Å; T667-E689 HydrophobicContact CG2-CG 3.47Å; T667-E689 VanDerWaalsContact CG2-CG 3.47Å; T667-E689 VanDerWaalsContact CG2-OE1 3.26Å; T667-E689 WeakPolarHBondContact CG2-OE1 3.11Å; F668-E689 CarbonylContact O-C 3.59Å; F668-E689 WeakPolarHBondContact O-CA 3.46Å; K669-E689 WeakPolarHBondContact CE-OE1 3.43Å; K669-E689 HydrophobicContact CG-CB 4.42Å; K669-E689 HydrophobicContact CG-CG 4.26Å; K669-E689 IonicContact NZ-OE1 2.67Å; K669-E689 PolarHBondContact NZ-OE1 2.83Å; K669-E689 IonicContact NZ-OE2 2.64Å; K669-E689 PolarHBondContact NZ-OE2 3.5Å; T687-E689 PolarHBondContact O-N 2.68Å; E689-T691 HydrophobicContact CG-CG2 4.42Å
690	V	82.7	Confident	75.9	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118.8	-178.2	-171.7	0	0	0	0	110.1	V574 I576 F644 L653 T667 F668 M670 L688 F692	V574-V690 WeakPolarHBondContact O-CA 3.34Å; I576-V690 HydrophobicContact CD1-CG1 3.25Å; I576-V690 HydrophobicContact CG1-CG1 3.82Å; F644-V690 HydrophobicContact CE1-CB 4.14Å; F644-V690 HydrophobicContact CE1-CG1 3.82Å; F644-V690 HydrophobicContact CE1-CG2 4.21Å; F644-V690 HydrophobicContact CZ-CB 4.14Å; F644-V690 HydrophobicContact CZ-CG1 4.16Å; F644-V690 HydrophobicContact CZ-CG2 4.45Å; L653-V690 HydrophobicContact CD2-CG2 3.99Å; T667-V690 CarbonylContact C-O 3.51Å; T667-V690 WeakPolarHBondContact CA-O 3.4Å; F668-V690 PolarHBondContact N-O 2.89Å; F668-V690 PolarHBondContact O-N 3.32Å; M670-V690 HydrophobicContact CE-CG2 3.52Å; L688-V690 HydrophobicContact CD1-CG2 4.08Å; L688-V690 HydrophobicContact CD2-CG2 4.38Å; L688-V690 HydrophobicContact CG-CG2 3.84Å; V690-F692 HydrophobicContact CG1-CE2 4.35Å
691	T	80.8	Confident	74.2	Confident	31 Å²	31	61.5 Å²	61.5	19%	0.19	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.6	178.2	62	0	0	0	0	110.3	V574 I576 T667 E689	V574-T691 PolarHBondContact O-N 2.68Å; V574-T691 PolarHBondContact O-OG1 3.4Å; I576-T691 PolarHBondContact N-O 3.2Å; T667-T691 HydrophobicContact CG2-CG2 3.8Å; E689-T691 HydrophobicContact CG-CG2 4.42Å
692	F	79.4	Confident	72.3	Confident	1 Å²	1	61 Å²	61	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	118.3	173.1	-68.8	-86.7	0	0	0	109.4	I576 V578 I585 F644 V655 L663 G665 R666 F668 V690	I576-F692 HydrophobicContact CB-CD1 3.86Å; I576-F692 HydrophobicContact CB-CE1 4.09Å; I576-F692 HydrophobicContact CD1-CD1 4.25Å; I576-F692 HydrophobicContact CD1-CE1 3.66Å; I576-F692 HydrophobicContact CD1-CZ 3.9Å; I576-F692 HydrophobicContact CG1-CE1 4.46Å; I576-F692 HydrophobicContact CG2-CD1 3.9Å; I576-F692 HydrophobicContact CG2-CE1 3.93Å; I576-F692 WeakPolarHBondContact O-CA 3.04Å; V578-F692 HydrophobicContact CG2-CB 4.29Å; V578-F692 HydrophobicContact CG2-CD1 3.81Å; I585-F692 HydrophobicContact CD1-CE1 4.09Å; F644-F692 HydrophobicContact CE1-CE2 4.11Å; F644-F692 AromaticContact CE1-CZ 3.9Å; F644-F692 HydrophobicContact CE1-CZ 3.9Å; F644-F692 AromaticContact CZ-CE2 3.87Å; F644-F692 HydrophobicContact CZ-CE2 3.87Å; F644-F692 HydrophobicContact CZ-CZ 4.1Å; V655-F692 HydrophobicContact CG1-CE1 4.07Å; V655-F692 HydrophobicContact CG1-CZ 3.81Å; V655-F692 HydrophobicContact CG2-CE1 4.03Å; V655-F692 HydrophobicContact CG2-CZ 3.85Å; L663-F692 HydrophobicContact CB-CB 4.14Å; L663-F692 HydrophobicContact CB-CD1 4.12Å; L663-F692 HydrophobicContact CB-CD2 3.75Å; L663-F692 HydrophobicContact CB-CE1 4.47Å; L663-F692 HydrophobicContact CB-CE2 4.11Å; L663-F692 HydrophobicContact CB-CG 3.74Å; L663-F692 HydrophobicContact CB-CZ 4.46Å; L663-F692 HydrophobicContact CD1-CD1 4.4Å; L663-F692 HydrophobicContact CD1-CD2 4.43Å; L663-F692 HydrophobicContact CD1-CE1 3.94Å; L663-F692 HydrophobicContact CD1-CE2 3.96Å; L663-F692 HydrophobicContact CD1-CZ 3.7Å; L663-F692 WeakPolarHBondContact O-CB 3.43Å; G665-F692 PolarHBondContact N-O 2.75Å; R666-F692 PolarHBondContact O-N 3.22Å; R666-F692 VanDerWaalsContact O-N 3.15Å; F668-F692 AromaticContact CD2-CD2 3.98Å; F668-F692 HydrophobicContact CD2-CD2 3.98Å; F668-F692 AromaticContact CD2-CE2 3.69Å; F668-F692 HydrophobicContact CD2-CE2 3.69Å; F668-F692 AromaticContact CE2-CD2 3.84Å; F668-F692 HydrophobicContact CE2-CD2 3.84Å; F668-F692 AromaticContact CE2-CE2 3.66Å; F668-F692 HydrophobicContact CE2-CE2 3.66Å; V690-F692 HydrophobicContact CG1-CE2 4.35Å
693	I	75.1	Confident	70	Confident	53 Å²	53	60.6 Å²	60.6	27%	0.272	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	152	-175.9	56.2	176.2	0	0	0	111.8	I576 P577 V578 L695 H698	I576-I693 PolarHBondContact O-N 3.18Å; P577-I693 CarbonylContact C-O 3.42Å; P577-I693 WeakPolarHBondContact CA-O 3.32Å; V578-I693 PolarHBondContact N-O 2.8Å; I693-L695 PolarHBondContact O-N 3.26Å; I693-H698 HydrophobicContact CD1-CB 4.02Å; I693-H698 WeakPolarHBondContact CD1-CD2 3.45Å; I693-H698 HydrophobicContact CG1-CB 4.45Å
694	N	70.6	Confident	67.9	Low	41 Å²	41	60.5 Å²	60.5	22%	0.219	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	125.1	177.6	-179.3	11.9	0	0	0	109.9	I664 Q696 D697 H698	I664-N694 HydrophobicContact CG2-CB 4.29Å; N694-Q696 PolarHBondContact O-N 3.13Å; N694-Q696 VanDerWaalsContact O-N 3.11Å; N694-Q696 PolarHBondContact OD1-N 2.78Å; N694-D697 PolarHBondContact ND2-OD2 2.78Å; N694-D697 PolarHBondContact O-N 3.1Å; N694-H698 PolarHBondContact O-N 3.02Å
695	L	63	Low	65.7	Low	36 Å²	36	62.7 Å²	62.7	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-49.7	-37.9	176	-177.8	70.7	0	0	0	112.2	P577 V578 N579 V586 I693 D697 H698 L699	P577-L695 HydrophobicContact CB-CB 4.42Å; P577-L695 HydrophobicContact CB-CD1 3.85Å; V578-L695 WeakPolarHBondContact O-CB 3.44Å; V578-L695 PolarHBondContact O-N 3.2Å; V578-L695 VanDerWaalsContact O-N 3.09Å; N579-L695 HydrophobicContact CB-CD2 4.44Å; V586-L695 HydrophobicContact CB-CD1 4.48Å; V586-L695 HydrophobicContact CG2-CD2 4.14Å; I693-L695 PolarHBondContact O-N 3.26Å; L695-D697 PolarHBondContact O-N 2.86Å; L695-H698 PolarHBondContact O-N 2.83Å; L695-L699 HydrophobicContact CD1-CD1 4.21Å; L695-L699 HydrophobicContact CD1-CG 4.39Å; L695-L699 HydrophobicContact CG-CD1 4.03Å; L695-L699 WeakPolarHBondContact O-CB 3.49Å; L695-L699 WeakPolarHBondContact O-CG 3.17Å; L695-L699 PolarHBondContact O-N 3.38Å; L695-L699 VanDerWaalsContact O-N 3.08Å
696	Q	59.5	Low	63.3	Low	107 Å²	107	62.6 Å²	62.6	50%	0.5	36%	0.364	S	S	.	.	H	α-helix	trans	-63.2	-26.2	-179.6	-147.7	84.4	17.1	0	0	114.1	N694	N694-Q696 PolarHBondContact O-N 3.13Å; N694-Q696 VanDerWaalsContact O-N 3.11Å; N694-Q696 PolarHBondContact OD1-N 2.78Å
697	D	56.8	Low	61.2	Low	68 Å²	68	74.5 Å²	74.5	36%	0.364	41%	0.407	S	S	.	.	H	α-helix	trans	-103.8	-28.6	-178.3	-59.6	-52.5	0	0	0	111.3	N694 L695 L699 K700 N701	N694-D697 PolarHBondContact ND2-OD2 2.78Å; N694-D697 PolarHBondContact O-N 3.1Å; L695-D697 PolarHBondContact O-N 2.86Å; D697-L699 VanDerWaalsContact C-N 3.33Å; D697-L699 PolarHBondContact O-N 2.71Å; D697-K700 PolarHBondContact O-N 3.14Å; D697-K700 IonicContact OD1-NZ 2.91Å; D697-K700 PolarHBondContact OD1-NZ 2.78Å; D697-N701 PolarHBondContact O-N 3.44Å; D697-N701 VanDerWaalsContact O-N 3.15Å
698	H	57.1	Low	59.2	Low	36 Å²	36	75.4 Å²	75.4	17%	0.167	43%	0.426	C	S	.	.	H	α-helix	trans	-56.9	-48	166.6	-163.8	-29.7	0	0	0	110.8	I693 N694 L695 K700 N701 S702	I693-H698 HydrophobicContact CD1-CB 4.02Å; I693-H698 WeakPolarHBondContact CD1-CD2 3.45Å; I693-H698 HydrophobicContact CG1-CB 4.45Å; N694-H698 PolarHBondContact O-N 3.02Å; L695-H698 PolarHBondContact O-N 2.83Å; H698-K700 PolarHBondContact O-N 2.86Å; H698-N701 PolarHBondContact O-N 3.16Å; H698-N701 VanDerWaalsContact O-N 3.16Å; H698-S702 WeakPolarHBondContact O-CB 3.32Å; H698-S702 PolarHBondContact O-N 3.14Å; H698-S702 PolarHBondContact O-OG 2.78Å
699	L	55.1	Low	57.4	Low	107 Å²	107	82.1 Å²	82.1	56%	0.56	46%	0.457	S	S	*	.	H	α-helix	trans	-68.2	-14.5	179.7	-70	171	0	0	0	114.6	L695 D697	L695-L699 HydrophobicContact CD1-CD1 4.21Å; L695-L699 HydrophobicContact CD1-CG 4.39Å; L695-L699 HydrophobicContact CG-CD1 4.03Å; L695-L699 WeakPolarHBondContact O-CB 3.49Å; L695-L699 WeakPolarHBondContact O-CG 3.17Å; L695-L699 PolarHBondContact O-N 3.38Å; L695-L699 VanDerWaalsContact O-N 3.08Å; D697-L699 VanDerWaalsContact C-N 3.33Å; D697-L699 PolarHBondContact O-N 2.71Å
700	K	49.4	Very low	55.5	Low	131 Å²	131	86.9 Å²	86.9	57%	0.57	48%	0.483	S	S	*	.	H	α-helix	trans	-87.5	-33.1	170.9	-70.9	174.3	-165.3	150.5	0	112.5	D697 H698	D697-K700 PolarHBondContact O-N 3.14Å; D697-K700 IonicContact OD1-NZ 2.91Å; D697-K700 PolarHBondContact OD1-NZ 2.78Å; H698-K700 PolarHBondContact O-N 2.86Å
701	N	48.6	Very low	54.3	Low	142 Å²	142	91.8 Å²	91.8	76%	0.759	52%	0.517	S	S	*	.	H	α-helix	trans	-91.4	-18.3	-175.8	-68.7	-18.3	0	0	0	112.9	D697 H698 S703	D697-N701 PolarHBondContact O-N 3.44Å; D697-N701 VanDerWaalsContact O-N 3.15Å; H698-N701 PolarHBondContact O-N 3.16Å; H698-N701 VanDerWaalsContact O-N 3.16Å; N701-S703 VanDerWaalsContact C-N 3.34Å; N701-S703 PolarHBondContact O-N 3.31Å
702	S	46.4	Very low	53.1	Low	55 Å²	55	97 Å²	97	39%	0.385	54%	0.538	S	S	.	.	S	Bend	trans	-84.3	6.8	179.3	61.5	0	0	0	0	115.2	H698 P704	H698-S702 WeakPolarHBondContact O-CB 3.32Å; H698-S702 PolarHBondContact O-N 3.14Å; H698-S702 PolarHBondContact O-OG 2.78Å; S702-P704 WeakPolarHBondContact O-CD 3.22Å
703	S	39.6	Very low	52.2	Low	88 Å²	88	101.1 Å²	101.1	62%	0.615	56%	0.563	S	S	*	*			trans	-87.8	104.8	176.3	65.4	0	0	0	0	112.2	N701 G705	N701-S703 VanDerWaalsContact C-N 3.34Å; N701-S703 PolarHBondContact O-N 3.31Å; S703-G705 PolarHBondContact O-N 3.05Å
704	P	43.8	Very low	51.4	Low	118 Å²	118	104.8 Å²	104.8	77%	0.766	58%	0.58	S	S	*	*			trans	-86.8	111.9	-177.4	-1.9	24	0	0	0	109.2	S702 N706	S702-P704 WeakPolarHBondContact O-CD 3.22Å; P704-N706 PolarHBondContact O-N 3.28Å
705	G	42.7	Very low	50.8	Low	88 Å²	88	107.9 Å²	107.9	91%	0.907	60%	0.595	S	S	*	*			trans	-71	84.8	177.3	0	0	0	0	0	112.5	S703	S703-G705 PolarHBondContact O-N 3.05Å
706	N	36.9	Very low	50.8	Low	110 Å²	110	110.5 Å²	110.5	59%	0.588	61%	0.607	S	S	*	*			trans	-125.8	63.1	176.9	-159.2	2.1	0	0	0	113.9	P704 G708	P704-N706 PolarHBondContact O-N 3.28Å; N706-G708 VanDerWaalsContact C-N 3.31Å
707	R	40.4	Very low	51	Low	262 Å²	262	108.3 Å²	108.3	99%	0.989	61%	0.608	S	S	*	*			trans	-89.5	14.7	170.2	-97.6	-175.9	174.5	180	-1	113.8
708	G	43.3	Very low	51.7	Low	68 Å²	68	109.8 Å²	109.8	70%	0.701	62%	0.619	S	S	*	*	S	Bend	trans	-102	-9.1	-165.3	0	0	0	0	0	117.7	N706	N706-G708 VanDerWaalsContact C-N 3.31Å
709	Q	47.8	Very low	52.2	Low	141 Å²	141	111.3 Å²	111.3	66%	0.659	63%	0.633	S	S	*	*	S	Bend	trans	-120.1	-11.2	-161.9	-121.3	170.7	-11.5	0	0	116.9	S711	Q709-S711 VanDerWaalsContact C-N 3.31Å; Q709-S711 PolarHBondContact O-N 2.87Å
710	L	45.7	Very low	53	Low	141 Å²	141	111.2 Å²	111.2	74%	0.738	63%	0.632	S	S	*	*	H	α-helix	trans	-74.9	-11.1	-174.9	-98.8	148.1	0	0	0	115.6
711	S	58.9	Low	54.1	Low	103 Å²	103	107 Å²	107	72%	0.72	63%	0.626	S	S	*	*	H	α-helix	trans	-73.8	-36.7	-179.5	-171.4	0	0	0	0	112.9	Q709 M715	Q709-S711 VanDerWaalsContact C-N 3.31Å; Q709-S711 PolarHBondContact O-N 2.87Å; S711-M715 PolarHBondContact O-N 3.16Å
712	F	55.5	Low	55.2	Low	141 Å²	141	102.6 Å²	102.6	62%	0.618	61%	0.61	S	S	*	*	H	α-helix	trans	-82.3	-35.3	-170.7	-152.9	-94.6	0	0	0	113.1	M715 M716	F712-M715 HydrophobicContact CD2-CE 4.19Å; F712-M715 HydrophobicContact CE2-CE 4.13Å; F712-M715 PolarHBondContact O-N 3.47Å; F712-M716 HydrophobicContact CD1-CG 3.97Å; F712-M716 HydrophobicContact CE1-CG 3.86Å; F712-M716 HydrophobicContact CE1-SD 4.38Å; F712-M716 WeakPolarHBondContact O-CG 3.31Å; F712-M716 PolarHBondContact O-N 2.84Å
713	T	59.5	Low	56.5	Low	88 Å²	88	104 Å²	104	54%	0.54	62%	0.616	S	S	.	*	H	α-helix	trans	-71	-42.5	-178.3	49	0	0	0	0	112.5	M716 A717	T713-M716 PolarHBondContact O-N 3.04Å; T713-A717 WeakPolarHBondContact O-CB 3.39Å; T713-A717 PolarHBondContact O-N 2.69Å
714	M	58.5	Low	58	Low	129 Å²	129	103.1 Å²	103.1	64%	0.635	61%	0.609	S	S	*	*	H	α-helix	trans	-62.6	-41.4	171.9	-86.1	-153	73.8	0	0	112.1	A717 V718	M714-A717 PolarHBondContact O-N 3.47Å; M714-V718 WeakPolarHBondContact O-CG2 3.46Å; M714-V718 PolarHBondContact O-N 2.85Å
715	M	57.8	Low	59.4	Low	107 Å²	107	102.9 Å²	102.9	53%	0.527	60%	0.601	S	S	.	*	H	α-helix	trans	-63.9	-43	178.5	-168.2	171.6	68.4	0	0	111.6	S711 F712 C719	S711-M715 PolarHBondContact O-N 3.16Å; F712-M715 HydrophobicContact CD2-CE 4.19Å; F712-M715 HydrophobicContact CE2-CE 4.13Å; F712-M715 PolarHBondContact O-N 3.47Å; M715-C719 WeakPolarHBondContact O-CB 3.04Å; M715-C719 PolarHBondContact O-N 2.03Å; M715-C719 PolarHBondContact O-SG 3.37Å
716	M	62.5	Low	60.8	Low	90 Å²	90	104.1 Å²	104.1	44%	0.443	59%	0.586	S	S	.	*	H	α-helix	trans	-64.6	-40	173.6	-76.1	-62.2	-62.8	0	0	112.9	F712 T713 C719 L720	F712-M716 HydrophobicContact CD1-CG 3.97Å; F712-M716 HydrophobicContact CE1-CG 3.86Å; F712-M716 HydrophobicContact CE1-SD 4.38Å; F712-M716 WeakPolarHBondContact O-CG 3.31Å; F712-M716 PolarHBondContact O-N 2.84Å; T713-M716 PolarHBondContact O-N 3.04Å; M716-C719 PolarHBondContact O-N 2.54Å; M716-L720 HydrophobicContact CE-CD1 4.49Å; M716-L720 WeakPolarHBondContact O-CB 3.35Å; M716-L720 WeakPolarHBondContact O-CG 3.39Å; M716-L720 PolarHBondContact O-N 2.91Å
717	A	65.3	Low	62.6	Low	62 Å²	62	104.2 Å²	104.2	51%	0.512	59%	0.586	S	S	.	*	H	α-helix	trans	-65	-41.6	177.7	0	0	0	0	0	112.4	T713 M714 L720 G721	T713-A717 WeakPolarHBondContact O-CB 3.39Å; T713-A717 PolarHBondContact O-N 2.69Å; M714-A717 PolarHBondContact O-N 3.47Å; A717-L720 PolarHBondContact O-N 2.85Å; A717-G721 PolarHBondContact O-N 3.07Å
718	V	70.7	Confident	64.2	Low	98 Å²	98	97 Å²	97	59%	0.594	57%	0.566	S	S	*	*	H	α-helix	trans	-66.3	-41.6	174.8	172.6	0	0	0	0	111.1	M714 G721 A722	M714-V718 WeakPolarHBondContact O-CG2 3.46Å; M714-V718 PolarHBondContact O-N 2.85Å; V718-G721 PolarHBondContact O-N 3.3Å; V718-A722 WeakPolarHBondContact O-CB 3.28Å; V718-A722 PolarHBondContact O-N 2.85Å
719	C	67.6	Low	65.6	Low	68 Å²	68	98.3 Å²	98.3	46%	0.459	56%	0.557	S	S	.	*	H	α-helix	trans	-62.9	-43.4	174.7	-73.8	0	0	0	0	112.6	M715 M716 A722 T723	M715-C719 WeakPolarHBondContact O-CB 3.04Å; M715-C719 PolarHBondContact O-N 2.03Å; M715-C719 PolarHBondContact O-SG 3.37Å; M716-C719 PolarHBondContact O-N 2.54Å; C719-A722 PolarHBondContact O-N 3.38Å; C719-T723 WeakPolarHBondContact O-CG2 3.23Å; C719-T723 PolarHBondContact O-N 2.97Å; C719-T723 PolarHBondContact O-OG1 2.89Å; C719-T723 VanDerWaalsContact O-OG1 3.12Å
720	L	72.9	Confident	66.6	Low	105 Å²	105	93.9 Å²	93.9	55%	0.55	54%	0.544	S	S	.	.	H	α-helix	trans	-68.5	-37.7	177.7	-75.9	165.2	0	0	0	112.5	M716 A717 T723 C724	M716-L720 HydrophobicContact CE-CD1 4.49Å; M716-L720 WeakPolarHBondContact O-CB 3.35Å; M716-L720 WeakPolarHBondContact O-CG 3.39Å; M716-L720 PolarHBondContact O-N 2.91Å; A717-L720 PolarHBondContact O-N 2.85Å; L720-T723 PolarHBondContact O-OG1 3.43Å; L720-C724 WeakPolarHBondContact O-CB 3.41Å; L720-C724 PolarHBondContact O-N 3.33Å
721	G	72.1	Confident	67.7	Low	42 Å²	42	91.6 Å²	91.6	43%	0.433	53%	0.532	S	S	.	.	H	α-helix	trans	-62.5	-44.8	171.8	0	0	0	0	0	112.1	A717 V718 L725	A717-G721 PolarHBondContact O-N 3.07Å; V718-G721 PolarHBondContact O-N 3.3Å; G721-L725 WeakPolarHBondContact O-CB 3.48Å; G721-L725 PolarHBondContact O-N 2.86Å
722	A	70.4	Confident	67.9	Low	51 Å²	51	88.8 Å²	88.8	42%	0.421	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-42.7	178.2	0	0	0	0	0	112.8	V718 C719 L726	V718-A722 WeakPolarHBondContact O-CB 3.28Å; V718-A722 PolarHBondContact O-N 2.85Å; C719-A722 PolarHBondContact O-N 3.38Å; A722-L726 WeakPolarHBondContact O-CB 3.39Å; A722-L726 WeakPolarHBondContact O-CG 2.97Å; A722-L726 PolarHBondContact O-N 2.82Å
723	T	75.3	Confident	68.3	Low	84 Å²	84	87.2 Å²	87.2	52%	0.515	51%	0.512	S	S	.	.	H	α-helix	trans	-70.1	-37.5	177.2	54.5	0	0	0	0	112.2	C719 L720 L726 L727	C719-T723 WeakPolarHBondContact O-CG2 3.23Å; C719-T723 PolarHBondContact O-N 2.97Å; C719-T723 PolarHBondContact O-OG1 2.89Å; C719-T723 VanDerWaalsContact O-OG1 3.12Å; L720-T723 PolarHBondContact O-OG1 3.43Å; T723-L726 PolarHBondContact O-N 2.91Å; T723-L727 WeakPolarHBondContact O-CB 3.32Å; T723-L727 PolarHBondContact O-N 3.26Å
724	C	70.3	Confident	68.4	Low	70 Å²	70	87.9 Å²	87.9	47%	0.473	52%	0.516	S	S	.	.	H	α-helix	trans	-64.3	-43.4	175.1	-170.3	0	0	0	0	111.7	L720 L727 L728	L720-C724 WeakPolarHBondContact O-CB 3.41Å; L720-C724 PolarHBondContact O-N 3.33Å; C724-L727 WeakPolarHBondContact O-CB 3.44Å; C724-L727 PolarHBondContact O-N 3.18Å; C724-L728 WeakPolarHBondContact O-CG 3.45Å; C724-L728 PolarHBondContact O-N 2.89Å
725	L	73.4	Confident	68.5	Low	113 Å²	113	86.6 Å²	86.6	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-68.6	-35.4	178.2	-166	135.7	0	0	0	112.5	G721 L729	G721-L725 WeakPolarHBondContact O-CB 3.48Å; G721-L725 PolarHBondContact O-N 2.86Å; L725-L729 HydrophobicContact CD2-CD1 3.9Å; L725-L729 PolarHBondContact O-N 3.43Å
726	L	72.9	Confident	68.5	Low	114 Å²	114	86.3 Å²	86.3	60%	0.597	52%	0.52	S	S	*	.	H	α-helix	trans	-67.1	-37.3	169.6	-78	168.4	0	0	0	112.6	A722 T723 L729 A730	A722-L726 WeakPolarHBondContact O-CB 3.39Å; A722-L726 WeakPolarHBondContact O-CG 2.97Å; A722-L726 PolarHBondContact O-N 2.82Å; T723-L726 PolarHBondContact O-N 2.91Å; L726-L729 PolarHBondContact O-N 3.33Å; L726-A730 WeakPolarHBondContact O-CB 3.25Å; L726-A730 PolarHBondContact O-N 3.17Å
727	L	73.4	Confident	68.3	Low	112 Å²	112	90.3 Å²	90.3	59%	0.586	54%	0.535	S	S	*	.	H	α-helix	trans	-66	-42.5	176.8	-159	81.9	0	0	0	111.1	T723 C724 A730 I731	T723-L727 WeakPolarHBondContact O-CB 3.32Å; T723-L727 PolarHBondContact O-N 3.26Å; C724-L727 WeakPolarHBondContact O-CB 3.44Å; C724-L727 PolarHBondContact O-N 3.18Å; L727-A730 PolarHBondContact O-N 2.95Å; L727-I731 HydrophobicContact CD2-CD1 4.35Å; L727-I731 HydrophobicContact CG-CD1 4.17Å; L727-I731 WeakPolarHBondContact O-CD1 3.22Å; L727-I731 VanDerWaalsContact O-CG1 3.27Å; L727-I731 WeakPolarHBondContact O-CG1 3.24Å; L727-I731 PolarHBondContact O-N 3.31Å
728	L	74	Confident	67.3	Low	109 Å²	109	92.1 Å²	92.1	57%	0.571	54%	0.543	S	S	*	.	H	α-helix	trans	-64.6	-40.9	175.6	-71	169	0	0	0	112	C724 I731 A732	C724-L728 WeakPolarHBondContact O-CG 3.45Å; C724-L728 PolarHBondContact O-N 2.89Å; L728-I731 PolarHBondContact O-N 2.86Å; L728-A732 WeakPolarHBondContact O-CB 3.38Å; L728-A732 PolarHBondContact O-N 3.31Å
729	L	72.8	Confident	66.2	Low	97 Å²	97	99.2 Å²	99.2	51%	0.508	56%	0.559	S	S	.	*	H	α-helix	trans	-64.5	-37.9	172.1	-80.9	166.3	0	0	0	112.6	L725 L726 A732 L733	L725-L729 HydrophobicContact CD2-CD1 3.9Å; L725-L729 PolarHBondContact O-N 3.43Å; L726-L729 PolarHBondContact O-N 3.33Å; L729-A732 PolarHBondContact O-N 3.47Å; L729-L733 WeakPolarHBondContact O-CG 3.42Å; L729-L733 PolarHBondContact O-N 3.09Å
730	A	68.6	Low	65	Low	47 Å²	47	101.2 Å²	101.2	39%	0.388	57%	0.571	S	S	.	*	H	α-helix	trans	-66.4	-42.5	175.1	0	0	0	0	0	112	L726 L727 A732 L733 V734	L726-A730 WeakPolarHBondContact O-CB 3.25Å; L726-A730 PolarHBondContact O-N 3.17Å; L727-A730 PolarHBondContact O-N 2.95Å; A730-A732 VanDerWaalsContact C-N 3.34Å; A730-L733 PolarHBondContact O-N 3.28Å; A730-V734 WeakPolarHBondContact O-CB 3.38Å; A730-V734 VanDerWaalsContact O-CG2 3.32Å; A730-V734 WeakPolarHBondContact O-CG2 3.13Å; A730-V734 PolarHBondContact O-N 3.48Å
731	I	70.3	Confident	63.2	Low	93 Å²	93	105.4 Å²	105.4	48%	0.477	59%	0.588	S	S	.	*	H	α-helix	trans	-63.9	-40.1	175	-68.6	163	0	0	0	110.5	L727 L728 V734 T735	L727-I731 HydrophobicContact CD2-CD1 4.35Å; L727-I731 HydrophobicContact CG-CD1 4.17Å; L727-I731 WeakPolarHBondContact O-CD1 3.22Å; L727-I731 VanDerWaalsContact O-CG1 3.27Å; L727-I731 WeakPolarHBondContact O-CG1 3.24Å; L727-I731 PolarHBondContact O-N 3.31Å; L728-I731 PolarHBondContact O-N 2.86Å; I731-V734 PolarHBondContact O-N 3.05Å; I731-T735 WeakPolarHBondContact O-CB 3.34Å; I731-T735 WeakPolarHBondContact O-CG2 3.3Å; I731-T735 PolarHBondContact O-N 2.98Å; I731-T735 PolarHBondContact O-OG1 2.92Å
732	A	62.2	Low	61.4	Low	45 Å²	45	112.8 Å²	112.8	37%	0.372	61%	0.608	S	S	.	*	H	α-helix	trans	-63.5	-39.4	174.3	0	0	0	0	0	112.7	L728 L729 A730 T735 T736	L728-A732 WeakPolarHBondContact O-CB 3.38Å; L728-A732 PolarHBondContact O-N 3.31Å; L729-A732 PolarHBondContact O-N 3.47Å; A730-A732 VanDerWaalsContact C-N 3.34Å; A732-T735 WeakPolarHBondContact CA-OG1 3.46Å; A732-T735 PolarHBondContact O-OG1 2.95Å; A732-T736 WeakPolarHBondContact O-CB 3.3Å; A732-T736 VanDerWaalsContact O-CG2 3.31Å; A732-T736 WeakPolarHBondContact O-CG2 3.48Å; A732-T736 PolarHBondContact O-N 3.37Å; A732-T736 VanDerWaalsContact O-N 3.14Å; A732-T736 PolarHBondContact O-OG1 2.91Å
733	L	64.1	Low	59.6	Low	107 Å²	107	122.1 Å²	122.1	56%	0.56	63%	0.633	S	S	*	*	H	α-helix	trans	-70.5	-39.2	175.8	-76.1	167.3	0	0	0	112.8	L729 A730 T736 F737	L729-L733 WeakPolarHBondContact O-CG 3.42Å; L729-L733 PolarHBondContact O-N 3.09Å; A730-L733 PolarHBondContact O-N 3.28Å; L733-T736 WeakPolarHBondContact CA-OG1 3.24Å; L733-T736 PolarHBondContact O-N 3.31Å; L733-T736 PolarHBondContact O-OG1 3.29Å; L733-F737 PolarHBondContact O-N 2.96Å
734	V	62.5	Low	57.7	Low	102 Å²	102	124.7 Å²	124.7	62%	0.618	64%	0.643	S	S	*	*	H	α-helix	trans	-68.8	-35.9	177.6	170.1	0	0	0	0	111.7	A730 I731	A730-V734 WeakPolarHBondContact O-CB 3.38Å; A730-V734 VanDerWaalsContact O-CG2 3.32Å; A730-V734 WeakPolarHBondContact O-CG2 3.13Å; A730-V734 PolarHBondContact O-N 3.48Å; I731-V734 PolarHBondContact O-N 3.05Å
735	T	59.5	Low	55.9	Low	102 Å²	102	128.4 Å²	128.4	63%	0.626	66%	0.659	S	S	*	*	H	α-helix	trans	-78.7	-21.5	177.7	49.4	0	0	0	0	114.1	I731 A732	I731-T735 WeakPolarHBondContact O-CB 3.34Å; I731-T735 WeakPolarHBondContact O-CG2 3.3Å; I731-T735 PolarHBondContact O-N 2.98Å; I731-T735 PolarHBondContact O-OG1 2.92Å; A732-T735 WeakPolarHBondContact CA-OG1 3.46Å; A732-T735 PolarHBondContact O-OG1 2.95Å
736	T	58.1	Low	53.9	Low	102 Å²	102	131.3 Å²	131.3	63%	0.626	67%	0.669	S	S	*	*	H	α-helix	trans	-89.1	-19.2	178.6	46.2	0	0	0	0	114.7	A732 L733	A732-T736 WeakPolarHBondContact O-CB 3.3Å; A732-T736 VanDerWaalsContact O-CG2 3.31Å; A732-T736 WeakPolarHBondContact O-CG2 3.48Å; A732-T736 PolarHBondContact O-N 3.37Å; A732-T736 VanDerWaalsContact O-N 3.14Å; A732-T736 PolarHBondContact O-OG1 2.91Å; L733-T736 WeakPolarHBondContact CA-OG1 3.24Å; L733-T736 PolarHBondContact O-N 3.31Å; L733-T736 PolarHBondContact O-OG1 3.29Å
737	F	58.3	Low	51.9	Low	173 Å²	173	130.1 Å²	130.1	76%	0.759	68%	0.675	S	S	*	*	H	α-helix	trans	-106.4	-4.6	-176.9	-90	-85.7	0	0	0	116.4	L733	L733-F737 PolarHBondContact O-N 2.96Å
738	C	43.1	Very low	49.8	Very low	100 Å²	100	135.3 Å²	135.3	68%	0.676	69%	0.689	S	S	*	*			trans	-127.2	81.6	-173.9	-76.5	0	0	0	0	114.8
739	R	48.1	Very low	47.8	Very low	247 Å²	247	136.4 Å²	136.4	93%	0.932	70%	0.695	S	S	*	*			trans	-115.5	128.7	139.3	-74.9	-175.6	174.6	-172.4	-1.3	106.7
740	P	42.9	Very low	45.8	Very low	111 Å²	111	137.5 Å²	137.5	72%	0.721	71%	0.709	S	S	*	*				-147.6	159.5	112.2	37.1	-21.5	0	0	0	116.1
741	E	35.7	Very low	44	Very low	192 Å²	192	146.7 Å²	146.7	90%	0.897	73%	0.734	S	S	*	*			trans	29.9	122.9	148.2	-60.4	179.9	108.8	0	0	121.7
742	K	33.5	Very low	42	Very low	198 Å²	198	151.6 Å²	151.6	86%	0.861	76%	0.755	S	S	*	*			trans	-76.8	139.2	158	-73.2	-176.4	175.3	-178.5	0	111
743	R	33	Very low	40.5	Very low	246 Å²	246	153.8 Å²	153.8	93%	0.928	77%	0.773	S	S	*	*			trans	-154.8	88.4	158.3	-164.8	173.4	-172.7	164.6	3	112
744	D	35.1	Very low	38.9	Very low	138 Å²	138	157.5 Å²	157.5	74%	0.738	79%	0.787	S	S	*	*			trans	-76.8	135.4	177.8	-63	-63.1	0	0	0	112.4
745	N	31.5	Very low	37.5	Very low	149 Å²	149	157.5 Å²	157.5	80%	0.797	79%	0.792	S	S	*	*			trans	-173.9	156.4	140.2	-108.7	-46.3	0	0	0	114.7
746	H	33.2	Very low	36.3	Very low	174 Å²	174	157.6 Å²	157.6	81%	0.806	80%	0.797	S	S	*	*			trans	67.4	106.2	167.5	-71.4	-66.8	0	0	0	121
747	A	30.2	Very low	35	Very low	89 Å²	89	163.4 Å²	163.4	74%	0.736	81%	0.809	S	S	*	*			trans	-54.2	168.9	162.4	0	0	0	0	0	116.5
748	Y	29.8	Very low	33.9	Very low	221 Å²	221	160.9 Å²	160.9	87%	0.867	81%	0.808	S	S	*	*				-160.4	171.8	120.7	-118.2	-84.1	0	0	0	112.9
749	N	31.5	Very low	33.4	Very low	132 Å²	132	166.9 Å²	166.9	71%	0.706	82%	0.816	S	S	*	*			trans	-86.7	150.6	-168.6	-56	-74.8	0	0	0	115.6
750	C	31.7	Very low	32.7	Very low	119 Å²	119	161.7 Å²	161.7	80%	0.804	80%	0.802	S	S	*	*				165.2	133.5	115.9	-89	0	0	0	0	110.4
751	R	29	Very low	32.9	Very low	240 Å²	240	162.6 Å²	162.6	91%	0.906	81%	0.808	S	S	*	*			cis	96	91.3	39.6	-170.7	-165.7	-165.4	-168.2	6.3	113.1
752	Q	29.2	Very low	32.9	Very low	197 Å²	197	163.7 Å²	163.7	92%	0.921	80%	0.804	S	S	*	*			trans	-149	156.7	152.5	-161	160.5	-1.3	0	0	109.3
753	A	30.4	Very low	32.7	Very low	90 Å²	90	166 Å²	166	74%	0.744	81%	0.807	S	S	*	*			trans	-160.1	153.5	-169.7	0	0	0	0	0	113
754	E	31.8	Very low	33	Very low	186 Å²	186	160.2 Å²	160.2	87%	0.869	80%	0.802	S	S	*	*			trans	-175.6	107.7	158.6	-102.1	155	-149.4	0	0	106.5
755	S	32.8	Very low	32.8	Very low	102 Å²	102	162.5 Å²	162.5	71%	0.713	81%	0.808	S	S	*	*				74.2	121.6	83.3	74.3	0	0	0	0	114.5
756	S	32.7	Very low	32.8	Very low	104 Å²	104	164.4 Å²	164.4	73%	0.727	81%	0.809	S	S	*	*				-168.2	142.9	80.1	36.2	0	0	0	0	115.3
757	Y	31.5	Very low	32.8	Very low	223 Å²	223	162.6 Å²	162.6	88%	0.875	81%	0.806	S	S	*	*			trans	45.3	121.7	143.2	-75	-110.4	0	0	0	119.3
758	T	36.3	Very low	33.2	Very low	121 Å²	121	166 Å²	166	74%	0.742	81%	0.81	S	S	*	*			cis	-145.3	-169.4	17	59.6	0	0	0	0	110.2
759	R	30.7	Very low	33.6	Very low	225 Å²	225	166.2 Å²	166.2	85%	0.849	81%	0.809	S	S	*	*			cis	-154.4	162.2	6.9	-151.9	172.2	-178.6	179.8	0.6	110.4
760	H	34.5	Very low	34	Very low	139 Å²	139	170.7 Å²	170.7	64%	0.644	82%	0.822	S	S	*	*			trans	-158.5	168	175.3	-99.4	-46.6	0	0	0	110.1
761	P	46.9	Very low	34.8	Very low	130 Å²	130	169.6 Å²	169.6	84%	0.844	82%	0.816	S	S	*	*				-123.8	175.4	87.9	3.3	18.8	0	0	0	114.1
762	R	34.7	Very low	35.2	Very low	215 Å²	215	163.9 Å²	163.9	81%	0.811	80%	0.803	S	S	*	*			trans	-115.4	158.5	179.9	-67.4	178	175.4	172.7	-4.5	112.1
763	R	29.8	Very low	35.6	Very low	245 Å²	245	162 Å²	162	93%	0.925	80%	0.798	S	S	*	*			trans	-102.7	138.2	167.5	-150.9	176.6	-166.1	-177.8	4.3	109.2
764	P	40.1	Very low	35.7	Very low	125 Å²	125	166.8 Å²	166.8	81%	0.812	81%	0.805	S	S	*	*			trans	-85.4	171.2	-173.9	33.5	-36	0	0	0	114.5
765	Q	31.4	Very low	35.8	Very low	187 Å²	187	165.9 Å²	165.9	87%	0.874	81%	0.805	S	S	*	*			trans	-117	172.5	177.7	-90	-169.5	-22.2	0	0	112.2
766	K	29.7	Very low	35.8	Very low	188 Å²	188	168.2 Å²	168.2	82%	0.817	81%	0.808	S	S	*	*			trans	85.3	140.8	179.2	-63.3	-168.4	173.8	-178.6	0	114.5
767	N	34.2	Very low	36	Very low	137 Å²	137	168.9 Å²	168.9	73%	0.733	81%	0.81	S	S	*	*			cis	-143.3	141.7	-5.9	-93.9	-23.2	0	0	0	108.5
768	I	38.7	Very low	35.9	Very low	161 Å²	161	164.5 Å²	164.5	83%	0.826	81%	0.806	S	S	*	*			trans	-113.4	143.9	166.4	-63.9	178.7	0	0	0	108.4
769	R	38.7	Very low	35.9	Very low	225 Å²	225	166.5 Å²	166.5	85%	0.849	81%	0.811	S	S	*	*			trans	-90.4	158.7	-173.9	-62.6	-171.2	-172	-163.6	4.2	111.8	S771	R769-S771 PolarHBondContact O-N 3.35Å; R769-S771 VanDerWaalsContact O-N 3.16Å
770	K	38.9	Very low	35.8	Very low	225 Å²	225	167 Å²	167	98%	0.978	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	61.7	-168.5	-162.2	-179.7	-178.2	-177.4	0	112.3
771	S	48.3	Very low	35.5	Very low	96 Å²	96	163.9 Å²	163.9	67%	0.671	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	-21.5	173	47.3	0	0	0	0	113.4	R769	R769-S771 PolarHBondContact O-N 3.35Å; R769-S771 VanDerWaalsContact O-N 3.16Å
772	D	37	Very low	34.7	Very low	120 Å²	120	169.5 Å²	169.5	64%	0.642	82%	0.822	S	S	*	*	S	Bend	trans	-103.3	110.9	-161.1	-56.7	-4.4	0	0	0	111.3
773	I	37.8	Very low	34.3	Very low	158 Å²	158	166.8 Å²	166.8	81%	0.81	82%	0.816	S	S	*	*			trans	72.3	119.9	160	-53.2	170.9	0	0	0	116.4
774	Q	33.4	Very low	34.3	Very low	191 Å²	191	162.8 Å²	162.8	89%	0.893	81%	0.808	S	S	*	*			trans	-92.7	143.8	169.3	-63.4	169.7	-53	0	0	110.4
775	L	32.8	Very low	33.7	Very low	167 Å²	167	163.8 Å²	163.8	87%	0.874	80%	0.802	S	S	*	*			trans	-138.9	157.8	161.9	-87.5	178.1	0	0	0	111.4
776	I	33.4	Very low	34.7	Very low	151 Å²	151	160.2 Å²	160.2	77%	0.774	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-81	138.2	-166.7	-61.9	160	0	0	0	110.8
777	P	37.5	Very low	34.6	Very low	118 Å²	118	157 Å²	157	77%	0.766	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.9	127.8	176.1	31.2	-33.6	0	0	0	112.3
778	V	29.9	Very low	34.5	Very low	130 Å²	130	159 Å²	159	79%	0.788	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-103	139	163.5	174.1	0	0	0	0	108.4
779	I	35.3	Very low	34.2	Very low	164 Å²	164	159.8 Å²	159.8	84%	0.841	80%	0.801	S	S	*	*			trans	-122.2	124.1	165.7	-65.3	-177.7	0	0	0	109.1
780	R	29.7	Very low	33.7	Very low	236 Å²	236	156.3 Å²	156.3	89%	0.891	80%	0.799	S	S	*	*			trans	-79.5	140.7	167.3	-82.5	176.5	166.4	164.7	-4.7	109.8
781	G	26.8	Very low	33.3	Very low	73 Å²	73	150.1 Å²	150.1	75%	0.753	79%	0.785	S	S	*	*			trans	-105.6	149.5	149.2	0	0	0	0	0	110.1
782	R	29.7	Very low	32.5	Very low	247 Å²	247	154 Å²	154	93%	0.932	79%	0.792	S	S	*	*			trans	-159.3	120.8	161.6	-138.7	-175.2	-171.1	-171.9	3.3	114.3
783	K	27.6	Very low	32.2	Very low	158 Å²	158	154.1 Å²	154.1	69%	0.687	80%	0.797	S	S	*	*			trans	62.5	146.4	153.4	-118.4	-159.6	173	-154.2	0	122.1	E785	K783-E785 IonicContact NZ-OE1 2.59Å; K783-E785 PolarHBondContact NZ-OE1 3.01Å
784	E	28.5	Very low	31.8	Very low	161 Å²	161	155 Å²	155	75%	0.752	80%	0.797	S	S	*	*			trans	-95	-179.5	173.9	-38.4	98.9	124.8	0	0	113
785	E	29.1	Very low	32.1	Very low	146 Å²	146	150.6 Å²	150.6	68%	0.682	79%	0.785	S	S	*	*			trans	161.5	167.8	135.5	-91.8	170.2	-137.2	0	0	110.9	K783	K783-E785 IonicContact NZ-OE1 2.59Å; K783-E785 PolarHBondContact NZ-OE1 3.01Å
786	P	52.1	Low	31.8	Very low	113 Å²	113	150 Å²	150	73%	0.734	78%	0.783	S	S	*	*			cis	-136.1	-179.6	-38.3	38.6	-23.2	0	0	0	113.1
787	S	27.2	Very low	31.9	Very low	120 Å²	120	149 Å²	149	84%	0.839	78%	0.783	S	S	*	*			trans	-164.3	127.4	144.3	55.5	0	0	0	0	113.5
788	E	32.7	Very low	31.8	Very low	179 Å²	179	149.5 Å²	149.5	84%	0.836	79%	0.787	S	S	*	*			trans	-72.8	175.7	171.4	-63.4	156.2	167.7	0	0	111.9
789	E	31.1	Very low	31.6	Very low	178 Å²	178	147.9 Å²	147.9	83%	0.832	79%	0.787	S	S	*	*			cis	-167.9	144.4	-30.4	-100.3	-168.8	153.7	0	0	105.2
790	D	28.2	Very low	32.2	Very low	151 Å²	151	146 Å²	146	81%	0.807	79%	0.785	S	S	*	*			trans	-167.7	121.3	143.9	-128	-30.4	0	0	0	115.1
791	S	31.3	Very low	32.2	Very low	96 Å²	96	142.4 Å²	142.4	67%	0.671	78%	0.783	S	S	*	*			trans	37.3	116.8	138	-52	0	0	0	0	124.4
792	E	30.8	Very low	33.1	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	78%	0.776	S	S	*	*			trans	76.2	113.8	132.3	-64	-152.3	132.6	0	0	124.6
793	V	30.6	Very low	33	Very low	122 Å²	122	140 Å²	140	74%	0.739	77%	0.771	S	S	*	*				76.2	115.5	128.8	-177.6	0	0	0	0	121.2
794	Q	29.5	Very low	33.1	Very low	177 Å²	177	138.6 Å²	138.6	83%	0.827	77%	0.771	S	S	*	*			trans	7.4	160.6	139.8	-80.7	-173.6	10.1	0	0	122.6
795	P	40.9	Very low	33.1	Very low	98 Å²	98	137.5 Å²	137.5	64%	0.636	77%	0.765	S	S	*	*			cis	-136.6	-165.7	-4.2	30.2	-5.8	0	0	0	114.5
796	L	26.4	Very low	33.1	Very low	156 Å²	156	138.3 Å²	138.3	82%	0.817	77%	0.769	S	S	*	*			trans	90	141.7	159.6	-61.9	164.5	0	0	0	119.4
797	T	34.2	Very low	32.2	Very low	129 Å²	129	138.4 Å²	138.4	79%	0.791	77%	0.768	S	S	*	*			trans	-29.2	144.9	172	49.6	0	0	0	0	118.7
798	P	35.7	Very low	32.3	Very low	129 Å²	129	141.4 Å²	141.4	84%	0.838	77%	0.769	S	S	*	*			trans	-129.8	143.8	143.5	37.5	-26.6	0	0	0	115.3
799	A	27.1	Very low	32.1	Very low	96 Å²	96	144.8 Å²	144.8	79%	0.793	77%	0.774	S	S	*	*			trans	-138.1	158.1	135.9	0	0	0	0	0	105.8
800	P	46.8	Very low	31.9	Very low	124 Å²	124	145.3 Å²	145.3	81%	0.805	78%	0.776	S	S	*	*			cis	-132	-165.6	12.8	42	-23.8	0	0	0	114.9
801	L	29.6	Very low	32	Very low	160 Å²	160	148.2 Å²	148.2	84%	0.838	78%	0.777	S	S	*	*			trans	-45.4	169.3	161.4	-64	168.5	0	0	0	114.3
802	P	46.9	Very low	31.8	Very low	93 Å²	93	150.1 Å²	150.1	60%	0.604	78%	0.78	S	S	*	*			cis	-145.8	-172.7	26	43.8	-23.3	0	0	0	118
803	E	27.2	Very low	31.7	Very low	177 Å²	177	150 Å²	150	83%	0.827	78%	0.777	S	S	*	*			trans	49.1	150	142.5	-75	156.6	-145.8	0	0	121.3
804	D	28.6	Very low	31.5	Very low	129 Å²	129	149.9 Å²	149.9	69%	0.69	77%	0.771	S	S	*	*			cis	-175	127.4	-24.7	-141.3	24.6	0	0	0	103.1
805	Q	29.3	Very low	32	Very low	137 Å²	137	146.3 Å²	146.3	64%	0.64	76%	0.763	S	S	*	*				161.2	150.7	78.4	-113.8	164.6	52.4	0	0	109.7
806	Q	29.4	Very low	31.5	Very low	163 Å²	163	146.2 Å²	146.2	76%	0.762	77%	0.765	S	S	*	*			trans	64.4	149.3	149.1	-61.5	170.8	28.9	0	0	119.3
807	T	32.4	Very low	31.6	Very low	116 Å²	116	145 Å²	145	71%	0.712	76%	0.764	S	S	*	*			cis	-134.5	139.1	7.6	46.5	0	0	0	0	114.2
808	E	29	Very low	31.4	Very low	183 Å²	183	147.4 Å²	147.4	86%	0.855	77%	0.768	S	S	*	*			trans	46.7	97.8	141.5	-57.1	-169.2	154.8	0	0	121.8
809	R	28.6	Very low	30.9	Very low	250 Å²	250	147.7 Å²	147.7	94%	0.943	76%	0.763	S	S	*	*				-179.4	102.5	119.4	-100.2	179.4	-173.1	-170.5	3.7	111.4
810	E	27.6	Very low	31	Very low	188 Å²	188	148.8 Å²	148.8	88%	0.879	76%	0.76	S	S	*	*				-168.1	174.6	108.7	-129.6	-178.2	-178.8	0	0	112.1	N812	E810-N812 PolarHBondContact O-N 3.11Å
811	Y	29.9	Very low	30	Very low	212 Å²	212	147 Å²	147	83%	0.831	75%	0.75	S	S	*	*			trans	-70.3	111.9	-167.7	-79.2	-102	0	0	0	113.6
812	N	26.4	Very low	30	Very low	136 Å²	136	148 Å²	148	73%	0.727	75%	0.748	S	S	*	*			trans	-120.4	119.5	143.2	-112.3	-43.4	0	0	0	107.8	E810 I814	E810-N812 PolarHBondContact O-N 3.11Å; N812-I814 VanDerWaalsContact O-CD1 3.31Å; N812-I814 WeakPolarHBondContact O-CD1 3.22Å
813	F	29	Very low	29.1	Very low	175 Å²	175	151.1 Å²	151.1	77%	0.768	75%	0.754	S	S	*	*			trans	-127.7	124.9	159.2	-101	-97	0	0	0	108.8
814	I	27.1	Very low	29.2	Very low	119 Å²	119	146.6 Å²	146.6	61%	0.61	74%	0.743	S	S	*	*			cis	81.6	134	34.9	-58.7	171.3	0	0	0	110.9	N812	N812-I814 VanDerWaalsContact O-CD1 3.31Å; N812-I814 WeakPolarHBondContact O-CD1 3.22Å
815	P	40.8	Very low	29.2	Very low	102 Å²	102	149 Å²	149	66%	0.662	75%	0.75	S	S	*	*			cis	-149.5	-34.6	-26.5	38.3	-20.6	0	0	0	120.6
816	S	28.7	Very low	29	Very low	96 Å²	96	147.6 Å²	147.6	67%	0.671	76%	0.755	S	S	*	*				-89.7	157.5	-121.6	8.3	0	0	0	0	116.2
817	V	29.1	Very low	28.9	Very low	130 Å²	130	150 Å²	150	79%	0.788	76%	0.758	S	S	*	*			cis	69.5	75.9	14.1	-164.6	0	0	0	0	116.8
818	M	30.8	Very low	29.6	Very low	180 Å²	180	149.1 Å²	149.1	89%	0.887	75%	0.754	S	S	*	*			trans	-167.5	130.8	145.6	-100.4	174.6	-170.6	0	0	105.7
819	N	25.5	Very low	29.7	Very low	136 Å²	136	148.4 Å²	148.4	73%	0.727	75%	0.751	S	S	*	*			cis	78.2	131.9	21.2	-156.3	13.6	0	0	0	115.7
820	T	28.4	Very low	29.8	Very low	118 Å²	118	142.6 Å²	142.6	72%	0.724	74%	0.743	S	S	*	*			trans	68.3	143.1	177.7	72.3	0	0	0	0	116.1
821	S	26.7	Very low	29.9	Very low	88 Å²	88	140.6 Å²	140.6	62%	0.615	74%	0.738	S	S	*	*			cis	-159.5	167.7	-1.1	40	0	0	0	0	113.7
822	F	27.6	Very low	29.7	Very low	179 Å²	179	135 Å²	135	79%	0.785	73%	0.731	S	S	*	*			trans	70.5	140.7	170.9	-56.8	-77.7	0	0	0	117.4
823	H	29.6	Very low	30.6	Very low	159 Å²	159	133.8 Å²	133.8	74%	0.736	73%	0.73	S	S	*	*			cis	-135.2	155.6	8.1	-129.6	-66.6	0	0	0	113.7
824	S	28.1	Very low	30.7	Very low	83 Å²	83	133.7 Å²	133.7	58%	0.58	73%	0.732	S	S	*	*			trans	-43.8	154	167.9	53.9	0	0	0	0	115.2
825	Q	28.9	Very low	30.9	Very low	180 Å²	180	135.8 Å²	135.8	84%	0.841	74%	0.739	S	S	*	*				-165.5	162.3	58	-73.3	171.5	-19.9	0	0	108.9
826	S	24.7	Very low	30.4	Very low	106 Å²	106	138.3 Å²	138.3	74%	0.741	75%	0.745	S	S	*	*			cis	179.8	143.2	-18.1	52.3	0	0	0	0	108.3
827	Y	27.7	Very low	30.3	Very low	213 Å²	213	136.5 Å²	136.5	84%	0.835	74%	0.742	S	S	*	*			trans	-41.8	175.6	167.5	-84.8	-100.8	0	0	0	117.3
828	P	48.4	Very low	30.5	Very low	98 Å²	98	138.7 Å²	138.7	64%	0.636	74%	0.743	S	S	*	*			cis	-143.6	162.3	22.5	29.9	-5	0	0	0	121.4
829	E	30	Very low	30.5	Very low	168 Å²	168	138.5 Å²	138.5	79%	0.785	74%	0.739	S	S	*	*			trans	54.1	160.6	133.4	-56.5	161.3	153.7	0	0	120
830	V	30.3	Very low	30.5	Very low	128 Å²	128	137.5 Å²	137.5	78%	0.776	74%	0.742	S	S	*	*			cis	-157.5	147.9	37.5	165.7	0	0	0	0	107.2
831	D	29.4	Very low	30.7	Very low	146 Å²	146	140.5 Å²	140.5	78%	0.781	75%	0.745	S	S	*	*			cis	-148.3	-156.6	4.9	-148.2	-45.7	0	0	0	110.7
832	S	26.4	Very low	30.8	Very low	95 Å²	95	142 Å²	142	66%	0.664	75%	0.751	S	S	*	*			trans	-126.8	-164.2	167.2	-50.5	0	0	0	0	110.9
833	P	46.1	Very low	30.8	Very low	110 Å²	110	140.7 Å²	140.7	71%	0.714	75%	0.751	S	S	*	*			cis	-136.3	144.2	41.9	43	-23.8	0	0	0	116.2
834	Q	31.3	Very low	30.7	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.813	76%	0.759	S	S	*	*				67.7	154.4	98.5	-59.9	178.5	-0.6	0	0	119
835	H	30.3	Very low	31	Very low	162 Å²	162	150.2 Å²	150.2	75%	0.75	77%	0.773	S	S	*	*			cis	-176.6	163.3	-39.6	-132.3	-81.9	0	0	0	110.3
836	I	29.7	Very low	31.5	Very low	155 Å²	155	147.5 Å²	147.5	80%	0.795	77%	0.771	S	S	*	*			trans	70.9	144.6	160.4	-57	150.9	0	0	0	116.6
837	G	28.4	Very low	31.5	Very low	58 Å²	58	145.6 Å²	145.6	60%	0.598	77%	0.769	S	S	*	*			cis	153.6	148.5	-13	0	0	0	0	0	116
838	H	32.2	Very low	31.5	Very low	176 Å²	176	143 Å²	143	82%	0.815	77%	0.769	S	S	*	*			trans	79.8	121.7	162.3	-63.2	-83.7	0	0	0	123.5
839	H	31	Very low	30.7	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.815	78%	0.778	S	S	*	*			trans	-19	154.8	151.4	-51.9	-90.6	0	0	0	119.6
840	C	25.6	Very low	30.8	Very low	116 Å²	116	145.4 Å²	145.4	78%	0.784	78%	0.775	S	S	*	*				171	-179.8	82.2	-158	0	0	0	0	113.9
841	K	31.7	Very low	31	Very low	180 Å²	180	146.2 Å²	146.2	78%	0.783	78%	0.775	S	S	*	*			trans	82.7	92.2	157.5	-66.6	179.6	-179.1	176.7	0	121.9
842	T	28.7	Very low	31	Very low	120 Å²	120	146.7 Å²	146.7	74%	0.736	78%	0.777	S	S	*	*				47.5	123.7	115	59.2	0	0	0	0	123.6
843	L	27.7	Very low	31.4	Very low	151 Å²	151	144.6 Å²	144.6	79%	0.791	77%	0.77	S	S	*	*				76	127.3	128.4	-72.7	168.2	0	0	0	123.4
844	R	28.9	Very low	31	Very low	241 Å²	241	145.8 Å²	145.8	91%	0.909	78%	0.776	S	S	*	*			trans	84.5	141.4	148.4	-70.9	177.8	175.2	-178.9	-1.1	120.2
845	K	33.5	Very low	31.2	Very low	201 Å²	201	144.5 Å²	144.5	87%	0.874	77%	0.774	S	S	*	*			trans	-70.2	171.9	177.6	-61	-179.8	176.6	-178.2	0	111.5
846	P	39.8	Very low	31.3	Very low	124 Å²	124	142.3 Å²	142.3	81%	0.805	77%	0.772	S	S	*	*			cis	-142.2	174.9	14.2	43.2	-25.4	0	0	0	118.1
847	G	25	Very low	31.3	Very low	66 Å²	66	141.8 Å²	141.8	68%	0.68	77%	0.77	S	S	*	*			trans	99.5	127.2	136.2	0	0	0	0	0	120.2
848	N	27.8	Very low	31.3	Very low	159 Å²	159	144.5 Å²	144.5	85%	0.85	78%	0.775	S	S	*	*			trans	53.2	125.1	147.3	-60.9	12.1	0	0	0	122.9
849	I	31.8	Very low	32	Very low	158 Å²	158	141.4 Å²	141.4	81%	0.81	77%	0.771	S	S	*	*			trans	179.5	104.4	134.1	-89.6	151.5	0	0	0	103.6
850	E	32.3	Very low	32.1	Very low	158 Å²	158	137.1 Å²	137.1	74%	0.738	77%	0.765	S	S	*	*				58.5	99.3	85	-61.9	-161.1	141.5	0	0	112.6
851	L	32.7	Very low	32.5	Very low	145 Å²	145	137.9 Å²	137.9	76%	0.759	77%	0.767	S	S	*	*				79.4	134.6	103.3	-73.7	155.9	0	0	0	112.7
852	D	30.7	Very low	32.5	Very low	156 Å²	156	133.4 Å²	133.4	83%	0.834	76%	0.758	S	S	*	*			cis	-125.5	165.6	12.2	-81.2	-53.2	0	0	0	112.7
853	G	34.4	Very low	32.5	Very low	51 Å²	51	137 Å²	137	53%	0.526	76%	0.759	S	S	.	*			cis	165.7	145.3	-8	0	0	0	0	0	114.6
854	T	37.2	Very low	32.7	Very low	134 Å²	134	137.4 Å²	137.4	82%	0.822	76%	0.757	S	S	*	*			trans	65.6	143.9	164.1	69.5	0	0	0	0	118.9
855	L	35.5	Very low	32.8	Very low	148 Å²	148	131.2 Å²	131.2	78%	0.775	75%	0.746	S	S	*	*			cis	-161.1	176.4	-15.2	-101.4	172.9	0	0	0	105.1
856	T	33	Very low	32.6	Very low	116 Å²	116	128.9 Å²	128.9	71%	0.712	74%	0.743	S	S	*	*			cis	-164.2	155.3	9.7	2.8	0	0	0	0	104.8
857	L	28.7	Very low	32	Very low	143 Å²	143	127.9 Å²	127.9	75%	0.749	74%	0.738	S	S	*	*			cis	-159.9	-163.6	-14.7	-135.2	176.8	0	0	0	107.5
858	T	28.5	Very low	32.1	Very low	116 Å²	116	133.7 Å²	133.7	71%	0.712	74%	0.744	S	S	*	*			trans	-140.3	-158.2	-178.6	60.4	0	0	0	0	108.5
859	P	48.1	Very low	32.1	Very low	111 Å²	111	132.1 Å²	132.1	72%	0.721	74%	0.74	S	S	*	*			cis	-123.1	170.3	-2.8	14.7	14	0	0	0	114.1
860	A	33.6	Very low	32	Very low	85 Å²	85	135.9 Å²	135.9	70%	0.702	75%	0.745	S	S	*	*				67.8	144.2	57.5	0	0	0	0	0	113.4
861	T	32.4	Very low	31.8	Very low	133 Å²	133	135.6 Å²	135.6	82%	0.816	75%	0.748	S	S	*	*			cis	-175.7	165	8.9	12	0	0	0	0	107.5
862	S	32	Very low	32.4	Very low	85 Å²	85	133.8 Å²	133.8	59%	0.594	75%	0.745	S	S	*	*			cis	-178.9	-166	-18.8	52.3	0	0	0	0	110
863	Y	29.5	Very low	32.3	Very low	195 Å²	195	131.3 Å²	131.3	77%	0.765	74%	0.74	S	S	*	*			trans	87.2	131.9	161.9	-72.4	-70.6	0	0	0	123.2
864	Q	32	Very low	32.1	Very low	160 Å²	160	133.6 Å²	133.6	75%	0.748	75%	0.748	S	S	*	*			trans	59.5	146.4	133	-80.3	168.9	-9.7	0	0	123
865	T	30.3	Very low	31.6	Very low	111 Å²	111	131.6 Å²	131.6	68%	0.681	74%	0.739	S	S	*	*			cis	-168.3	164.2	-21.3	7.9	0	0	0	0	112.7
866	L	28.7	Very low	31.3	Very low	152 Å²	152	129.8 Å²	129.8	80%	0.796	74%	0.739	S	S	*	*			trans	83.7	155.9	141.9	-84.9	164.5	0	0	0	123.3
867	C	27.4	Very low	31.1	Very low	104 Å²	104	129 Å²	129	70%	0.703	74%	0.738	S	S	*	*			trans	71.2	117.5	174.9	-65.5	0	0	0	0	117
868	K	28	Very low	31	Very low	187 Å²	187	126.3 Å²	126.3	81%	0.813	73%	0.731	S	S	*	*				68.5	130.5	63	-70.3	-169.3	175.2	-178.1	0	111.9
869	T	27.5	Very low	31	Very low	126 Å²	126	128.5 Å²	128.5	77%	0.773	74%	0.738	S	S	*	*			cis	-164.9	178.1	10.8	1.9	0	0	0	0	111.7
870	R	28.7	Very low	30.1	Very low	238 Å²	238	127.7 Å²	127.7	90%	0.898	74%	0.735	S	S	*	*			trans	82.7	100.8	155.4	-89.1	-179.6	166.8	145.3	-3.8	120.4
871	N	29.3	Very low	29.9	Very low	152 Å²	152	130.7 Å²	130.7	81%	0.813	73%	0.734	S	S	*	*				-49.9	166.7	128.2	-82.2	-0.7	0	0	0	111.7
872	P	45	Very low	29.7	Very low	107 Å²	107	133 Å²	133	70%	0.695	73%	0.733	S	S	*	*			cis	-145.1	-175.3	30.6	36.4	-13	0	0	0	117.6
873	S	28.7	Very low	29.4	Very low	104 Å²	104	132.9 Å²	132.9	73%	0.727	73%	0.732	S	S	*	*			trans	56.4	142.1	142.7	56.6	0	0	0	0	121.2
874	S	29.4	Very low	29.4	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	73%	0.731	S	S	*	*			cis	-172.4	175.5	-6.9	49.7	0	0	0	0	111.1
875	S	27.8	Very low	29.1	Very low	91 Å²	91	129.1 Å²	129.1	64%	0.636	73%	0.734	S	S	*	*			trans	63.4	129.2	139.2	58.8	0	0	0	0	122
876	S	28.1	Very low	29.1	Very low	111 Å²	111	134 Å²	134	78%	0.776	75%	0.746	S	S	*	*			trans	68.1	142.6	141.2	52	0	0	0	0	120.5
877	S	28.6	Very low	29	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	75%	0.748	S	S	*	*			cis	-169.4	172.9	-11.7	50.7	0	0	0	0	112.3
878	S	27	Very low	29	Very low	86 Å²	86	139.2 Å²	139.2	60%	0.601	75%	0.751	S	S	*	*			trans	62	121.2	137.1	61.1	0	0	0	0	122.1
879	L	29	Very low	29	Very low	162 Å²	162	139.1 Å²	139.1	85%	0.848	75%	0.751	S	S	*	*				65.4	147.5	128.9	-63	168.7	0	0	0	118.9
880	S	29	Very low	28.9	Very low	94 Å²	94	141 Å²	141	66%	0.657	76%	0.755	S	S	*	*			cis	-164.7	159.1	-2.6	41.2	0	0	0	0	112.9
881	H	29.8	Very low	29	Very low	148 Å²	148	137.3 Å²	137.3	69%	0.685	75%	0.748	S	S	*	*			trans	39.2	140.4	141.9	-77.9	-95.6	0	0	0	124.8
882	F	27	Very low	29.5	Very low	182 Å²	182	134.9 Å²	134.9	80%	0.798	74%	0.74	S	S	*	*			trans	67.8	156.5	153.4	-62.7	-55.8	0	0	0	119.2
883	S	27.4	Very low	28.7	Very low	83 Å²	83	137.9 Å²	137.9	58%	0.58	75%	0.745	S	S	*	*			cis	-171.2	164.4	-39.1	55	0	0	0	0	112.9
884	T	28.2	Very low	28.7	Very low	121 Å²	121	137.4 Å²	137.4	74%	0.742	74%	0.742	S	S	*	*			trans	75.5	162.4	158.6	75.5	0	0	0	0	121.2
885	L	26.5	Very low	28.7	Very low	154 Å²	154	140.5 Å²	140.5	81%	0.806	75%	0.745	S	S	*	*			trans	69.7	101	157.8	-69.4	164.3	0	0	0	119.6
886	K	29.2	Very low	28.8	Very low	213 Å²	213	144.7 Å²	144.7	93%	0.926	76%	0.755	S	S	*	*				-162	174.9	94.2	-107.6	165.1	-174	170.2	0	114.5
887	R	26.9	Very low	28.8	Very low	221 Å²	221	145.2 Å²	145.2	83%	0.834	76%	0.758	S	S	*	*			trans	-137.8	125.1	-159.9	170.8	-169.1	-169.4	168.8	4.1	109.5
888	N	27.3	Very low	28.7	Very low	145 Å²	145	151.9 Å²	151.9	78%	0.775	77%	0.768	S	S	*	*			trans	174.6	125.6	144	-86.1	-19.9	0	0	0	107.6
889	K	27.9	Very low	29.4	Very low	185 Å²	185	153 Å²	153	80%	0.804	77%	0.774	S	S	*	*				83.4	99.2	53.4	-160.6	-170.2	-167.4	-165.4	0	112.6
890	L	26.8	Very low	29.3	Very low	167 Å²	167	153.1 Å²	153.1	87%	0.874	77%	0.77	S	S	*	*				-156.9	147.5	121.4	-129.2	76.4	0	0	0	111.1
891	H	29.2	Very low	29.2	Very low	160 Å²	160	158.9 Å²	158.9	74%	0.741	78%	0.777	S	S	*	*			trans	-124.6	162.2	167.9	-123.7	-44.7	0	0	0	106.6
892	P	40.3	Very low	29.1	Very low	100 Å²	100	156.5 Å²	156.5	65%	0.649	78%	0.777	S	S	*	*				-119.6	162.2	85.5	1	22.1	0	0	0	111.7
893	E	29.1	Very low	29.1	Very low	170 Å²	170	154.2 Å²	154.2	79%	0.794	78%	0.778	S	S	*	*				63.7	137.3	56.3	-52.7	168.4	174	0	0	112.8
894	S	28.4	Very low	29.3	Very low	94 Å²	94	154.8 Å²	154.8	66%	0.657	78%	0.782	S	S	*	*			cis	-165.8	-178.4	-20.6	70.3	0	0	0	0	108.4
895	E	29.6	Very low	29.4	Very low	165 Å²	165	158 Å²	158	77%	0.771	79%	0.789	S	S	*	*			cis	-163.2	170.8	-1	-132.4	146.8	162.5	0	0	111.6
896	E	29.1	Very low	29.5	Very low	179 Å²	179	154.6 Å²	154.6	84%	0.836	78%	0.783	S	S	*	*			trans	53.3	156	156.9	-66.1	-147.7	124.6	0	0	125.8
897	S	27.6	Very low	29.6	Very low	121 Å²	121	151.1 Å²	151.1	85%	0.846	78%	0.779	S	S	*	*			trans	97.3	135.9	154.4	79.2	0	0	0	0	122
898	R	27.5	Very low	29.7	Very low	239 Å²	239	146.9 Å²	146.9	90%	0.902	77%	0.773	S	S	*	*			trans	-110.5	170.3	160.2	-73.6	179.2	167.8	-177.7	-3.3	106.6
899	P	41.8	Very low	29.8	Very low	110 Å²	110	150.8 Å²	150.8	71%	0.714	78%	0.776	S	S	*	*			cis	-148.1	-174.1	20.6	45.5	-25.3	0	0	0	118.2
900	Q	26.9	Very low	29.9	Very low	165 Å²	165	152.9 Å²	152.9	77%	0.771	78%	0.78	S	S	*	*			trans	69.3	130.3	149.5	-79.5	-172.1	13.5	0	0	124.5
901	R	27.1	Very low	30.7	Very low	215 Å²	215	150.8 Å²	150.8	81%	0.811	78%	0.776	S	S	*	*			trans	62.5	106.3	138.4	-72.5	-174.2	169.6	-176.8	-1.9	122.8
902	S	27.7	Very low	30.8	Very low	97 Å²	97	152.6 Å²	152.6	68%	0.678	78%	0.781	S	S	*	*				87.6	139.6	118.8	74.2	0	0	0	0	122.5
903	T	27.5	Very low	30.4	Very low	134 Å²	134	154.2 Å²	154.2	82%	0.822	79%	0.79	S	S	*	*			trans	68.1	153.1	168.3	71.8	0	0	0	0	118.4
904	S	30.8	Very low	30.6	Very low	95 Å²	95	151.1 Å²	151.1	66%	0.664	79%	0.787	S	S	*	*			cis	-166.5	153	-41.3	57.6	0	0	0	0	110.1
905	Q	30.1	Very low	30.9	Very low	189 Å²	189	155 Å²	155	88%	0.883	80%	0.8	S	S	*	*			trans	66.5	154.1	168	-58.7	-177.6	11.6	0	0	117.8
906	A	28.9	Very low	31.4	Very low	82 Å²	82	150.2 Å²	150.2	68%	0.678	80%	0.795	S	S	*	*			cis	-168.7	140.4	-26.3	0	0	0	0	0	111.7
907	T	30.6	Very low	31.9	Very low	140 Å²	140	150.8 Å²	150.8	86%	0.859	80%	0.798	S	S	*	*			trans	179.7	153.7	149.8	38.1	0	0	0	0	109.7
908	L	28.7	Very low	32.5	Very low	133 Å²	133	153.4 Å²	153.4	70%	0.696	80%	0.797	S	S	*	*			cis	173.7	107.9	-44.3	-115.3	170.7	0	0	0	107.6
909	R	29.6	Very low	33.3	Very low	226 Å²	226	148.1 Å²	148.1	85%	0.853	79%	0.786	S	S	*	*			trans	68.1	154	164.6	-64.7	166.4	-179.4	171	0.2	116.1
910	R	30.7	Very low	33.4	Very low	230 Å²	230	146.4 Å²	146.4	87%	0.868	78%	0.782	S	S	*	*			cis	-155.2	178.8	9.1	-126.4	173.3	179.4	-179.8	0.1	107.1
911	P	43.9	Very low	34.4	Very low	123 Å²	123	146.6 Å²	146.6	80%	0.799	78%	0.782	S	S	*	*			cis	-128.3	-155.6	1.9	42.4	-23.2	0	0	0	114.9
912	K	31.3	Very low	35.2	Very low	197 Å²	197	142.7 Å²	142.7	86%	0.857	77%	0.773	S	S	*	*			trans	-115.6	150.2	-176.6	-77.5	-172.7	170.8	-167.4	0	113
913	T	31.5	Very low	36.2	Very low	134 Å²	134	143.6 Å²	143.6	82%	0.822	77%	0.767	S	S	*	*			trans	-142.7	110.4	137.9	43.8	0	0	0	0	106
914	S	34	Very low	37.2	Very low	106 Å²	106	143.7 Å²	143.7	74%	0.741	76%	0.758	S	S	*	*				85.2	70.1	62.4	72.7	0	0	0	0	113.8
915	D	34.8	Very low	37.9	Very low	175 Å²	175	145.6 Å²	145.6	94%	0.936	76%	0.758	S	S	*	*			trans	-148.4	163.9	142.8	-145.1	-26.5	0	0	0	109.6
916	G	38.4	Very low	38.6	Very low	64 Å²	64	141.2 Å²	141.2	66%	0.66	74%	0.74	S	S	*	*			trans	121.6	97.5	174.5	0	0	0	0	0	115.1
917	Q	39.9	Very low	39.4	Very low	191 Å²	191	145.8 Å²	145.8	89%	0.893	74%	0.74	S	S	*	*			trans	-151	47.2	171.5	-156.1	167.7	-9.5	0	0	113.7
918	Q	41	Very low	40.2	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	72%	0.721	S	S	*	*	S	Bend	trans	-130.5	-33.6	169.2	-74.1	-169.2	-28.3	0	0	114.6	A920	Q918-A920 PolarHBondContact O-N 3.42Å; Q918-A920 VanDerWaalsContact O-N 3.12Å
919	D	44.3	Very low	40.9	Very low	127 Å²	127	142.1 Å²	142.1	68%	0.679	72%	0.715	S	S	*	*	H	α-helix	trans	-66.8	-16	-177.2	-61.8	-65.5	0	0	0	115.7
920	A	44.4	Very low	41.7	Very low	75 Å²	75	135.7 Å²	135.7	62%	0.62	70%	0.701	S	S	*	*	H	α-helix	trans	-68.6	-36.3	-172.1	0	0	0	0	0	113.7	Q918	Q918-A920 PolarHBondContact O-N 3.42Å; Q918-A920 VanDerWaalsContact O-N 3.12Å
921	E	47.5	Very low	42.1	Very low	168 Å²	168	134.3 Å²	134.3	79%	0.785	70%	0.696	S	S	*	*	H	α-helix	trans	-79.9	-36.9	-175.8	-60.1	-166.2	149.9	0	0	111.8	Q923 Q924 M925	E921-Q923 PolarHBondContact O-N 3.08Å; E921-Q924 PolarHBondContact O-N 3.39Å; E921-Q924 VanDerWaalsContact O-N 3.15Å; E921-M925 PolarHBondContact O-N 2.7Å; E921-M925 VanDerWaalsContact O-N 3.16Å
922	H	43.4	Very low	42.1	Very low	134 Å²	134	134.7 Å²	134.7	62%	0.62	69%	0.69	S	S	*	*	H	α-helix	trans	-64.4	-41	-179.2	-154.3	78.1	0	0	0	112.1	Q924 M925 L926	H922-Q924 VanDerWaalsContact C-N 3.29Å; H922-Q924 PolarHBondContact O-N 3.3Å; H922-M925 PolarHBondContact O-N 3.44Å; H922-L926 PolarHBondContact O-N 3.31Å
923	Q	48.1	Very low	42.4	Very low	116 Å²	116	128.7 Å²	128.7	54%	0.542	67%	0.673	S	S	.	*	H	α-helix	trans	-68.4	-26	175.5	-66.5	-165.8	10.2	0	0	113.5	E921 R927	E921-Q923 PolarHBondContact O-N 3.08Å; Q923-R927 WeakPolarHBondContact O-CG 3.26Å; Q923-R927 PolarHBondContact O-N 2.9Å
924	Q	49.6	Very low	42.8	Very low	135 Å²	135	130.1 Å²	130.1	63%	0.631	67%	0.672	S	S	*	*	H	α-helix	trans	-77.2	-33.6	177.5	-168.4	144.3	-53.6	0	0	112	E921 H922 R927 N928	E921-Q924 PolarHBondContact O-N 3.39Å; E921-Q924 VanDerWaalsContact O-N 3.15Å; H922-Q924 VanDerWaalsContact C-N 3.29Å; H922-Q924 PolarHBondContact O-N 3.3Å; Q924-R927 PolarHBondContact O-N 2.98Å; Q924-N928 PolarHBondContact O-N 3.49Å
925	M	44.2	Very low	43.1	Very low	135 Å²	135	129.1 Å²	129.1	67%	0.665	67%	0.67	S	S	*	*	H	α-helix	trans	-63.5	-45.8	173.2	-161.5	176.6	-130.9	0	0	111.7	E921 H922 R927 N928 L929	E921-M925 PolarHBondContact O-N 2.7Å; E921-M925 VanDerWaalsContact O-N 3.16Å; H922-M925 PolarHBondContact O-N 3.44Å; M925-R927 PolarHBondContact O-N 2.79Å; M925-N928 PolarHBondContact O-N 3.41Å; M925-L929 PolarHBondContact O-N 2.63Å; M925-L929 VanDerWaalsContact O-N 3.13Å
926	L	45.9	Very low	43.4	Very low	97 Å²	97	124.2 Å²	124.2	51%	0.508	65%	0.654	S	S	.	*	H	α-helix	trans	-61.4	-40.5	176.9	-77.6	162.3	0	0	0	113	H922 N928 L929 V930	H922-L926 PolarHBondContact O-N 3.31Å; L926-N928 VanDerWaalsContact C-N 3.27Å; L926-N928 PolarHBondContact O-N 2.83Å; L926-L929 PolarHBondContact O-N 3.05Å; L926-V930 WeakPolarHBondContact O-CG2 3.45Å; L926-V930 PolarHBondContact O-N 3.13Å; L926-V930 VanDerWaalsContact O-N 3.12Å
927	R	45.4	Very low	43.5	Very low	178 Å²	178	130.7 Å²	130.7	67%	0.672	67%	0.665	S	S	*	*	H	α-helix	trans	-67	-25.6	177.1	-73.2	179.1	-174.4	-153.6	2.4	113.7	Q923 Q924 M925 R931	Q923-R927 WeakPolarHBondContact O-CG 3.26Å; Q923-R927 PolarHBondContact O-N 2.9Å; Q924-R927 PolarHBondContact O-N 2.98Å; M925-R927 PolarHBondContact O-N 2.79Å; R927-R931 PolarHBondContact O-N 3.2Å
928	N	47.6	Very low	43.1	Very low	88 Å²	88	124.9 Å²	124.9	47%	0.471	66%	0.656	S	S	.	*	H	α-helix	trans	-79.5	-38	174.3	-71.7	-18.3	0	0	0	111.9	Q924 M925 L926 R931 L932	Q924-N928 PolarHBondContact O-N 3.49Å; M925-N928 PolarHBondContact O-N 3.41Å; L926-N928 VanDerWaalsContact C-N 3.27Å; L926-N928 PolarHBondContact O-N 2.83Å; N928-R931 PolarHBondContact O-N 3.25Å; N928-L932 PolarHBondContact O-N 3.21Å; N928-L932 VanDerWaalsContact O-N 3.15Å
929	L	42.7	Very low	42.7	Very low	108 Å²	108	123.7 Å²	123.7	57%	0.565	66%	0.655	S	S	*	*	H	α-helix	trans	-59.5	-44.7	172.7	-90.4	159.4	0	0	0	112.4	M925 L926 R931 L932 S933	M925-L929 PolarHBondContact O-N 2.63Å; M925-L929 VanDerWaalsContact O-N 3.13Å; L926-L929 PolarHBondContact O-N 3.05Å; L929-R931 VanDerWaalsContact C-N 3.26Å; L929-R931 PolarHBondContact O-N 3Å; L929-L932 PolarHBondContact O-N 3.42Å; L929-L932 VanDerWaalsContact O-N 3.14Å; L929-S933 PolarHBondContact O-N 2.9Å
930	V	46.8	Very low	42.2	Very low	91 Å²	91	123.6 Å²	123.6	55%	0.552	66%	0.659	S	S	*	*	H	α-helix	trans	-67.8	-24.3	177.5	176.1	0	0	0	0	112.7	L926 S933	L926-V930 WeakPolarHBondContact O-CG2 3.45Å; L926-V930 PolarHBondContact O-N 3.13Å; L926-V930 VanDerWaalsContact O-N 3.12Å; V930-S933 PolarHBondContact O-OG 2.9Å
931	R	40.1	Very low	41.4	Very low	202 Å²	202	128 Å²	128	76%	0.762	67%	0.671	S	S	*	*	H	α-helix	trans	-77.1	-27.4	171.7	-88.7	-179	164.2	165	-4.6	113.7	R927 N928 L929	R927-R931 PolarHBondContact O-N 3.2Å; N928-R931 PolarHBondContact O-N 3.25Å; L929-R931 VanDerWaalsContact C-N 3.26Å; L929-R931 PolarHBondContact O-N 3Å
932	L	42.3	Very low	40.6	Very low	131 Å²	131	128 Å²	128	69%	0.686	67%	0.671	S	S	*	*	H	α-helix	trans	-76.2	-33.6	177.2	-91.8	153.8	0	0	0	112.7	N928 L929	N928-L932 PolarHBondContact O-N 3.21Å; N928-L932 VanDerWaalsContact O-N 3.15Å; L929-L932 PolarHBondContact O-N 3.42Å; L929-L932 VanDerWaalsContact O-N 3.14Å
933	S	39	Very low	40	Very low	71 Å²	71	129.1 Å²	129.1	50%	0.497	68%	0.681	S	S	.	*	H	α-helix	trans	-71.9	-34.2	179.9	56.7	0	0	0	0	113.9	L929 V930 A935	L929-S933 PolarHBondContact O-N 2.9Å; V930-S933 PolarHBondContact O-OG 2.9Å; S933-A935 VanDerWaalsContact C-N 3.31Å; S933-A935 PolarHBondContact O-N 3.33Å
934	M	39.8	Very low	39.1	Very low	163 Å²	163	129.6 Å²	129.6	80%	0.803	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-4.5	-178.5	-59.9	-159.6	80.5	0	0	114.6
935	A	40.3	Very low	38.5	Very low	85 Å²	85	128.5 Å²	128.5	70%	0.702	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-2.9	176.5	0	0	0	0	0	113.8	S933	S933-A935 VanDerWaalsContact C-N 3.31Å; S933-A935 PolarHBondContact O-N 3.33Å
936	A	40.4	Very low	38.3	Very low	73 Å²	73	126.6 Å²	126.6	60%	0.603	71%	0.709	S	S	*	*	S	Bend	trans	-96.9	-0.8	-169.1	0	0	0	0	0	115.5
937	F	40.5	Very low	38.2	Very low	200 Å²	200	124.4 Å²	124.4	88%	0.877	70%	0.702	S	S	*	*	S	Bend	trans	-129.8	70.4	-175.3	-74.2	-82	0	0	0	111.7
938	G	31.2	Very low	38.4	Very low	68 Å²	68	119.6 Å²	119.6	70%	0.701	69%	0.694	S	S	*	*			trans	-157.1	108.2	174.8	0	0	0	0	0	113.1
939	D	32.4	Very low	38.6	Very low	152 Å²	152	120.6 Å²	120.6	81%	0.813	70%	0.696	S	S	*	*			trans	38.2	105.4	157.3	-58.9	-11.9	0	0	0	121.7
940	T	33.9	Very low	39	Very low	126 Å²	126	120.2 Å²	120.2	77%	0.773	70%	0.698	S	S	*	*			trans	41.1	118.1	134.9	63.1	0	0	0	0	121.3
941	I	29.4	Very low	39.2	Very low	168 Å²	168	122.1 Å²	122.1	86%	0.862	70%	0.701	S	S	*	*				-176.2	172	113.4	-94.5	162.7	0	0	0	110.7
942	E	29.8	Very low	39.7	Very low	167 Å²	167	119.3 Å²	119.3	78%	0.78	70%	0.696	S	S	*	*			trans	-76.9	151.5	-157	-53.6	177.1	125.9	0	0	117.9
943	L	30.4	Very low	40.2	Very low	158 Å²	158	118.1 Å²	118.1	83%	0.827	69%	0.69	S	S	*	*			trans	45.5	106.5	141.8	-67.4	165.3	0	0	0	120.2
944	S	29.6	Very low	40.6	Very low	125 Å²	125	118.5 Å²	118.5	87%	0.874	69%	0.692	S	S	*	*				-170.9	161.5	113.3	37.7	0	0	0	0	114.5
945	S	36.7	Very low	41.2	Very low	113 Å²	113	117.1 Å²	117.1	79%	0.79	68%	0.684	S	S	*	*			trans	-48.8	144.3	-169.2	50.3	0	0	0	0	121.2
946	A	39.5	Very low	41.6	Very low	94 Å²	94	118.7 Å²	118.7	78%	0.777	68%	0.68	S	S	*	*			trans	89.6	103.1	136.4	0	0	0	0	0	121.2
947	S	44.6	Very low	41.9	Very low	51 Å²	51	120.3 Å²	120.3	36%	0.357	68%	0.677	S	S	.	*			trans	-121.6	152.8	134.7	98.5	0	0	0	0	109.1	E949	S947-E949 VanDerWaalsContact CB-OE2 3.23Å; S947-E949 WeakPolarHBondContact CB-OE2 3.23Å; S947-E949 PolarHBondContact OG-OE2 2.87Å
948	P	50	Low	42.5	Very low	77 Å²	77	113.5 Å²	113.5	50%	0.5	66%	0.655	S	S	.	*	H	α-helix	trans	-73.7	-26.5	-174.7	28.7	-34.6	0	0	0	114.1	V950 Q951 Q952	P948-V950 VanDerWaalsContact C-N 3.34Å; P948-V950 PolarHBondContact O-N 2.88Å; P948-Q951 PolarHBondContact O-N 3.42Å; P948-Q952 PolarHBondContact O-N 2.81Å
949	E	50.3	Low	43.4	Very low	109 Å²	109	114.8 Å²	114.8	51%	0.509	65%	0.645	S	S	.	*	H	α-helix	trans	-64.1	-40.2	-178.4	-55.9	75.2	-162.1	0	0	111.3	S947 Q951 Q952 I953	S947-E949 VanDerWaalsContact CB-OE2 3.23Å; S947-E949 WeakPolarHBondContact CB-OE2 3.23Å; S947-E949 PolarHBondContact OG-OE2 2.87Å; E949-Q951 VanDerWaalsContact C-N 3.28Å; E949-Q951 PolarHBondContact O-N 2.91Å; E949-Q952 PolarHBondContact O-N 3.41Å; E949-I953 WeakPolarHBondContact O-CG1 3.32Å; E949-I953 PolarHBondContact O-N 2.76Å; E949-I953 VanDerWaalsContact O-N 3.12Å
950	V	53.1	Low	44.1	Very low	100 Å²	100	113.8 Å²	113.8	61%	0.606	64%	0.639	S	S	*	*	H	α-helix	trans	-65.6	-32.8	178	-177.6	0	0	0	0	111.4	P948 S954	P948-V950 VanDerWaalsContact C-N 3.34Å; P948-V950 PolarHBondContact O-N 2.88Å; V950-S954 WeakPolarHBondContact O-CB 3.26Å; V950-S954 PolarHBondContact O-N 3Å
951	Q	49.8	Very low	44.5	Very low	132 Å²	132	119 Å²	119	62%	0.617	64%	0.644	S	S	*	*	H	α-helix	trans	-69	-41	175.3	-70.4	-172	-28.3	0	0	112	P948 E949 S954 Q955	P948-Q951 PolarHBondContact O-N 3.42Å; E949-Q951 VanDerWaalsContact C-N 3.28Å; E949-Q951 PolarHBondContact O-N 2.91Å; Q951-S954 PolarHBondContact O-N 3.02Å; Q951-Q955 WeakPolarHBondContact O-CB 3.21Å; Q951-Q955 PolarHBondContact O-N 2.84Å
952	Q	50.8	Low	45.6	Very low	142 Å²	142	117.5 Å²	117.5	66%	0.664	63%	0.634	S	S	*	*	H	α-helix	trans	-64.3	-43.3	177.2	-68.8	-175.4	-11.2	0	0	112.1	P948 E949 Q955 L956	P948-Q952 PolarHBondContact O-N 2.81Å; E949-Q952 PolarHBondContact O-N 3.41Å; Q952-Q955 PolarHBondContact O-N 3.07Å; Q952-L956 WeakPolarHBondContact O-CB 3.44Å; Q952-L956 PolarHBondContact O-N 3.04Å
953	I	53.6	Low	46.5	Very low	107 Å²	107	112.6 Å²	112.6	55%	0.549	63%	0.629	S	S	.	*	H	α-helix	trans	-66	-41.8	177.4	-64.7	169.2	0	0	0	110.9	E949 Q955 L956 L957	E949-I953 WeakPolarHBondContact O-CG1 3.32Å; E949-I953 PolarHBondContact O-N 2.76Å; E949-I953 VanDerWaalsContact O-N 3.12Å; I953-Q955 PolarHBondContact O-N 3.3Å; I953-L956 PolarHBondContact O-N 2.7Å; I953-L957 HydrophobicContact CG2-CD1 3.97Å; I953-L957 WeakPolarHBondContact O-CB 3.44Å; I953-L957 WeakPolarHBondContact O-CG 3.25Å; I953-L957 PolarHBondContact O-N 2.75Å
954	S	47.5	Very low	47.5	Very low	78 Å²	78	112.4 Å²	112.4	55%	0.545	62%	0.623	S	S	.	*	H	α-helix	trans	-59.5	-43.9	173.7	-179.8	0	0	0	0	112.3	V950 Q951 L957 S958	V950-S954 WeakPolarHBondContact O-CB 3.26Å; V950-S954 PolarHBondContact O-N 3Å; Q951-S954 PolarHBondContact O-N 3.02Å; S954-L957 PolarHBondContact O-N 2.76Å; S954-S958 WeakPolarHBondContact O-CB 3.32Å; S954-S958 PolarHBondContact O-N 2.93Å
955	Q	52.1	Low	48	Very low	135 Å²	135	114.2 Å²	114.2	63%	0.631	62%	0.622	S	S	*	*	H	α-helix	trans	-67.7	-38.5	-179.9	-165.7	168.8	12	0	0	112.2	Q951 Q952 I953 S958 L959	Q951-Q955 WeakPolarHBondContact O-CB 3.21Å; Q951-Q955 PolarHBondContact O-N 2.84Å; Q952-Q955 PolarHBondContact O-N 3.07Å; I953-Q955 PolarHBondContact O-N 3.3Å; Q955-S958 PolarHBondContact O-N 3.32Å; Q955-L959 WeakPolarHBondContact O-CG 3.33Å; Q955-L959 PolarHBondContact O-N 2.95Å
956	L	47.2	Very low	47.9	Very low	118 Å²	118	117.4 Å²	117.4	62%	0.618	63%	0.625	S	S	*	*	H	α-helix	trans	-65.3	-44.2	175	-163.2	75.1	0	0	0	112	Q952 I953 S958 L959 L960	Q952-L956 WeakPolarHBondContact O-CB 3.44Å; Q952-L956 PolarHBondContact O-N 3.04Å; I953-L956 PolarHBondContact O-N 2.7Å; L956-S958 VanDerWaalsContact C-N 3.35Å; L956-L959 PolarHBondContact O-N 3.06Å; L956-L960 PolarHBondContact O-N 3.2Å
957	L	48.4	Very low	48.1	Very low	106 Å²	106	118.2 Å²	118.2	56%	0.555	62%	0.622	S	S	*	*	H	α-helix	trans	-67.5	-33.8	176.3	-73.4	168.6	0	0	0	112.5	I953 S954 L960 R961	I953-L957 HydrophobicContact CG2-CD1 3.97Å; I953-L957 WeakPolarHBondContact O-CB 3.44Å; I953-L957 WeakPolarHBondContact O-CG 3.25Å; I953-L957 PolarHBondContact O-N 2.75Å; S954-L957 PolarHBondContact O-N 2.76Å; L957-L960 PolarHBondContact O-N 3.12Å; L957-R961 WeakPolarHBondContact O-CB 3.3Å; L957-R961 PolarHBondContact O-N 2.96Å
958	S	51.6	Low	47.2	Very low	57 Å²	57	127.5 Å²	127.5	40%	0.399	65%	0.649	S	S	.	*	H	α-helix	trans	-62.3	-44.8	174.7	-171.4	0	0	0	0	112	S954 Q955 L956 R961 Q962	S954-S958 WeakPolarHBondContact O-CB 3.32Å; S954-S958 PolarHBondContact O-N 2.93Å; Q955-S958 PolarHBondContact O-N 3.32Å; L956-S958 VanDerWaalsContact C-N 3.35Å; S958-R961 PolarHBondContact O-N 3.46Å; S958-Q962 PolarHBondContact O-N 3.22Å; S958-Q962 VanDerWaalsContact O-N 3.16Å
959	L	50.9	Low	46.6	Very low	96 Å²	96	129.6 Å²	129.6	50%	0.503	66%	0.661	S	S	.	*	H	α-helix	trans	-63	-43.1	177.5	-71	167.4	0	0	0	112.1	Q955 L956 R961 Q962	Q955-L959 WeakPolarHBondContact O-CG 3.33Å; Q955-L959 PolarHBondContact O-N 2.95Å; L956-L959 PolarHBondContact O-N 3.06Å; L959-R961 VanDerWaalsContact C-N 3.32Å; L959-R961 PolarHBondContact O-N 3.42Å; L959-Q962 PolarHBondContact O-N 3.42Å
960	L	47.1	Very low	45.6	Very low	131 Å²	131	131.4 Å²	131.4	69%	0.686	67%	0.674	S	S	*	*	H	α-helix	trans	-61.4	-38.3	173.7	-80.8	162.9	0	0	0	112.4	L956 L957 Q962 G963	L956-L960 PolarHBondContact O-N 3.2Å; L957-L960 PolarHBondContact O-N 3.12Å; L960-Q962 VanDerWaalsContact C-N 3.31Å; L960-Q962 PolarHBondContact O-N 3.05Å; L960-G963 PolarHBondContact O-N 3.14Å
961	R	42.3	Very low	44.4	Very low	234 Å²	234	137 Å²	137	88%	0.883	69%	0.691	S	S	*	*	H	α-helix	trans	-75.9	-15.2	-178.7	-145.1	178.3	-162.9	-155.5	5.2	114.2	L957 S958 L959	L957-R961 WeakPolarHBondContact O-CB 3.3Å; L957-R961 PolarHBondContact O-N 2.96Å; S958-R961 PolarHBondContact O-N 3.46Å; L959-R961 VanDerWaalsContact C-N 3.32Å; L959-R961 PolarHBondContact O-N 3.42Å
962	Q	51.7	Low	43.4	Very low	137 Å²	137	142.7 Å²	142.7	64%	0.64	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	2.9	175.1	-70.5	-173.9	-1	0	0	113.9	S958 L959 L960 Q964	S958-Q962 PolarHBondContact O-N 3.22Å; S958-Q962 VanDerWaalsContact O-N 3.16Å; L959-Q962 PolarHBondContact O-N 3.42Å; L960-Q962 VanDerWaalsContact C-N 3.31Å; L960-Q962 PolarHBondContact O-N 3.05Å; Q962-Q964 PolarHBondContact O-N 3.36Å
963	G	49.1	Very low	42.3	Very low	65 Å²	65	138.6 Å²	138.6	67%	0.67	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	73	6.3	170.8	0	0	0	0	0	115.7	L960 L965	L960-G963 PolarHBondContact O-N 3.14Å; G963-L965 VanDerWaalsContact C-N 3.35Å; G963-L965 PolarHBondContact O-N 3.4Å; G963-L965 VanDerWaalsContact O-N 3.12Å
964	Q	51.3	Low	41.2	Very low	153 Å²	153	140.3 Å²	140.3	72%	0.715	71%	0.712	S	S	*	*			trans	-85.2	70.3	175.9	-70.2	-165.8	-14.4	0	0	111.9	Q962	Q962-Q964 PolarHBondContact O-N 3.36Å
965	L	39.8	Very low	40.4	Very low	163 Å²	163	143.3 Å²	143.3	85%	0.853	72%	0.715	S	S	*	*			trans	178.4	104.6	148.8	-100	159.6	0	0	0	111.7	G963	G963-L965 VanDerWaalsContact C-N 3.35Å; G963-L965 PolarHBondContact O-N 3.4Å; G963-L965 VanDerWaalsContact O-N 3.12Å
966	Q	35.9	Very low	39.4	Very low	181 Å²	181	146 Å²	146	85%	0.846	72%	0.721	S	S	*	*			trans	-141.1	151.3	160.7	-92	-77.9	-37.8	0	0	107.5
967	P	43.6	Very low	38.5	Very low	110 Å²	110	144.5 Å²	144.5	71%	0.714	72%	0.72	S	S	*	*			trans	-86.3	152.2	-148.5	32.5	-35.7	0	0	0	114.6
968	R	26.2	Very low	37.5	Very low	247 Å²	247	148.3 Å²	148.3	93%	0.932	74%	0.735	S	S	*	*			trans	-134.2	133.3	158.2	-81.4	-168.4	167.5	-173.7	-3.3	111.2
969	T	37.2	Very low	36.4	Very low	121 Å²	121	156.2 Å²	156.2	74%	0.742	76%	0.756	S	S	*	*			trans	-81.3	167.4	168.1	45.8	0	0	0	0	111.2
970	N	28.5	Very low	35.3	Very low	146 Å²	146	159.2 Å²	159.2	78%	0.781	77%	0.773	S	S	*	*			trans	78.3	108.7	172.3	-50.7	-39.3	0	0	0	117.3
971	F	27.9	Very low	34.4	Very low	219 Å²	219	156.9 Å²	156.9	96%	0.961	78%	0.78	S	S	*	*			trans	-115.6	120.2	137.4	-119.6	-91.6	0	0	0	107.9
972	R	28.2	Very low	33.7	Very low	251 Å²	251	155.8 Å²	155.8	95%	0.947	78%	0.776	S	S	*	*			trans	-149.7	132.3	171.7	-167	-177.6	-171.9	-155.8	3.3	111.1
973	G	28.4	Very low	32.5	Very low	55 Å²	55	159.5 Å²	159.5	57%	0.567	79%	0.786	S	S	*	*			trans	128.7	148.3	174.7	0	0	0	0	0	110.9
974	N	30.8	Very low	31.4	Very low	144 Å²	144	160.2 Å²	160.2	77%	0.77	79%	0.793	S	S	*	*			cis	-170.2	150.6	3.3	-117.9	-23.9	0	0	0	106.2
975	K	30.9	Very low	30.2	Very low	141 Å²	141	156.3 Å²	156.3	61%	0.613	79%	0.794	S	S	*	*			cis	-177.7	171.9	43.2	-102.4	150.4	179.6	-154.1	0	106.8
976	Y	31.1	Very low	29.8	Very low	191 Å²	191	156.9 Å²	156.9	75%	0.749	79%	0.792	S	S	*	*			cis	-152.1	167.4	-4.4	-94.8	-57.5	0	0	0	104.6
977	S	28	Very low	29.4	Very low	86 Å²	86	154.7 Å²	154.7	60%	0.601	79%	0.786	S	S	*	*			cis	-145.9	159.3	-4.9	39.9	0	0	0	0	106.2
978	H	27.2	Very low	28.6	Very low	186 Å²	186	154.8 Å²	154.8	86%	0.861	79%	0.788	S	S	*	*				-147.9	-172.5	64.2	-97.2	-98	0	0	0	112.9
979	R	28.3	Very low	28.8	Very low	224 Å²	224	147.5 Å²	147.5	85%	0.845	78%	0.775	S	S	*	*			trans	-139.1	131.2	-153	-172.2	-174.7	-171.6	-168.5	3.2	112.9
980	N	27.7	Very low	28.4	Very low	159 Å²	159	148.2 Å²	148.2	85%	0.85	77%	0.774	S	S	*	*			trans	24.7	129.5	156.6	-54.4	9.6	0	0	0	120.9
981	G	27.3	Very low	28.2	Very low	82 Å²	82	150.8 Å²	150.8	85%	0.845	77%	0.773	S	S	*	*			trans	-152.1	145.7	154	0	0	0	0	0	111.2
982	R	28.1	Very low	28.1	Very low	211 Å²	211	147.8 Å²	147.8	80%	0.796	76%	0.762	S	S	*	*			trans	-127.2	163.4	171.2	-89.6	-168.1	177.4	-172.9	1.2	108.5
983	Y	27.2	Very low	28.1	Very low	215 Å²	215	140.7 Å²	140.7	84%	0.843	75%	0.751	S	S	*	*			trans	70.7	160.5	165.8	-67.4	-78.7	0	0	0	117
984	G	26	Very low	28.1	Very low	80 Å²	80	143.6 Å²	143.6	83%	0.825	76%	0.758	S	S	*	*			trans	105.9	122.7	166.9	0	0	0	0	0	112.4
985	G	26.5	Very low	28.1	Very low	71 Å²	71	146.5 Å²	146.5	73%	0.732	76%	0.764	S	S	*	*			trans	-112.1	-170.3	164.6	0	0	0	0	0	110.7
986	H	31.3	Very low	28	Very low	174 Å²	174	146.5 Å²	146.5	81%	0.806	77%	0.77	S	S	*	*			trans	73.7	130.3	174.2	-81.3	61	0	0	0	118.4
987	D	27.9	Very low	28.1	Very low	136 Å²	136	142.4 Å²	142.4	73%	0.727	77%	0.769	S	S	*	*			trans	79.1	147.8	138.6	-60.8	-14.2	0	0	0	124.1
988	C	26	Very low	28.2	Very low	112 Å²	112	142 Å²	142	76%	0.757	78%	0.78	S	S	*	*			trans	67.9	89.6	155.1	-68.1	0	0	0	0	119.8
989	S	29.9	Very low	28.4	Very low	93 Å²	93	142.2 Å²	142.2	65%	0.65	78%	0.78	S	S	*	*				58.4	135.7	106.9	68.7	0	0	0	0	121.7
990	D	28.5	Very low	28.4	Very low	136 Å²	136	135.2 Å²	135.2	73%	0.727	78%	0.778	S	S	*	*			trans	87.4	122.8	135.7	-74.7	-13.6	0	0	0	123.1
991	W	24	Very low	28.6	Very low	200 Å²	200	136.1 Å²	136.1	76%	0.758	78%	0.777	S	S	*	*			trans	80.4	126.1	134.8	-80.1	53.8	0	0	0	122.1
992	Q	25.8	Very low	28.9	Very low	156 Å²	156	136.5 Å²	136.5	73%	0.729	77%	0.767	S	S	*	*			trans	65	131	154	-62	-179.7	-15.9	0	0	117.5
993	S	29.5	Very low	29.1	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	77%	0.769	S	S	*	*			cis	87.9	145.5	35.1	-165.4	0	0	0	0	114.8
994	T	29	Very low	29.4	Very low	115 Å²	115	129.6 Å²	129.6	71%	0.706	77%	0.768	S	S	*	*			trans	86	105.1	171.9	69.7	0	0	0	0	120.2
995	K	29.3	Very low	29.6	Very low	206 Å²	206	128.7 Å²	128.7	90%	0.896	76%	0.759	S	S	*	*				80	141.6	120.4	-73.8	-173.1	173.1	-176.8	0	122.3
996	D	30	Very low	29.8	Very low	140 Å²	140	133 Å²	133	75%	0.749	77%	0.765	S	S	*	*			trans	-95.6	160.6	167.1	-170.5	-11.7	0	0	0	109.9
997	S	31.8	Very low	29.9	Very low	105 Å²	105	130.4 Å²	130.4	73%	0.734	76%	0.761	S	S	*	*			trans	64.1	119	153.6	-73.1	0	0	0	0	121.6
998	G	31.7	Very low	30.2	Very low	79 Å²	79	131.3 Å²	131.3	81%	0.814	77%	0.766	S	S	*	*				102.9	112.5	115.9	0	0	0	0	0	118.4
999	H	31.5	Very low	30.2	Very low	189 Å²	189	137.9 Å²	137.9	88%	0.875	78%	0.775	S	S	*	*			trans	-67.3	152.7	171.3	-77.3	-91.2	0	0	0	113.7
1000	G	28.2	Very low	30.3	Very low	77 Å²	77	142.2 Å²	142.2	79%	0.794	79%	0.785	S	S	*	*			trans	176.7	85.1	169.8	0	0	0	0	0	112.8
1001	E	32	Very low	30.5	Very low	178 Å²	178	140.3 Å²	140.3	83%	0.832	79%	0.788	S	S	*	*			trans	-82	169.1	177.2	-55.5	163	170.3	0	0	110.1
1002	S	32.2	Very low	30.7	Very low	90 Å²	90	134.2 Å²	134.2	63%	0.629	79%	0.787	S	S	*	*			cis	-155.8	163.9	13.5	58.4	0	0	0	0	112.8
1003	E	33.3	Very low	31.1	Very low	183 Å²	183	137.5 Å²	137.5	86%	0.855	79%	0.793	S	S	*	*			trans	60.1	150.8	142.6	-73.8	170.9	156.8	0	0	122.3
1004	A	32.4	Very low	31	Very low	99 Å²	99	138.5 Å²	138.5	82%	0.818	79%	0.79	S	S	*	*			cis	-162.5	172.4	-8.8	0	0	0	0	0	111.9
1005	G	30	Very low	31.3	Very low	61 Å²	61	138 Å²	138	63%	0.629	79%	0.792	S	S	*	*			trans	105.2	111.6	176.9	0	0	0	0	0	112.2
1006	D	32	Very low	32.4	Very low	162 Å²	162	133.1 Å²	133.1	87%	0.866	78%	0.781	S	S	*	*				62	134.8	67.6	-56.8	-34.7	0	0	0	111.9
1007	V	33.6	Very low	32.4	Very low	119 Å²	119	134.2 Å²	134.2	72%	0.721	79%	0.785	S	S	*	*				-158.7	144.9	51.9	165.7	0	0	0	0	112.4
1008	D	32.9	Very low	32.4	Very low	154 Å²	154	135.6 Å²	135.6	82%	0.824	78%	0.784	S	S	*	*			trans	65.9	161.4	155.8	-62.2	-12.4	0	0	0	125.4
1009	W	27.3	Very low	33.3	Very low	250 Å²	250	136 Å²	136	95%	0.947	77%	0.772	S	S	*	*			trans	-135.4	-171	-169.3	-102	86.4	0	0	0	110.8
1010	E	31.2	Very low	33.3	Very low	185 Å²	185	135 Å²	135	86%	0.864	77%	0.768	S	S	*	*			trans	80.5	155.5	165.1	-60.4	-162.6	173.9	0	0	118.4
1011	A	31.9	Very low	33.4	Very low	96 Å²	96	137.6 Å²	137.6	79%	0.793	76%	0.763	S	S	*	*			cis	-168.6	166	-28.6	0	0	0	0	0	110.7
1012	G	30	Very low	33.3	Very low	71 Å²	71	137.4 Å²	137.4	73%	0.732	76%	0.762	S	S	*	*			trans	130.7	124.8	176.6	0	0	0	0	0	112.3
1013	R	32.9	Very low	33.2	Very low	226 Å²	226	142.3 Å²	142.3	85%	0.853	78%	0.775	S	S	*	*			cis	65.1	131.4	17.3	-64.8	-165.6	-156.5	-119.7	6.7	114.8
1014	D	28.5	Very low	33	Very low	123 Å²	123	137 Å²	137	66%	0.658	77%	0.769	S	S	*	*			cis	-154	142.9	4.2	-97.4	-36.8	0	0	0	112.8
1015	S	34.3	Very low	32.8	Very low	106 Å²	106	140 Å²	140	74%	0.741	77%	0.771	S	S	*	*			trans	61.6	169.2	136.2	-63.1	0	0	0	0	120.3
1016	P	51.8	Low	32.6	Very low	103 Å²	103	141.2 Å²	141.2	67%	0.669	77%	0.77	S	S	*	*			cis	-144.3	166.6	16.2	47.1	-28.7	0	0	0	119.8
1017	I	31.5	Very low	32.5	Very low	162 Å²	162	140.5 Å²	140.5	83%	0.831	77%	0.765	S	S	*	*			trans	48.8	142.8	130.7	-64.3	169.9	0	0	0	120.2
1018	D	31.1	Very low	32.2	Very low	134 Å²	134	142.2 Å²	142.2	72%	0.717	77%	0.77	S	S	*	*			cis	170.4	-171.3	-12.8	-155.6	19.8	0	0	0	106.3
1019	P	51.3	Low	31.8	Very low	88 Å²	88	141.7 Å²	141.7	57%	0.571	77%	0.766	S	S	*	*			cis	-126.1	-170.3	-38.3	17.7	7.2	0	0	0	114.1
1020	Q	30.3	Very low	32	Very low	168 Å²	168	136.5 Å²	136.5	79%	0.785	76%	0.757	S	S	*	*			trans	86.6	134.1	155.1	-50.5	-158.4	-11.9	0	0	118
1021	L	30.8	Very low	31.7	Very low	131 Å²	131	133.1 Å²	133.1	69%	0.686	75%	0.754	S	S	*	*			cis	-155.6	158	-8.9	-138.5	71.2	0	0	0	105.8
1022	E	29.8	Very low	32.2	Very low	174 Å²	174	133 Å²	133	81%	0.813	75%	0.745	S	S	*	*			cis	-155.1	156.2	11.7	-163.6	159	-127.9	0	0	109.1
1023	E	29.8	Very low	32.1	Very low	194 Å²	194	136.5 Å²	136.5	91%	0.907	75%	0.747	S	S	*	*			trans	-126.7	145.2	-174.9	-95.8	-162	131.7	0	0	114.7
1024	G	29.6	Very low	31.9	Very low	70 Å²	70	132.8 Å²	132.8	72%	0.722	74%	0.744	S	S	*	*			trans	85	165.9	151.3	0	0	0	0	0	118.6
1025	L	27.2	Very low	32	Very low	164 Å²	164	133 Å²	133	86%	0.859	75%	0.75	S	S	*	*			cis	-162.5	141.9	-7.2	-121.3	170.7	0	0	0	112.5
1026	S	27.7	Very low	31.5	Very low	86 Å²	86	137 Å²	137	60%	0.601	75%	0.754	S	S	*	*			trans	60	120.6	150.3	60.8	0	0	0	0	123.7
1027	N	29.5	Very low	30.3	Very low	146 Å²	146	136.7 Å²	136.7	78%	0.781	75%	0.754	S	S	*	*				62.8	112.6	126.9	-53.8	-13.4	0	0	0	122
1028	L	26.4	Very low	30.2	Very low	156 Å²	156	136.4 Å²	136.4	82%	0.817	75%	0.749	S	S	*	*				172.5	143.2	102.1	-93.2	166.1	0	0	0	114.7
1029	L	25.9	Very low	30	Very low	142 Å²	142	137.2 Å²	137.2	74%	0.743	75%	0.752	S	S	*	*			trans	74.8	141.6	150.1	-68.9	164.2	0	0	0	123.1
1030	N	29.8	Very low	28.9	Very low	141 Å²	141	138.2 Å²	138.2	75%	0.754	76%	0.761	S	S	*	*			trans	76.9	95.1	146.8	-62.8	-10.6	0	0	0	123.4
1031	S	26.3	Very low	28.9	Very low	115 Å²	115	137.3 Å²	137.3	80%	0.804	76%	0.762	S	S	*	*				67.5	-172.7	119.5	-134.9	0	0	0	0	118.1
1032	P	41.7	Very low	29.7	Very low	94 Å²	94	136.8 Å²	136.8	61%	0.61	77%	0.766	S	S	*	*				-130	179.5	-107.5	45.3	-27.8	0	0	0	116.5
1033	D	28.8	Very low	29.8	Very low	144 Å²	144	132.7 Å²	132.7	77%	0.77	76%	0.762	S	S	*	*			trans	64.3	138.1	152.3	-55.1	-29.4	0	0	0	123.1
1034	D	27.9	Very low	29.8	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	76%	0.758	S	S	*	*			trans	75.8	162.8	146.2	-87.8	-25.1	0	0	0	123.9
1035	V	29.9	Very low	29.6	Very low	127 Å²	127	138 Å²	138	77%	0.77	76%	0.761	S	S	*	*			trans	77.7	98	171.8	-168.5	0	0	0	0	114
1036	F	25	Very low	29.6	Very low	191 Å²	191	134 Å²	134	84%	0.838	75%	0.751	S	S	*	*				48.6	140.4	78.1	-70.6	-87.9	0	0	0	113.1
1037	S	27	Very low	29.6	Very low	96 Å²	96	141.3 Å²	141.3	67%	0.671	77%	0.766	S	S	*	*			cis	-159.7	-178.8	8.9	50.2	0	0	0	0	107.3
1038	E	28.8	Very low	29.5	Very low	156 Å²	156	142.7 Å²	142.7	73%	0.729	77%	0.772	S	S	*	*			cis	-169.6	159.7	13.3	-139.2	165.3	-148	0	0	109.6
1039	I	27.3	Very low	29.6	Very low	151 Å²	151	139.8 Å²	139.8	77%	0.774	76%	0.764	S	S	*	*			trans	66.4	140	151.9	-72.1	156.5	0	0	0	118.2
1040	S	28.2	Very low	29.8	Very low	108 Å²	108	141 Å²	141	76%	0.755	77%	0.771	S	S	*	*			cis	-148.8	155.1	4.3	44.9	0	0	0	0	114.1
1041	D	29	Very low	30.5	Very low	150 Å²	150	139.7 Å²	139.7	80%	0.802	77%	0.77	S	S	*	*			trans	-47.1	166.1	154.6	-78.5	-63	0	0	0	114.5
1042	P	48.7	Very low	30.7	Very low	119 Å²	119	142 Å²	142	77%	0.773	77%	0.773	S	S	*	*			cis	-126.9	-150.4	19.7	31	-5.1	0	0	0	111.9
1043	A	31	Very low	30.1	Very low	88 Å²	88	144.1 Å²	144.1	73%	0.727	78%	0.784	S	S	*	*			cis	-160	-158.2	18.7	0	0	0	0	0	114.3
1044	W	30	Very low	30.3	Very low	219 Å²	219	143 Å²	143	83%	0.83	78%	0.782	S	S	*	*			trans	-133.3	150.2	-160.5	47.3	-75.3	0	0	0	114.9
1045	M	25.3	Very low	30.5	Very low	158 Å²	158	142.2 Å²	142.2	78%	0.778	78%	0.778	S	S	*	*			trans	71.9	106.9	147.3	-74.9	-111.4	-72.5	0	0	123.1
1046	A	28.4	Very low	30.6	Very low	79 Å²	79	146 Å²	146	65%	0.653	78%	0.78	S	S	*	*				107.2	158.3	100.4	0	0	0	0	0	121.4
1047	R	27	Very low	31	Very low	240 Å²	240	144.1 Å²	144.1	91%	0.906	77%	0.773	S	S	*	*			trans	77.6	133.9	170.3	-55.7	-176.8	177.7	-170.8	-1.3	117.7
1048	L	27.8	Very low	31.3	Very low	175 Å²	175	145.5 Å²	145.5	92%	0.916	77%	0.773	S	S	*	*				-156.5	153.7	119.8	-109.6	169.4	0	0	0	110.5
1049	S	28.3	Very low	31.5	Very low	94 Å²	94	145.2 Å²	145.2	66%	0.657	78%	0.777	S	S	*	*			trans	-163.3	143.2	-176.4	57.3	0	0	0	0	111.3
1050	L	29	Very low	31.6	Very low	167 Å²	167	143.5 Å²	143.5	87%	0.874	77%	0.773	S	S	*	*			trans	72.2	141.1	170.5	-54.9	171.5	0	0	0	117.7
1051	P	44.3	Very low	31.6	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	78%	0.779	S	S	*	*			trans	-107.1	129.5	170.4	36.8	-28.8	0	0	0	114.6
1052	L	31.8	Very low	31.7	Very low	163 Å²	163	146.6 Å²	146.6	85%	0.853	78%	0.776	S	S	*	*			trans	26.2	135.2	136.4	-62.9	167.3	0	0	0	122.2
1053	T	28	Very low	31.7	Very low	139 Å²	139	145.8 Å²	145.8	85%	0.853	77%	0.771	S	S	*	*				-155.1	149.8	114.8	7.8	0	0	0	0	113.6
1054	V	33	Very low	31.6	Very low	121 Å²	121	149.1 Å²	149.1	73%	0.733	78%	0.777	S	S	*	*			trans	-54.7	-178.4	179.9	-102.3	0	0	0	0	116.8
1055	D	32.7	Very low	31.5	Very low	131 Å²	131	142.1 Å²	142.1	70%	0.701	77%	0.772	S	S	*	*			cis	-160.5	-178.4	13.8	-128.6	-13	0	0	0	110.5
1056	Y	32.2	Very low	32.4	Very low	205 Å²	205	140.7 Å²	140.7	80%	0.804	78%	0.775	S	S	*	*			cis	-154.9	-153.7	-8	-171	-121.4	0	0	0	108.8
1057	H	32.9	Very low	33.6	Very low	152 Å²	152	142.7 Å²	142.7	70%	0.704	78%	0.781	S	S	*	*			trans	-125	161.2	176.2	-108.4	-77.7	0	0	0	115.2
1058	D	34.3	Very low	34.1	Very low	125 Å²	125	136.3 Å²	136.3	67%	0.668	77%	0.774	S	S	*	*			trans	-21.5	153.2	178.2	-60	-83.5	0	0	0	123.4
1059	N	31.5	Very low	35.2	Very low	151 Å²	151	133.4 Å²	133.4	81%	0.807	77%	0.765	S	S	*	*				-176.5	118	117.1	-96.2	-59.5	0	0	0	116.8
1060	V	30.6	Very low	35.4	Very low	115 Å²	115	137.8 Å²	137.8	70%	0.697	78%	0.775	S	S	*	*				76.9	128.2	126.4	175.3	0	0	0	0	124.4
1061	F	27.1	Very low	35.5	Very low	198 Å²	198	134.5 Å²	134.5	87%	0.868	77%	0.766	S	S	*	*			trans	77	163.4	159.3	-91.9	-61.5	0	0	0	122.9
1062	V	31.2	Very low	34.7	Very low	124 Å²	124	137.1 Å²	137.1	75%	0.752	77%	0.768	S	S	*	*			trans	-154.4	138.4	-142.3	161.1	0	0	0	0	108.3
1063	P	49	Very low	34.6	Very low	103 Å²	103	136.8 Å²	136.8	67%	0.669	77%	0.767	S	S	*	*				-157.8	160.8	98.7	41.6	-21.4	0	0	0	120.4
1064	N	29.5	Very low	36.2	Very low	158 Å²	158	135 Å²	135	85%	0.845	76%	0.758	S	S	*	*			trans	79.7	138.2	155.9	-57.3	-29.2	0	0	0	120.8
1065	G	27.8	Very low	37.6	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	76%	0.758	S	S	*	*			trans	-99.1	-155.6	171.7	0	0	0	0	0	113.2
1066	P	44.7	Very low	37.8	Very low	129 Å²	129	138.1 Å²	138.1	84%	0.838	76%	0.761	S	S	*	*			cis	-135.3	-136.7	40.4	43.7	-22	0	0	0	113.7
1067	P	51.8	Low	37.7	Very low	121 Å²	121	133.9 Å²	133.9	79%	0.786	75%	0.752	S	S	*	*			trans	-128.1	-167.2	-131.2	35.8	-10.1	0	0	0	117.5
1068	S	38.7	Very low	37.8	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	75%	0.745	S	S	*	*			trans	-73	166.1	-175.6	52.8	0	0	0	0	117.5
1069	P	50.5	Low	38	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	75%	0.749	S	S	*	*				-134.8	161.2	108.4	32.4	-16.5	0	0	0	112.4
1070	E	32	Very low	37.9	Very low	186 Å²	186	129.4 Å²	129.4	87%	0.869	75%	0.746	S	S	*	*				57.4	141.3	59.7	-58.6	-171.7	157.3	0	0	113.8
1071	S	31.1	Very low	38.1	Very low	99 Å²	99	128 Å²	128	69%	0.692	74%	0.74	S	S	*	*			cis	-121.5	-146.6	6.5	47.6	0	0	0	0	111
1072	E	28.7	Very low	38.5	Very low	169 Å²	169	125.2 Å²	125.2	79%	0.79	74%	0.74	S	S	*	*			cis	-159.4	-177.9	3.5	-150.7	143.9	-78	0	0	112.8
1073	L	29	Very low	38.7	Very low	156 Å²	156	124.4 Å²	124.4	82%	0.817	74%	0.74	S	S	*	*			trans	-160.5	-178.8	-177.4	-92.8	174	0	0	0	108.4
1074	P	61.4	Low	38.3	Very low	103 Å²	103	124.9 Å²	124.9	67%	0.669	75%	0.746	S	S	*	*			cis	-127.7	-142.8	-35.4	40.7	-21.6	0	0	0	108.5
1075	P	62.6	Low	38.4	Very low	112 Å²	112	127.2 Å²	127.2	73%	0.727	75%	0.749	S	S	*	*			cis	-120.5	-135.6	-19.4	30.2	-4.6	0	0	0	110.3
1076	R	36.7	Very low	38.6	Very low	205 Å²	205	128.8 Å²	128.8	77%	0.774	75%	0.748	S	S	*	*			cis	-165.4	162.1	1.2	-135.3	-157.5	151.4	83.8	21.7	106.1
1077	D	31.2	Very low	38	Very low	115 Å²	115	129 Å²	129	62%	0.615	75%	0.747	S	S	*	*			cis	-161.2	162.8	-10.7	-138.9	17	0	0	0	106
1078	G	33.5	Very low	37	Very low	54 Å²	54	132.9 Å²	132.9	56%	0.557	75%	0.752	S	S	*	*			cis	159.8	133.6	-9.6	0	0	0	0	0	113.1
1079	L	38.8	Very low	36.6	Very low	144 Å²	144	131.1 Å²	131.1	75%	0.754	75%	0.75	S	S	*	*			trans	75.8	150.3	154.2	-49.9	167	0	0	0	118
1080	N	29.9	Very low	35.6	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	76%	0.759	S	S	*	*			cis	-136.5	167.8	14.5	-62.9	-101.2	0	0	0	109.6
1081	S	34.4	Very low	35.7	Very low	84 Å²	84	133.3 Å²	133.3	59%	0.587	76%	0.757	S	S	*	*			cis	75.4	136.5	19.3	66.9	0	0	0	0	117.7
1082	T	36.7	Very low	36.5	Very low	140 Å²	140	134.3 Å²	134.3	86%	0.859	76%	0.761	S	S	*	*			cis	-140.7	-125.3	-12.8	9.8	0	0	0	0	108.7
1083	S	34.1	Very low	36.7	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	76%	0.758	S	S	*	*			cis	-168.1	152.8	-3.6	55.5	0	0	0	0	110.6
1084	S	41.7	Very low	36.7	Very low	112 Å²	112	133.3 Å²	133.3	78%	0.783	75%	0.75	S	S	*	*			trans	-138.6	138.8	174	51.5	0	0	0	0	113.1
1085	F	30.7	Very low	35.2	Very low	208 Å²	208	135.3 Å²	135.3	91%	0.912	76%	0.755	S	S	*	*			trans	-163	178	-178.7	-94.5	-82.9	0	0	0	111.8
1086	S	31.4	Very low	33.4	Very low	103 Å²	103	134 Å²	134	72%	0.72	76%	0.761	S	S	*	*				176.2	112.6	-89.2	-178.8	0	0	0	0	112.1
1087	T	33.3	Very low	33.1	Very low	133 Å²	133	132.8 Å²	132.8	82%	0.816	77%	0.765	S	S	*	*			trans	-154.4	137.8	175.7	39.1	0	0	0	0	118
1088	F	31	Very low	33	Very low	204 Å²	204	134.7 Å²	134.7	90%	0.895	77%	0.774	S	S	*	*			trans	3.3	156	144.9	-63.9	-102.2	0	0	0	122.1
1089	G	29.3	Very low	32.8	Very low	68 Å²	68	136.1 Å²	136.1	70%	0.701	79%	0.789	S	S	*	*			cis	151.3	178.2	-4.5	0	0	0	0	0	115.4
1090	K	30.6	Very low	32.2	Very low	211 Å²	211	133.1 Å²	133.1	92%	0.917	79%	0.793	S	S	*	*			trans	94.6	155.3	172	-63.1	-172.2	174.7	-177.6	0	120.3
1091	T	32.7	Very low	32.5	Very low	134 Å²	134	131.1 Å²	131.1	82%	0.822	80%	0.795	S	S	*	*			trans	-120.6	178.4	-171	55.2	0	0	0	0	112.2
1092	P	48.9	Very low	32.4	Very low	120 Å²	120	134.8 Å²	134.8	78%	0.779	81%	0.807	S	S	*	*				-147.1	170.3	90.7	40.2	-23.2	0	0	0	117.3
1093	E	31.8	Very low	32.2	Very low	155 Å²	155	134.6 Å²	134.6	72%	0.724	80%	0.8	S	S	*	*			trans	-7.5	157.4	150.6	-74.2	-178.4	-157.3	0	0	120.9
1094	K	30.6	Very low	32	Very low	150 Å²	150	133.5 Å²	133.5	65%	0.652	79%	0.793	S	S	*	*			cis	-166.8	167.7	23.6	-135.2	176.9	172.8	100.9	0	114.9
1095	D	28.2	Very low	31.7	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	79%	0.793	S	S	*	*			trans	52.2	140.5	150.6	-60.9	-27.4	0	0	0	123.5
1096	G	26.6	Very low	31.8	Very low	83 Å²	83	132.8 Å²	132.8	86%	0.856	79%	0.789	S	S	*	*			trans	151.8	119.5	165.4	0	0	0	0	0	114
1097	Q	30.5	Very low	31.6	Very low	181 Å²	181	132.8 Å²	132.8	85%	0.846	79%	0.789	S	S	*	*			trans	-145	166.4	-173.1	-144.7	-171.3	13.2	0	0	112.6
1098	L	28.8	Very low	31.7	Very low	155 Å²	155	132.2 Å²	132.2	81%	0.812	79%	0.786	S	S	*	*			trans	75.9	149.2	167.1	-95.5	70.8	0	0	0	120
1099	G	27.9	Very low	31.6	Very low	84 Å²	84	129.9 Å²	129.9	87%	0.866	78%	0.781	S	S	*	*			trans	91.9	135.3	166	0	0	0	0	0	115
1100	G	27.8	Very low	31.4	Very low	81 Å²	81	133.9 Å²	133.9	84%	0.835	78%	0.78	S	S	*	*			cis	157	134.1	-3.4	0	0	0	0	0	110.4
1101	A	35.8	Very low	31.4	Very low	95 Å²	95	130.1 Å²	130.1	79%	0.785	77%	0.765	S	S	*	*			trans	-95.1	-157	-178.7	0	0	0	0	0	112.6
1102	L	31.6	Very low	31	Very low	161 Å²	161	130.1 Å²	130.1	84%	0.843	76%	0.758	S	S	*	*			trans	79.1	151	-177.1	-45.1	173.3	0	0	0	113.5
1103	L	32.3	Very low	29.9	Very low	135 Å²	135	132.5 Å²	132.5	71%	0.707	76%	0.763	S	S	*	*			cis	-159.8	176.6	-16.4	-108.9	169.5	0	0	0	105.4
1104	S	31.1	Very low	29.8	Very low	86 Å²	86	132.6 Å²	132.6	60%	0.601	77%	0.766	S	S	*	*			cis	-153.1	166.3	13.5	-166.1	0	0	0	0	106.8
1105	E	34.7	Very low	29.7	Very low	167 Å²	167	132 Å²	132	78%	0.78	77%	0.774	S	S	*	*			cis	72.4	158.4	25.3	-85	-172.6	-93.7	0	0	117.4
1106	V	31.7	Very low	29.7	Very low	137 Å²	137	132.7 Å²	132.7	83%	0.83	77%	0.773	S	S	*	*			trans	78.5	132.5	-179.2	179.4	0	0	0	0	115.1
1107	S	28.5	Very low	29.7	Very low	103 Å²	103	137.6 Å²	137.6	72%	0.72	77%	0.771	S	S	*	*			cis	-162.9	176.6	-18	-166.3	0	0	0	0	112.3
1108	T	34.3	Very low	29.6	Very low	122 Å²	122	133.2 Å²	133.2	75%	0.748	77%	0.765	S	S	*	*			trans	-66.3	169.9	177.7	56.9	0	0	0	0	115.9
1109	L	30	Very low	29.4	Very low	154 Å²	154	133.6 Å²	133.6	81%	0.806	77%	0.768	S	S	*	*			trans	164.5	143.7	147	-89.1	167.8	0	0	0	107
1110	F	23.8	Very low	29.4	Very low	153 Å²	153	134.2 Å²	134.2	67%	0.671	77%	0.766	S	S	*	*			cis	-154.9	153.5	-6.3	-162.3	-133.5	0	0	0	108.7
1111	E	31.4	Very low	29.3	Very low	131 Å²	131	139.3 Å²	139.3	61%	0.612	77%	0.767	S	S	*	*				8.9	157.8	128.4	-113.7	-177.6	-114.1	0	0	119.6
1112	M	24.3	Very low	29.7	Very low	134 Å²	134	140.6 Å²	140.6	66%	0.66	77%	0.768	S	S	*	*			cis	-167.7	144.9	18.5	178.4	176.9	41.5	0	0	109.6
1113	L	26.1	Very low	29.4	Very low	171 Å²	171	136 Å²	136	90%	0.895	76%	0.76	S	S	*	*			trans	-176	138.6	132.4	-103.2	164.8	0	0	0	114.3
1114	M	29.5	Very low	29.9	Very low	157 Å²	157	135.2 Å²	135.2	77%	0.773	76%	0.762	S	S	*	*			trans	-87.3	155.8	-170.3	-63.6	-92.9	-85.4	0	0	113.6
1115	T	29.6	Very low	29.7	Very low	137 Å²	137	142.5 Å²	142.5	84%	0.84	78%	0.776	S	S	*	*			trans	148.3	160	133.5	45.9	0	0	0	0	112
1116	Q	27.8	Very low	30.1	Very low	159 Å²	159	139.2 Å²	139.2	74%	0.743	77%	0.77	S	S	*	*			cis	-172.8	142.7	-38.5	-166	-171.1	65.4	0	0	107.9
1117	K	25.3	Very low	30	Very low	186 Å²	186	139.7 Å²	139.7	81%	0.809	77%	0.768	S	S	*	*			trans	77.3	145.1	150	-122	179.9	-179.6	-179.8	0	122.5
1118	A	28.4	Very low	30	Very low	89 Å²	89	140.4 Å²	140.4	74%	0.736	77%	0.767	S	S	*	*			trans	94.5	147	136.4	0	0	0	0	0	121.3
1119	D	25.9	Very low	29.7	Very low	163 Å²	163	141.7 Å²	141.7	87%	0.872	77%	0.769	S	S	*	*			trans	-81.9	152.4	-169.4	-40	-100.8	0	0	0	114.8
1120	A	27.7	Very low	29.7	Very low	98 Å²	98	142 Å²	142	81%	0.81	76%	0.76	S	S	*	*			trans	179.4	152.3	135.2	0	0	0	0	0	113.7
1121	H	26	Very low	30	Very low	187 Å²	187	142.9 Å²	142.9	87%	0.866	76%	0.759	S	S	*	*			trans	-90.9	168.4	153.8	-74	47.3	0	0	0	109.3
1122	P	44.8	Very low	29.8	Very low	123 Å²	123	143.7 Å²	143.7	80%	0.799	77%	0.767	S	S	*	*			cis	-127.6	-165	-2.3	38.1	-18.8	0	0	0	113.2
1123	G	24.3	Very low	30	Very low	65 Å²	65	141.5 Å²	141.5	67%	0.67	77%	0.765	S	S	*	*			trans	-80.9	-157.6	167.4	0	0	0	0	0	113.9
1124	P	43	Very low	30.2	Very low	117 Å²	117	138.1 Å²	138.1	76%	0.76	76%	0.762	S	S	*	*			cis	-140.7	172.1	8.5	43.4	-26.6	0	0	0	117.4
1125	R	25.9	Very low	30.1	Very low	239 Å²	239	134.7 Å²	134.7	90%	0.902	76%	0.758	S	S	*	*			trans	63.6	171.9	157.9	-81.2	-176.3	-177.5	-174.9	0.3	117.3
1126	P	43.4	Very low	30	Very low	99 Å²	99	139 Å²	139	64%	0.643	76%	0.761	S	S	*	*			cis	-132.7	179.3	-37.6	38.3	-22.1	0	0	0	113.9
1127	D	29.4	Very low	30.1	Very low	147 Å²	147	140.6 Å²	140.6	79%	0.786	76%	0.76	S	S	*	*			trans	59.4	142.4	139.5	-71	-21.5	0	0	0	124.9
1128	V	28.7	Very low	30.5	Very low	118 Å²	118	141.9 Å²	141.9	72%	0.715	76%	0.759	S	S	*	*			trans	83.4	110	134.8	156.8	0	0	0	0	120.7
1129	L	29.2	Very low	30.7	Very low	148 Å²	148	142.2 Å²	142.2	78%	0.775	76%	0.756	S	S	*	*			trans	69.9	156.5	142.5	-67.5	-177.3	0	0	0	119.4
1130	Y	29.9	Very low	30.9	Very low	161 Å²	161	143.2 Å²	143.2	63%	0.631	76%	0.761	S	S	*	*			cis	-179.8	160.1	-17.3	-175.6	-148.9	0	0	0	110.8
1131	R	29.3	Very low	31.2	Very low	171 Å²	171	141.5 Å²	141.5	65%	0.645	75%	0.753	S	S	*	*			trans	66	125.1	162	-79.7	179.1	-178	-179.1	11.6	117.5
1132	L	28.1	Very low	31.6	Very low	148 Å²	148	140.2 Å²	140.2	78%	0.775	75%	0.752	S	S	*	*				71.9	149	102.5	-64.1	174.8	0	0	0	114.8
1133	S	28.8	Very low	31	Very low	89 Å²	89	140.9 Å²	140.9	62%	0.622	75%	0.748	S	S	*	*			cis	-178.4	153.9	-17.2	52.5	0	0	0	0	108.8
1134	A	28.6	Very low	31.5	Very low	100 Å²	100	141.2 Å²	141.2	83%	0.826	74%	0.744	S	S	*	*			trans	62.9	156.1	160.1	0	0	0	0	0	115.9
1135	A	27.8	Very low	31	Very low	84 Å²	84	141.7 Å²	141.7	69%	0.694	75%	0.746	S	S	*	*			cis	-159	160.6	-23.4	0	0	0	0	0	107.8
1136	Y	28.2	Very low	31.2	Very low	228 Å²	228	136.5 Å²	136.5	89%	0.894	74%	0.74	S	S	*	*			trans	-146.5	153.7	136.3	-141.7	-107.1	0	0	0	112.1
1137	R	30.5	Very low	30.6	Very low	192 Å²	192	136 Å²	136	73%	0.725	75%	0.745	S	S	*	*			trans	-119.2	140	-177.8	-78	177.7	170.7	173	-2.4	109.2
1138	R	33	Very low	30.6	Very low	213 Å²	213	134.3 Å²	134.3	80%	0.804	75%	0.751	S	S	*	*			trans	66.6	159.9	148.4	-69.7	172.9	-173.6	175.7	-1	117
1139	S	31.4	Very low	30.6	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	76%	0.757	S	S	*	*			cis	-175.2	139.1	-25.8	52.9	0	0	0	0	110.5
1140	L	31.5	Very low	30.5	Very low	184 Å²	184	129 Å²	129	96%	0.963	76%	0.756	S	S	*	*			trans	-149.8	135.2	158.3	-67.9	175.1	0	0	0	107.6
1141	G	32.5	Very low	30.5	Very low	62 Å²	62	128.1 Å²	128.1	64%	0.639	77%	0.768	S	S	*	*			cis	163.2	147.3	-14.4	0	0	0	0	0	112.8
1142	L	34.7	Very low	30.6	Very low	161 Å²	161	125.2 Å²	125.2	84%	0.843	77%	0.774	S	S	*	*			trans	71.4	150.2	160.8	-50.1	173.1	0	0	0	116.7
1143	D	31.9	Very low	31.5	Very low	137 Å²	137	123.1 Å²	123.1	73%	0.733	77%	0.769	S	S	*	*			cis	-150.6	155.8	-5.5	-129.9	-24	0	0	0	117
1144	A	36.4	Very low	31.6	Very low	71 Å²	71	127.7 Å²	127.7	59%	0.587	78%	0.778	S	S	*	*			trans	23.8	132.5	153	0	0	0	0	0	121.5
1145	T	31.4	Very low	31.4	Very low	128 Å²	128	130.4 Å²	130.4	79%	0.785	78%	0.778	S	S	*	*				-179	167.7	75.2	35.9	0	0	0	0	109.5
1146	T	31.1	Very low	31.4	Very low	129 Å²	129	132.2 Å²	132.2	79%	0.791	78%	0.784	S	S	*	*			cis	-171.7	155.3	-23.9	33.9	0	0	0	0	106.7
1147	A	29.7	Very low	31.4	Very low	89 Å²	89	127.2 Å²	127.2	74%	0.736	78%	0.782	S	S	*	*			cis	-171.9	160.9	-20.9	0	0	0	0	0	109.2
1148	A	29.8	Very low	31.5	Very low	111 Å²	111	126.2 Å²	126.2	92%	0.917	79%	0.786	S	S	*	*			trans	65.2	140.3	175.6	0	0	0	0	0	117.9
1149	G	28.4	Very low	31.2	Very low	82 Å²	82	125.7 Å²	125.7	85%	0.845	79%	0.79	S	S	*	*			cis	161.8	147.9	-8.7	0	0	0	0	0	112.3
1150	G	27.9	Very low	31.2	Very low	72 Å²	72	132.5 Å²	132.5	74%	0.742	80%	0.801	S	S	*	*			trans	135.6	94.6	170.9	0	0	0	0	0	116.6
1151	T	30.1	Very low	31.8	Very low	144 Å²	144	128.6 Å²	128.6	88%	0.883	79%	0.786	S	S	*	*			trans	27.4	113.3	142.3	53.3	0	0	0	0	120.8
1152	S	31.9	Very low	31.6	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	79%	0.793	S	S	*	*			trans	-74.5	178.6	139.7	64.5	0	0	0	0	109.8
1153	P	45.9	Very low	31.4	Very low	104 Å²	104	130.3 Å²	130.3	68%	0.675	79%	0.791	S	S	*	*			cis	-144.3	-168.8	13.9	45.9	-26.7	0	0	0	116.8
1154	K	30.2	Very low	31.2	Very low	185 Å²	185	127.9 Å²	127.9	80%	0.804	79%	0.79	S	S	*	*			trans	60.3	114.4	156.6	-69.8	-176.8	179.2	-174.3	0	119.1
1155	N	26.1	Very low	30.9	Very low	157 Å²	157	130.2 Å²	130.2	84%	0.84	80%	0.802	S	S	*	*				-177.3	167	94.1	-105.7	-5	0	0	0	113.2
1156	C	27.7	Very low	30.9	Very low	121 Å²	121	132 Å²	132	82%	0.818	80%	0.799	S	S	*	*			trans	-74.4	150.6	169.5	-52.2	0	0	0	0	111.7
1157	S	27.7	Very low	31	Very low	123 Å²	123	133.1 Å²	133.1	86%	0.86	80%	0.795	S	S	*	*			trans	179.4	166.8	137.5	37.3	0	0	0	0	112.3
1158	E	33	Very low	31.1	Very low	171 Å²	171	137.3 Å²	137.3	80%	0.799	80%	0.799	S	S	*	*			trans	-68.8	155.7	-170.9	-47.4	150.7	105.1	0	0	114.4
1159	K	26.8	Very low	31.5	Very low	203 Å²	203	142.8 Å²	142.8	88%	0.883	80%	0.798	S	S	*	*				-178.6	137.4	121.1	-98.5	149.2	-169.1	163.7	0	115
1160	R	30.7	Very low	31.9	Very low	238 Å²	238	151.3 Å²	151.3	90%	0.898	82%	0.815	S	S	*	*			trans	-82.4	160.7	142.6	-83.3	-178.1	174.1	-178.5	-0.4	107.6
1161	P	44.6	Very low	32.1	Very low	102 Å²	102	155.3 Å²	155.3	66%	0.662	82%	0.819	S	S	*	*			cis	-150.6	170.1	35.5	41.5	-20.3	0	0	0	119.9
1162	T	28.4	Very low	32.2	Very low	129 Å²	129	155.8 Å²	155.8	79%	0.791	82%	0.816	S	S	*	*			trans	69.6	154.2	144.2	48.5	0	0	0	0	123.7
1163	V	28.7	Very low	32.2	Very low	131 Å²	131	158.4 Å²	158.4	79%	0.794	82%	0.818	S	S	*	*			trans	87.4	84.5	160.6	-160.9	0	0	0	0	119.9
1164	A	29.1	Very low	31.4	Very low	86 Å²	86	161.6 Å²	161.6	71%	0.711	83%	0.827	S	S	*	*				57.5	156.5	123.6	0	0	0	0	0	124.3
1165	S	29	Very low	31.5	Very low	120 Å²	120	160.1 Å²	160.1	84%	0.839	83%	0.828	S	S	*	*			trans	78.3	153.7	165.2	80.2	0	0	0	0	118.2
1166	K	32.5	Very low	31.9	Very low	164 Å²	164	160.3 Å²	160.3	71%	0.713	83%	0.827	S	S	*	*			cis	-171.9	141.3	-34.8	-165	-172.3	-178.7	-158.2	0	108.4
1167	H	32.8	Very low	32.2	Very low	153 Å²	153	163.1 Å²	163.1	71%	0.708	83%	0.828	S	S	*	*			trans	65.7	165.5	-176.8	-50.9	-74	0	0	0	112.9
1168	Q	31.9	Very low	32.5	Very low	178 Å²	178	166.2 Å²	166.2	83%	0.832	83%	0.826	S	S	*	*			cis	-145	171.8	10.1	-161.7	159.7	-23.9	0	0	111.3
1169	Y	37.9	Very low	32.5	Very low	226 Å²	226	165.8 Å²	165.8	89%	0.886	83%	0.828	S	S	*	*			trans	-53.3	132.7	172.3	-77.8	-105.8	0	0	0	112.3
1170	Q	37.3	Very low	33	Very low	260 Å²	260	162.5 Å²	162.5	100%	1.215	82%	0.823	S	S	*	*				-154	0	98.1	-138.4	169.4	-4.6	0	0	111.4

Retrieved 1,170 of 1,170 residues in 342.4 ms (Link to these results)

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