A0A3Q0KKX0_SCHMA Loading...

Putative cadherin

AlphaFold DB , UniProt , Accession A0A3Q0KKX0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,533 aa.

						>A0A3Q0KKX0_SCHMA|A0A3Q0KKX0
MICCWGMNISINDINVPKYVRIKLKEESPSGTVVINIGEFLNSIPLTNYDTSNNADHDLKKRMLIVPSSLSLVSEIPSVTRLFRLNKETESIHTMMAIDRDTLCSKNQLCCSNPTIKNSINGYIDTSGRMPMTGGGQTFKSYDSKTADVCLIQFRVIFSMHYQDDFVGNNNYNQVDGSTEKMAYITVEVELLDINDNSPQFILPVPIPKTTTLLYSPIPVIEISVEESMGLHTCIHLPKALDLDSSIYDVTEYRIESLTQSDILQLKNKLSHSNLVGIDKNELPFSLEHMSCTDPLVQNYIEVDMNTPVQQTNEGFELTTNNQLLTPSLKVINYLDRETVEYYWIKLLAIDGIKYLETDASGYQDVNNKMPSNEHSFQNTKHTGTILIHIHIIDTNDNIPIVPRTLNLDISEDAKVGTLLARINGTDPDLGDNGKLHYHLMMDQTGISNFPFVIDSQTGSITVNRPLDADRLPQSNKHLRFKVLTSDFGKPISHSSYTVVDVRINDVNDETPQIKVIDLESRSNPPYPTVMENRQPGQLVAFVTATDADSGPNGALSCRINNPKFKLEQITLSSSIPDIQSNNNLNFYSFEPLSSQSLKEPLNTLDFKVVTSTELDRELSTIEIIEITCTDQPLNSETVRTGRTQFYVRILDENDNPPTFNTHKFQLDILENTPPDEIIFIFNATDPDYQNHLSGGNTHRINDPNYHYVHQQQQRQNLLGIQSTNRIKYVIDSNGQQYLRIDPDTGILYSKVKVDKKIVDKFKFNVTAMDNGHPPKNITAEVFINVIDQNDHAPKFEKQIFYYNLSEDMPVNSIVAILIAQDDDFGQNAEIIYKLDDLQGHSIKTFRLDRNNGTLWLRTPLDREKLDSYTFKVLAYDHGIPKQSSSCQVHIKVHDINDNAPKFVYPTHSNHTVYASVYTNPGIPLVKLTATDSDEGVNSQLTFHLLDESKEKDIFTVDPHTGELSLLPTVDPFNIGGRYQLKFEVRDGGTPSLSGYANINIILDSNSPQLSSFNNGKYQLTNIESSNSRNSYRSSILKSDNEVVHAANKEFDRIQSRYDIRDSHIYEPTYAQTILPISSHSNEKYRRKERVSTMTNQKPSTPFSLEKIWISVICLIAISTLVAFAFLVAITLARQKVATYELQRGSNHLTENFNLCQTEQCGSQFSVNSHRFTNLDNAYSPTKFQTLEKPDHKIHNNSCSNHDPTLYSPFVKYDTNTNSTTGSVHQLGFCTKEMTSINTDIQHSKPIYNHNIPITASSLQFPRKFQAVHNNNNNKTENLSSDKWISLMHVQHSAPASPNDYFSQRYKTIDQYQMNRNIPNQKYEILQPHQCSIDEYNNKISVSPNFANGLMKLNNMELSNPNITKTFCLDDKSLLYITPKGILKGCITELDENSHRNNDDDNNNNNNSNNNESKNVEMDVEKNTNSIVNHSLYCCNLNKQRQTIQMNDCIPKLNDIDHNEQLTMKVNKSITDSMNKSNQLSEIFSNQNDEQNPQLLLINKSQIEQNLLNINNNKYSSYNPIVTTISSHVSTFI
					

Structure Viewer

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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	28.7	Very low	34.5	Very low	144 Å²	144	86.3 Å²	86.3	71%	0.709	47%	0.472	S	S	*	.				0	156.8	0	-79.9	152.9	53.4	0	0	109.7	Y184	M1-Y184 HydrophobicContact CG-CD2 4.27Å
2	I	35.6	Very low	34.8	Very low	24 Å²	24	87.4 Å²	87.4	12%	0.123	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	116.5	172.8	-55.1	174	0	0	0	107.4	V16 L41 Y184 I185	I2-V16 HydrophobicContact CB-CG1 4.4Å; I2-V16 HydrophobicContact CD1-CG1 3.7Å; I2-V16 HydrophobicContact CG1-CG1 3.88Å; I2-V16 HydrophobicContact CG2-CB 4.47Å; I2-V16 HydrophobicContact CG2-CG1 3.66Å; I2-V16 HydrophobicContact CG2-CG2 3.92Å; I2-L41 HydrophobicContact CD1-CD1 3.58Å; I2-Y184 WeakPolarHBondContact O-CA 3.32Å; I2-Y184 WeakPolarHBondContact O-CB 3.47Å; I2-I185 PolarHBondContact N-O 2.75Å; I2-I185 PolarHBondContact O-N 3.02Å
3	C	32.2	Very low	35	Very low	63 Å²	63	90.1 Å²	90.1	43%	0.426	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.6	176.5	-62.3	0	0	0	0	110.1
4	C	37.2	Very low	35.2	Very low	26 Å²	26	87.6 Å²	87.6	18%	0.176	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.9	173.6	-66.8	0	0	0	0	110.1	L46 A183	C4-L46 HydrophobicContact CB-CD1 3.71Å; C4-A183 PolarHBondContact N-O 2.82Å
5	W	33.7	Very low	35.2	Very low	180 Å²	180	93.6 Å²	93.6	68%	0.682	51%	0.507	S	S	*	.			trans	-83.7	151.2	172.4	-86.3	35.4	0	0	0	111.4	M7 M182	W5-M7 PolarHBondContact O-N 3.11Å; W5-M182 PolarHBondContact NE1-SD 2.99Å
6	G	33.2	Very low	35.4	Very low	67 Å²	67	88.9 Å²	88.9	69%	0.691	48%	0.483	S	S	*	.	S	Bend	trans	-75.6	45.4	-171.7	0	0	0	0	0	115.9
7	M	29.2	Very low	35.6	Very low	127 Å²	127	88.1 Å²	88.1	63%	0.626	48%	0.483	S	S	*	.	S	Bend	trans	-126.5	156.3	173.4	-68.6	-158	178.9	0	0	112.5	W5 I9	W5-M7 PolarHBondContact O-N 3.11Å; M7-I9 VanDerWaalsContact C-N 3.26Å; M7-I9 HydrophobicContact CB-CD1 4.07Å; M7-I9 HydrophobicContact CB-CG1 4.33Å; M7-I9 PolarHBondContact O-N 3.11Å
8	N	36	Very low	36.1	Very low	146 Å²	146	86.8 Å²	86.8	78%	0.781	47%	0.472	S	S	*	.	S	Bend	trans	-77.3	68.1	-165.8	-163.2	6.6	0	0	0	112.4	T47	N8-T47 WeakPolarHBondContact OD1-CG2 3.29Å
9	I	31.9	Very low	36.6	Very low	101 Å²	101	89.5 Å²	89.5	52%	0.518	48%	0.475	S	S	.	.			trans	-119.8	144.8	-168	-63.5	173.7	0	0	0	109.7	M7 D13 I14	M7-I9 VanDerWaalsContact C-N 3.26Å; M7-I9 HydrophobicContact CB-CD1 4.07Å; M7-I9 HydrophobicContact CB-CG1 4.33Å; M7-I9 PolarHBondContact O-N 3.11Å; I9-D13 HydrophobicContact CG2-CB 3.7Å; I9-I14 HydrophobicContact CG2-CD1 4.49Å; I9-I14 HydrophobicContact CG2-CG1 4.24Å
10	S	40.2	Very low	37.3	Very low	50 Å²	50	86.2 Å²	86.2	35%	0.35	46%	0.458	S	S	.	.			trans	-76.9	145.5	175.8	-170.5	0	0	0	0	110.6	N12 D13	S10-N12 PolarHBondContact O-N 3.48Å; S10-N12 PolarHBondContact OG-N 2.89Å; S10-N12 PolarHBondContact OG-ND2 2.89Å; S10-D13 VanDerWaalsContact CB-OD2 3.27Å; S10-D13 WeakPolarHBondContact CB-OD2 3.41Å; S10-D13 PolarHBondContact N-OD2 3.2Å; S10-D13 VanDerWaalsContact N-OD2 3.13Å; S10-D13 WeakPolarHBondContact O-CB 3.41Å; S10-D13 PolarHBondContact O-N 3.07Å
11	I	41.9	Very low	37.6	Very low	21 Å²	21	88.2 Å²	88.2	11%	0.108	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-9.2	169	-74.6	173.4	0	0	0	111.7	D13 L41	I11-D13 VanDerWaalsContact C-N 3.32Å; I11-L41 HydrophobicContact CD1-CB 4.12Å
12	N	38.2	Very low	38.5	Very low	100 Å²	100	81.5 Å²	81.5	54%	0.535	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.7	166.9	-70	-51.9	0	0	0	114.7	S10 K18	S10-N12 PolarHBondContact O-N 3.48Å; S10-N12 PolarHBondContact OG-N 2.89Å; S10-N12 PolarHBondContact OG-ND2 2.89Å; N12-K18 PolarHBondContact OD1-NZ 2.72Å
13	D	36.6	Very low	38.9	Very low	122 Å²	122	83.9 Å²	83.9	65%	0.652	44%	0.436	S	S	*	.	S	Bend	trans	-94.5	-3	-179	-48.4	-51.5	0	0	0	112.5	I9 S10 I11	I9-D13 HydrophobicContact CG2-CB 3.7Å; S10-D13 VanDerWaalsContact CB-OD2 3.27Å; S10-D13 WeakPolarHBondContact CB-OD2 3.41Å; S10-D13 PolarHBondContact N-OD2 3.2Å; S10-D13 VanDerWaalsContact N-OD2 3.13Å; S10-D13 WeakPolarHBondContact O-CB 3.41Å; S10-D13 PolarHBondContact O-N 3.07Å; I11-D13 VanDerWaalsContact C-N 3.32Å
14	I	38	Very low	39.4	Very low	55 Å²	55	83.6 Å²	83.6	28%	0.282	43%	0.43	S	S	.	.	S	Bend	trans	-113.8	132.1	179.9	-50	177.7	0	0	0	108.9	I9 V16	I9-I14 HydrophobicContact CG2-CD1 4.49Å; I9-I14 HydrophobicContact CG2-CG1 4.24Å; I14-V16 HydrophobicContact CB-CG2 4.01Å; I14-V16 HydrophobicContact CG2-CG2 3.66Å; I14-V16 PolarHBondContact O-N 3.28Å
15	N	35.7	Very low	39.6	Very low	178 Å²	178	88 Å²	88	95%	0.952	45%	0.446	S	S	*	.			trans	-72.9	72.8	177	-90.8	-13.2	0	0	0	111.9
16	V	38.1	Very low	39.8	Very low	19 Å²	19	87.3 Å²	87.3	12%	0.115	45%	0.451	C	S	.	.			trans	-99.5	137.2	176.2	-177.1	0	0	0	0	110.1	I2 I14 K18	I2-V16 HydrophobicContact CB-CG1 4.4Å; I2-V16 HydrophobicContact CD1-CG1 3.7Å; I2-V16 HydrophobicContact CG1-CG1 3.88Å; I2-V16 HydrophobicContact CG2-CB 4.47Å; I2-V16 HydrophobicContact CG2-CG1 3.66Å; I2-V16 HydrophobicContact CG2-CG2 3.92Å; I14-V16 HydrophobicContact CB-CG2 4.01Å; I14-V16 HydrophobicContact CG2-CG2 3.66Å; I14-V16 PolarHBondContact O-N 3.28Å; V16-K18 PolarHBondContact O-N 3.1Å
17	P	39.5	Very low	39.9	Very low	74 Å²	74	91 Å²	91	48%	0.481	45%	0.45	S	S	.	.			trans	-59.1	104.1	171.5	-24.5	34.9	0	0	0	111.8	Y19	P17-Y19 PolarHBondContact O-N 2.76Å
18	K	44.3	Very low	40.1	Very low	66 Å²	66	88.1 Å²	88.1	29%	0.287	44%	0.443	S	S	.	.			trans	-74.3	-11.6	-179.8	-61.9	-172.6	-176.2	-180	0	113.2	N12 V16 N36 I37 G38	N12-K18 PolarHBondContact OD1-NZ 2.72Å; V16-K18 PolarHBondContact O-N 3.1Å; K18-N36 PolarHBondContact O-OD1 2.79Å; K18-I37 PolarHBondContact O-N 3.34Å; K18-G38 PolarHBondContact O-N 3.1Å
19	Y	46.1	Very low	40	Very low	137 Å²	137	87.4 Å²	87.4	54%	0.537	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.6	-172.7	-55.2	-76.5	0	0	0	111.4	P17 V34 I35 N36	P17-Y19 PolarHBondContact O-N 2.76Å; Y19-V34 HydrophobicContact CD1-CG1 3.84Å; Y19-V34 HydrophobicContact CG-CG1 4.06Å; Y19-I35 CarbonylContact C-O 3.55Å; Y19-I35 WeakPolarHBondContact CA-O 3.22Å; Y19-N36 HydrophobicContact CD1-CB 3.9Å; Y19-N36 HydrophobicContact CE1-CB 3.86Å
20	V	49.2	Very low	40.2	Very low	23 Å²	23	86.7 Å²	86.7	14%	0.139	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	122.8	164.6	-176.9	0	0	0	0	107.8	V34 I35 I37 I223	V20-V34 WeakPolarHBondContact O-CA 3.34Å; V20-I35 HydrophobicContact CB-CB 4.39Å; V20-I35 PolarHBondContact N-O 3.06Å; V20-I35 PolarHBondContact O-N 3.35Å; V20-I37 HydrophobicContact CG2-CD1 3.87Å; V20-I37 HydrophobicContact CG2-CG1 4.32Å; V20-I37 HydrophobicContact CG2-CG2 4.21Å; V20-I223 HydrophobicContact CG1-CG2 4.08Å
21	R	44.5	Very low	40.3	Very low	130 Å²	130	84.8 Å²	84.8	49%	0.491	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.2	179.4	-178.4	172	-102.5	176.3	-12.5	109.6	T32	R21-T32 HydrophobicContact CG-CG2 3.57Å
22	I	48	Very low	40.4	Very low	3 Å²	3	84.8 Å²	84.8	2%	0.015	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	116.1	177.5	-69.6	177.5	0	0	0	106.5	V33 I35 V189 I221	I22-V33 HydrophobicContact CB-CB 4.15Å; I22-V33 HydrophobicContact CG2-CB 4.3Å; I22-V33 PolarHBondContact N-O 3.15Å; I22-V33 PolarHBondContact O-N 3.07Å; I22-I35 HydrophobicContact CD1-CD1 3.76Å; I22-I35 HydrophobicContact CD1-CG1 4.38Å; I22-V189 HydrophobicContact CD1-CG1 4.29Å; I22-I221 HydrophobicContact CB-CG2 4.07Å; I22-I221 HydrophobicContact CG1-CG2 3.96Å; I22-I221 HydrophobicContact CG2-CG2 3.75Å
23	K	44.1	Very low	40.9	Very low	74 Å²	74	80.1 Å²	80.1	32%	0.322	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.7	-172.6	-178	176.3	155.7	-147.9	0	109.7	K25 E222	K23-K25 PolarHBondContact O-N 3.08Å; K23-E222 VanDerWaalsContact CD-OE2 3.31Å; K23-E222 WeakPolarHBondContact CD-OE2 3.43Å; K23-E222 WeakPolarHBondContact CE-OE2 3.26Å; K23-E222 IonicContact NZ-OE1 3.67Å; K23-E222 IonicContact NZ-OE2 2.76Å; K23-E222 PolarHBondContact NZ-OE2 2.69Å
24	L	42.9	Very low	41.4	Very low	57 Å²	57	75.3 Å²	75.3	30%	0.298	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-91.1	79.1	-172.5	-63.4	175.3	0	0	0	112	G31	L24-G31 PolarHBondContact N-O 3Å
25	K	41.3	Very low	42.1	Very low	117 Å²	117	73.5 Å²	73.5	51%	0.509	38%	0.38	S	S	.	.			trans	66.8	154.3	178.9	-158.1	-179.4	177	-171.9	0	114.6	K23	K23-K25 PolarHBondContact O-N 3.08Å
26	E	36.2	Very low	43	Very low	166 Å²	166	65.6 Å²	65.6	78%	0.776	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-28.1	-163.8	-63.7	177	103.9	0	0	115.9	S28	E26-S28 VanDerWaalsContact C-N 3.31Å; E26-S28 PolarHBondContact O-N 2.76Å
27	E	35.2	Very low	43.8	Very low	145 Å²	145	65.4 Å²	65.4	68%	0.678	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	8.2	-171.6	-59.6	-169.5	129.8	0	0	114.8	Q108	E27-Q108 PolarHBondContact OE2-NE2 2.93Å
28	S	34.8	Very low	44.2	Very low	67 Å²	67	62 Å²	62	47%	0.469	32%	0.315	S	S	.	.			trans	-114.6	103.4	-169.3	-64.5	0	0	0	0	113.3	E26 S30	E26-S28 VanDerWaalsContact C-N 3.31Å; E26-S28 PolarHBondContact O-N 2.76Å; S28-S30 PolarHBondContact O-N 3.44Å
29	P	33.1	Very low	44.6	Very low	130 Å²	130	63.6 Å²	63.6	84%	0.844	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	7.3	-178.9	-21.2	34.2	0	0	0	116.8
30	S	37.1	Very low	45	Very low	86 Å²	86	58.4 Å²	58.4	60%	0.601	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.2	29.3	-166.1	62.4	0	0	0	0	113.6	S28	S28-S30 PolarHBondContact O-N 3.44Å
31	G	42.7	Very low	45	Very low	11 Å²	11	57.7 Å²	57.7	11%	0.113	30%	0.299	C	S	.	.			trans	-123.8	34.6	-167.5	0	0	0	0	0	115.4	L24	L24-G31 PolarHBondContact N-O 3Å
32	T	43.3	Very low	45.3	Very low	20 Å²	20	54.3 Å²	54.3	12%	0.123	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.2	-177.8	-31.1	0	0	0	0	112.8	R21 V34 E75	R21-T32 HydrophobicContact CG-CG2 3.57Å; T32-V34 HydrophobicContact CG2-CG2 3.98Å; T32-E75 WeakPolarHBondContact CB-OE2 3.4Å; T32-E75 PolarHBondContact O-N 3.03Å; T32-E75 PolarHBondContact OG1-OE2 3.44Å
33	V	47.3	Very low	45.3	Very low	3 Å²	3	57 Å²	57	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.4	166.4	-179.5	0	0	0	0	108.4	I22 L72 M96	I22-V33 HydrophobicContact CB-CB 4.15Å; I22-V33 HydrophobicContact CG2-CB 4.3Å; I22-V33 PolarHBondContact N-O 3.15Å; I22-V33 PolarHBondContact O-N 3.07Å; V33-L72 HydrophobicContact CG1-CD1 4.06Å; V33-L72 HydrophobicContact CG1-CD2 3.88Å; V33-L72 HydrophobicContact CG1-CG 3.93Å; V33-M96 HydrophobicContact CG2-CE 3.42Å; V33-M96 VanDerWaalsContact CG2-CE 3.42Å; V33-M96 HydrophobicContact CG2-SD 3.88Å
34	V	47.1	Very low	45.5	Very low	21 Å²	21	55.4 Å²	55.4	13%	0.127	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	114.5	-176	-175	0	0	0	0	109.4	Y19 V20 T32 V73	Y19-V34 HydrophobicContact CD1-CG1 3.84Å; Y19-V34 HydrophobicContact CG-CG1 4.06Å; V20-V34 WeakPolarHBondContact O-CA 3.34Å; T32-V34 HydrophobicContact CG2-CG2 3.98Å; V34-V73 WeakPolarHBondContact CA-O 3.43Å; V34-V73 HydrophobicContact CB-CB 4.36Å; V34-V73 PolarHBondContact N-O 2.96Å; V34-V73 PolarHBondContact O-N 3.36Å; V34-V73 VanDerWaalsContact O-O 3.12Å
35	I	53.7	Low	45.5	Very low	16 Å²	16	56 Å²	56	8%	0.082	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	114.2	177.2	-52.4	179.5	0	0	0	108.1	Y19 V20 I22 I37 L72	Y19-I35 CarbonylContact C-O 3.55Å; Y19-I35 WeakPolarHBondContact CA-O 3.22Å; V20-I35 HydrophobicContact CB-CB 4.39Å; V20-I35 PolarHBondContact N-O 3.06Å; V20-I35 PolarHBondContact O-N 3.35Å; I22-I35 HydrophobicContact CD1-CD1 3.76Å; I22-I35 HydrophobicContact CD1-CG1 4.38Å; I35-I37 HydrophobicContact CG2-CG2 4.12Å; I35-I37 PolarHBondContact O-N 3.36Å; I35-L72 HydrophobicContact CG1-CD1 4.28Å
36	N	54.4	Low	45.5	Very low	13 Å²	13	55 Å²	55	7%	0.07	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	109	172.4	179.8	4.8	0	0	0	109.6	K18 Y19 G38 S71	K18-N36 PolarHBondContact O-OD1 2.79Å; Y19-N36 HydrophobicContact CD1-CB 3.9Å; Y19-N36 HydrophobicContact CE1-CB 3.86Å; N36-G38 PolarHBondContact OD1-N 2.81Å; N36-G38 VanDerWaalsContact OD1-N 3.08Å; N36-S71 WeakPolarHBondContact CB-O 3.4Å; N36-S71 WeakPolarHBondContact CB-OG 3.42Å; N36-S71 PolarHBondContact N-O 2.9Å; N36-S71 PolarHBondContact ND2-OG 2.99Å; N36-S71 VanDerWaalsContact ND2-OG 3.14Å
37	I	55.9	Low	45.4	Very low	14 Å²	14	50.4 Å²	50.4	7%	0.072	30%	0.295	C	S	.	.			trans	-99.4	-12.8	173.7	60	166.9	0	0	0	112.1	K18 V20 I35 E39 F40 L41	K18-I37 PolarHBondContact O-N 3.34Å; V20-I37 HydrophobicContact CG2-CD1 3.87Å; V20-I37 HydrophobicContact CG2-CG1 4.32Å; V20-I37 HydrophobicContact CG2-CG2 4.21Å; I35-I37 HydrophobicContact CG2-CG2 4.12Å; I35-I37 PolarHBondContact O-N 3.36Å; I37-E39 PolarHBondContact O-N 2.91Å; I37-F40 WeakPolarHBondContact O-CB 3.5Å; I37-F40 PolarHBondContact O-N 2.88Å; I37-F40 VanDerWaalsContact O-N 3.16Å; I37-L41 HydrophobicContact CD1-CD1 4.38Å; I37-L41 PolarHBondContact O-N 2.66Å; I37-L41 VanDerWaalsContact O-N 3.11Å
38	G	46.3	Very low	45.3	Very low	4 Å²	4	51.4 Å²	51.4	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-61	-39.6	-177.6	0	0	0	0	0	113.6	K18 N36 N42	K18-G38 PolarHBondContact O-N 3.1Å; N36-G38 PolarHBondContact OD1-N 2.81Å; N36-G38 VanDerWaalsContact OD1-N 3.08Å; G38-N42 WeakPolarHBondContact O-CB 3.36Å; G38-N42 PolarHBondContact O-N 3.28Å; G38-N42 PolarHBondContact O-ND2 3.01Å
39	E	53.6	Low	45.4	Very low	98 Å²	98	54.5 Å²	54.5	46%	0.458	31%	0.307	S	S	.	.	H	α-helix	trans	-72	-29	176.6	-65.5	-174	-170.7	0	0	113.2	I37 S43 S69	I37-E39 PolarHBondContact O-N 2.91Å; E39-S43 PolarHBondContact O-N 3.34Å; E39-S69 WeakPolarHBondContact OE2-CB 3.47Å
40	F	54.4	Low	45.4	Very low	28 Å²	28	55 Å²	55	12%	0.123	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-51.8	174.6	179.9	-109.6	0	0	0	110.2	I37 N42 S43 P67 L70 F158	I37-F40 WeakPolarHBondContact O-CB 3.5Å; I37-F40 PolarHBondContact O-N 2.88Å; I37-F40 VanDerWaalsContact O-N 3.16Å; F40-N42 PolarHBondContact O-N 3.2Å; F40-S43 WeakPolarHBondContact O-CB 3.25Å; F40-S43 PolarHBondContact O-N 3.02Å; F40-S43 VanDerWaalsContact O-N 3.08Å; F40-S43 PolarHBondContact O-OG 2.95Å; F40-P67 HydrophobicContact CD2-CG 3.75Å; F40-P67 HydrophobicContact CE2-CG 4.07Å; F40-L70 HydrophobicContact CB-CD1 3.92Å; F40-L70 HydrophobicContact CD2-CD1 3.76Å; F40-L70 HydrophobicContact CG-CD1 3.97Å; F40-F158 HydrophobicContact CD1-CE1 4.07Å; F40-F158 HydrophobicContact CD1-CZ 4.32Å; F40-F158 HydrophobicContact CE1-CD1 4.21Å; F40-F158 AromaticContact CE1-CE1 3.89Å; F40-F158 HydrophobicContact CE1-CE1 3.89Å; F40-F158 HydrophobicContact CE1-CZ 4.14Å
41	L	50.4	Low	45.2	Very low	9 Å²	9	57.2 Å²	57.2	5%	0.047	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-38.9	-179.5	-63.5	172.4	0	0	0	112.5	I2 I11 I37 S43 I44 I185	I2-L41 HydrophobicContact CD1-CD1 3.58Å; I11-L41 HydrophobicContact CD1-CB 4.12Å; I37-L41 HydrophobicContact CD1-CD1 4.38Å; I37-L41 PolarHBondContact O-N 2.66Å; I37-L41 VanDerWaalsContact O-N 3.11Å; L41-S43 PolarHBondContact O-N 3.49Å; L41-S43 VanDerWaalsContact O-N 3.16Å; L41-I44 PolarHBondContact O-N 2.77Å; L41-I44 VanDerWaalsContact O-N 3.17Å; L41-I185 HydrophobicContact CD2-CD1 4.03Å
42	N	49.4	Very low	45	Very low	59 Å²	59	60 Å²	60	32%	0.316	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.5	174	-85.6	-82.1	0	0	0	114	G38 F40 I44	G38-N42 WeakPolarHBondContact O-CB 3.36Å; G38-N42 PolarHBondContact O-N 3.28Å; G38-N42 PolarHBondContact O-ND2 3.01Å; F40-N42 PolarHBondContact O-N 3.2Å; N42-I44 VanDerWaalsContact C-N 3.27Å; N42-I44 PolarHBondContact O-N 3.18Å
43	S	48.9	Very low	44.8	Very low	60 Å²	60	67 Å²	67	42%	0.42	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.1	176.6	77.5	0	0	0	0	114.1	E39 F40 L41 P45	E39-S43 PolarHBondContact O-N 3.34Å; F40-S43 WeakPolarHBondContact O-CB 3.25Å; F40-S43 PolarHBondContact O-N 3.02Å; F40-S43 VanDerWaalsContact O-N 3.08Å; F40-S43 PolarHBondContact O-OG 2.95Å; L41-S43 PolarHBondContact O-N 3.49Å; L41-S43 VanDerWaalsContact O-N 3.16Å; S43-P45 VanDerWaalsContact O-CD 3.32Å; S43-P45 WeakPolarHBondContact O-CD 3.45Å
44	I	48.5	Very low	44.7	Very low	40 Å²	40	71.8 Å²	71.8	21%	0.205	39%	0.392	C	S	.	.	S	Bend	trans	-107.6	97.7	-178.5	-52.7	175.6	0	0	0	109.3	L41 N42 L46	L41-I44 PolarHBondContact O-N 2.77Å; L41-I44 VanDerWaalsContact O-N 3.17Å; N42-I44 VanDerWaalsContact C-N 3.27Å; N42-I44 PolarHBondContact O-N 3.18Å; I44-L46 PolarHBondContact O-N 2.7Å
45	P	42	Very low	44.6	Very low	68 Å²	68	72 Å²	72	44%	0.442	40%	0.396	S	S	.	.			trans	-72.8	112.9	177	28.5	-33.4	0	0	0	110.9	S43 T47	S43-P45 VanDerWaalsContact O-CD 3.32Å; S43-P45 WeakPolarHBondContact O-CD 3.45Å; P45-T47 PolarHBondContact O-N 2.83Å
46	L	41.8	Very low	44.2	Very low	97 Å²	97	75.3 Å²	75.3	51%	0.508	41%	0.414	S	S	.	.			trans	-80.3	43.8	178.1	-68.9	169.5	0	0	0	112.6	C4 I44	C4-L46 HydrophobicContact CB-CD1 3.71Å; I44-L46 PolarHBondContact O-N 2.7Å
47	T	34.2	Very low	43.8	Very low	70 Å²	70	80 Å²	80	43%	0.429	44%	0.435	S	S	.	.			trans	-101	110.6	-174	56.5	0	0	0	0	111.9	N8 P45	N8-T47 WeakPolarHBondContact OD1-CG2 3.29Å; P45-T47 PolarHBondContact O-N 2.83Å
48	N	31.7	Very low	43.3	Very low	165 Å²	165	81.6 Å²	81.6	88%	0.882	44%	0.444	S	S	*	.			trans	51.8	75	170.8	-64	9.3	0	0	0	115.7
49	Y	36.9	Very low	43.4	Very low	133 Å²	133	83.2 Å²	83.2	52%	0.522	45%	0.452	S	S	.	.			trans	-92.2	108.9	162.2	-82.6	-84.7	0	0	0	110.8
50	D	34	Very low	43.2	Very low	140 Å²	140	81.7 Å²	81.7	75%	0.749	44%	0.443	S	S	*	.			trans	-74	152.4	177.6	-159.2	-6.6	0	0	0	111.5	S52	D50-S52 PolarHBondContact O-N 3.19Å
51	T	33.8	Very low	42.9	Very low	132 Å²	132	85.7 Å²	85.7	81%	0.81	46%	0.461	S	S	*	.	S	Bend	trans	-75.2	77.7	-159.1	58.6	0	0	0	0	113.8
52	S	36.5	Very low	42.6	Very low	70 Å²	70	91.2 Å²	91.2	49%	0.49	48%	0.481	S	S	.	.	S	Bend	trans	-148.3	157.7	174.4	66.9	0	0	0	0	112.3	D50 N54	D50-S52 PolarHBondContact O-N 3.19Å; S52-N54 PolarHBondContact O-N 2.8Å; S52-N54 PolarHBondContact OG-ND2 3.25Å; S52-N54 VanDerWaalsContact OG-ND2 3.16Å
53	N	40.8	Very low	42.4	Very low	167 Å²	167	89.5 Å²	89.5	89%	0.893	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	27.6	-168.3	-61.3	-4.3	0	0	0	115.9
54	N	44.2	Very low	41.9	Very low	103 Å²	103	91.1 Å²	91.1	55%	0.551	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-15.7	-173.7	-70.1	-62.7	0	0	0	114.7	S52 D56 H57 D58	S52-N54 PolarHBondContact O-N 2.8Å; S52-N54 PolarHBondContact OG-ND2 3.25Å; S52-N54 VanDerWaalsContact OG-ND2 3.16Å; N54-D56 PolarHBondContact O-N 2.83Å; N54-H57 PolarHBondContact O-N 3.28Å; N54-D58 PolarHBondContact O-N 2.76Å; N54-D58 VanDerWaalsContact O-N 3.16Å
55	A	44.4	Very low	41.7	Very low	25 Å²	25	95.1 Å²	95.1	21%	0.207	50%	0.495	C	S	.	.	H	α-helix	trans	-62	-42.5	-173.8	0	0	0	0	0	113.3	H57 D58 L59 Y162	A55-H57 VanDerWaalsContact C-N 3.33Å; A55-H57 PolarHBondContact O-N 3.4Å; A55-D58 PolarHBondContact O-N 3Å; A55-L59 PolarHBondContact O-N 2.73Å; A55-Y162 WeakPolarHBondContact CB-OH 3.24Å
56	D	46.1	Very low	41.8	Very low	86 Å²	86	94.9 Å²	94.9	46%	0.46	49%	0.493	S	S	.	.	H	α-helix	trans	-63.5	-38.4	177.1	-172.5	47	0	0	0	111.9	N54 D58 L59 K60	N54-D56 PolarHBondContact O-N 2.83Å; D56-D58 VanDerWaalsContact C-N 3.34Å; D56-D58 PolarHBondContact O-N 3.36Å; D56-L59 PolarHBondContact O-N 2.87Å; D56-K60 VanDerWaalsContact O-CG 3.3Å; D56-K60 WeakPolarHBondContact O-CG 3.1Å; D56-K60 PolarHBondContact O-N 2.9Å; D56-K60 VanDerWaalsContact O-N 3.08Å; D56-K60 VanDerWaalsContact OD1-CE 3.26Å; D56-K60 WeakPolarHBondContact OD1-CE 3.35Å; D56-K60 WeakPolarHBondContact OD2-CE 3.44Å; D56-K60 IonicContact OD2-NZ 3.79Å
57	H	45.7	Very low	41.8	Very low	111 Å²	111	91.9 Å²	91.9	51%	0.514	48%	0.479	S	S	.	.	H	α-helix	trans	-66.3	-34.7	176.4	-164.9	-13.5	0	0	0	112.4	N54 A55 K61	N54-H57 PolarHBondContact O-N 3.28Å; A55-H57 VanDerWaalsContact C-N 3.33Å; A55-H57 PolarHBondContact O-N 3.4Å; H57-K61 WeakPolarHBondContact O-CB 3.43Å; H57-K61 WeakPolarHBondContact O-CG 3.4Å; H57-K61 PolarHBondContact O-N 3.35Å
58	D	46.2	Very low	42.1	Very low	48 Å²	48	94.8 Å²	94.8	26%	0.257	50%	0.502	S	S	.	.	H	α-helix	trans	-80.7	-28.9	179.8	-132.9	54.1	0	0	0	112.7	N54 A55 D56 K61 R62	N54-D58 PolarHBondContact O-N 2.76Å; N54-D58 VanDerWaalsContact O-N 3.16Å; A55-D58 PolarHBondContact O-N 3Å; D56-D58 VanDerWaalsContact C-N 3.34Å; D56-D58 PolarHBondContact O-N 3.36Å; D58-K61 PolarHBondContact O-N 2.81Å; D58-K61 WeakPolarHBondContact OD1-CD 3.45Å; D58-K61 IonicContact OD1-NZ 3.88Å; D58-R62 WeakPolarHBondContact O-CG 3.25Å; D58-R62 PolarHBondContact O-N 2.87Å; D58-R62 VanDerWaalsContact O-N 3.1Å; D58-R62 IonicContact OD2-NE 3.59Å
59	L	47.9	Very low	42.6	Very low	39 Å²	39	88 Å²	88	20%	0.204	47%	0.468	C	S	.	.	H	α-helix	trans	-62.3	-51.5	167.4	-162.6	84.3	0	0	0	110.6	A55 D56 K61 R62 M63 M160	A55-L59 PolarHBondContact O-N 2.73Å; D56-L59 PolarHBondContact O-N 2.87Å; L59-K61 VanDerWaalsContact C-N 3.27Å; L59-K61 PolarHBondContact O-N 2.73Å; L59-R62 PolarHBondContact O-N 2.94Å; L59-M63 HydrophobicContact CD2-SD 4.37Å; L59-M63 HydrophobicContact CG-SD 4.46Å; L59-M63 WeakPolarHBondContact O-CG 3.48Å; L59-M63 PolarHBondContact O-N 2.85Å; L59-M160 HydrophobicContact CD1-CE 4.47Å; L59-M160 HydrophobicContact CD2-CB 4.41Å; L59-M160 HydrophobicContact CD2-CE 4.14Å
60	K	48.4	Very low	43.1	Very low	65 Å²	65	82.6 Å²	82.6	28%	0.283	45%	0.448	S	S	.	.	H	α-helix	trans	-59	-35.8	176.2	-67.2	169.7	-167.1	-74.8	0	112.3	D56 L64 E90	D56-K60 VanDerWaalsContact O-CG 3.3Å; D56-K60 WeakPolarHBondContact O-CG 3.1Å; D56-K60 PolarHBondContact O-N 2.9Å; D56-K60 VanDerWaalsContact O-N 3.08Å; D56-K60 VanDerWaalsContact OD1-CE 3.26Å; D56-K60 WeakPolarHBondContact OD1-CE 3.35Å; D56-K60 WeakPolarHBondContact OD2-CE 3.44Å; D56-K60 IonicContact OD2-NZ 3.79Å; K60-L64 PolarHBondContact O-N 2.85Å; K60-E90 IonicContact NZ-OE1 2.85Å; K60-E90 PolarHBondContact NZ-OE1 2.7Å; K60-E90 IonicContact NZ-OE2 2.89Å; K60-E90 PolarHBondContact NZ-OE2 3.47Å
61	K	48.3	Very low	43.6	Very low	113 Å²	113	77.1 Å²	77.1	49%	0.491	42%	0.42	S	S	.	.	H	α-helix	trans	-64.6	-33.3	171.6	-89.1	173.9	177.9	166.9	0	114.1	H57 D58 L59	H57-K61 WeakPolarHBondContact O-CB 3.43Å; H57-K61 WeakPolarHBondContact O-CG 3.4Å; H57-K61 PolarHBondContact O-N 3.35Å; D58-K61 PolarHBondContact O-N 2.81Å; D58-K61 WeakPolarHBondContact OD1-CD 3.45Å; D58-K61 IonicContact OD1-NZ 3.88Å; L59-K61 VanDerWaalsContact C-N 3.27Å; L59-K61 PolarHBondContact O-N 2.73Å
62	R	45.5	Very low	44.3	Very low	125 Å²	125	71.5 Å²	71.5	47%	0.472	39%	0.385	S	S	.	.	H	α-helix	trans	-83.8	-32.4	180	-70.7	179.3	-174.1	-127.6	2.9	112.4	D58 L59 L64 I65	D58-R62 WeakPolarHBondContact O-CG 3.25Å; D58-R62 PolarHBondContact O-N 2.87Å; D58-R62 VanDerWaalsContact O-N 3.1Å; D58-R62 IonicContact OD2-NE 3.59Å; L59-R62 PolarHBondContact O-N 2.94Å; R62-L64 PolarHBondContact O-N 3.4Å; R62-I65 PolarHBondContact O-N 3.48Å; R62-I65 VanDerWaalsContact O-N 3.16Å
63	M	44.9	Very low	44.8	Very low	23 Å²	23	71.7 Å²	71.7	11%	0.113	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-21.5	170.6	-68.2	175	75.7	0	0	113	L59 I65 L85 E90	L59-M63 HydrophobicContact CD2-SD 4.37Å; L59-M63 HydrophobicContact CG-SD 4.46Å; L59-M63 WeakPolarHBondContact O-CG 3.48Å; L59-M63 PolarHBondContact O-N 2.85Å; M63-I65 PolarHBondContact O-N 2.87Å; M63-I65 VanDerWaalsContact O-N 3.09Å; M63-L85 WeakPolarHBondContact O-CD1 3.42Å; M63-L85 WeakPolarHBondContact O-CD2 3.48Å; M63-E90 HydrophobicContact CE-CB 4.35Å; M63-E90 WeakPolarHBondContact CE-O 3.4Å
64	L	38.1	Very low	45	Very low	93 Å²	93	65.2 Å²	65.2	49%	0.487	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-6.9	173.7	-84.7	162.1	0	0	0	115.1	K60 R62 K87	K60-L64 PolarHBondContact O-N 2.85Å; R62-L64 PolarHBondContact O-N 3.4Å; L64-K87 HydrophobicContact CD2-CD 3.71Å; L64-K87 HydrophobicContact CD2-CG 4.22Å
65	I	43.6	Very low	44.9	Very low	124 Å²	124	65.2 Å²	65.2	64%	0.636	35%	0.348	S	S	*	.	S	Bend	trans	-120.6	121	174.9	-56.2	174.6	0	0	0	108.4	R62 M63 P67	R62-I65 PolarHBondContact O-N 3.48Å; R62-I65 VanDerWaalsContact O-N 3.16Å; M63-I65 PolarHBondContact O-N 2.87Å; M63-I65 VanDerWaalsContact O-N 3.09Å; I65-P67 VanDerWaalsContact O-CD 3.24Å; I65-P67 WeakPolarHBondContact O-CD 3.42Å
66	V	44.6	Very low	45	Very low	64 Å²	64	65 Å²	65	39%	0.388	34%	0.342	S	S	.	.			trans	-73.2	113.1	165.8	-179.7	0	0	0	0	107.6	F83 L85	V66-F83 HydrophobicContact CG1-CB 4.47Å; V66-L85 HydrophobicContact CG2-CB 3.84Å; V66-L85 HydrophobicContact CG2-CD1 4.01Å
67	P	41	Very low	44.7	Very low	34 Å²	34	66.8 Å²	66.8	22%	0.221	36%	0.359	C	S	.	.			trans	-79.6	145.9	-179.4	32.8	-31.2	0	0	0	110	F40 I65 S69 L70	F40-P67 HydrophobicContact CD2-CG 3.75Å; F40-P67 HydrophobicContact CE2-CG 4.07Å; I65-P67 VanDerWaalsContact O-CD 3.24Å; I65-P67 WeakPolarHBondContact O-CD 3.42Å; P67-S69 PolarHBondContact O-N 2.82Å; P67-L70 HydrophobicContact CG-CD1 4.41Å; P67-L70 PolarHBondContact O-N 2.95Å
68	S	40.7	Very low	44.9	Very low	130 Å²	130	63 Å²	63	91%	0.909	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-2.1	179.4	53.9	0	0	0	0	114.7
69	S	42.9	Very low	45	Very low	24 Å²	24	62.2 Å²	62.2	17%	0.168	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-8.2	179.2	48.7	0	0	0	0	114.8	E39 P67 S71	E39-S69 WeakPolarHBondContact OE2-CB 3.47Å; P67-S69 PolarHBondContact O-N 2.82Å; S69-S71 PolarHBondContact O-N 2.95Å
70	L	46.9	Very low	45	Very low	19 Å²	19	63.3 Å²	63.3	10%	0.099	35%	0.35	C	S	.	.			trans	-69.7	98	172.5	-120.4	86.5	0	0	0	110.1	F40 P67 F83 I92	F40-L70 HydrophobicContact CB-CD1 3.92Å; F40-L70 HydrophobicContact CD2-CD1 3.76Å; F40-L70 HydrophobicContact CG-CD1 3.97Å; P67-L70 HydrophobicContact CG-CD1 4.41Å; P67-L70 PolarHBondContact O-N 2.95Å; L70-F83 HydrophobicContact CB-CE2 4.37Å; L70-F83 HydrophobicContact CB-CZ 4.29Å; L70-F83 HydrophobicContact CD2-CD1 4.2Å; L70-F83 HydrophobicContact CD2-CE1 3.85Å; L70-F83 HydrophobicContact CD2-CZ 4.21Å; L70-F83 WeakPolarHBondContact O-CE2 3.35Å; L70-I92 HydrophobicContact CD2-CD1 3.92Å
71	S	46	Very low	45.1	Very low	24 Å²	24	66.4 Å²	66.4	17%	0.168	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	114	-176.1	48.3	0	0	0	0	112.1	N36 S69	N36-S71 WeakPolarHBondContact CB-O 3.4Å; N36-S71 WeakPolarHBondContact CB-OG 3.42Å; N36-S71 PolarHBondContact N-O 2.9Å; N36-S71 PolarHBondContact ND2-OG 2.99Å; N36-S71 VanDerWaalsContact ND2-OG 3.14Å; S69-S71 PolarHBondContact O-N 2.95Å
72	L	47.2	Very low	45	Very low	14 Å²	14	63.1 Å²	63.1	7%	0.073	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	103.1	173.5	-172.5	145.2	0	0	0	109.3	V33 I35 V79 R81 F83	V33-L72 HydrophobicContact CG1-CD1 4.06Å; V33-L72 HydrophobicContact CG1-CD2 3.88Å; V33-L72 HydrophobicContact CG1-CG 3.93Å; I35-L72 HydrophobicContact CG1-CD1 4.28Å; L72-V79 HydrophobicContact CD2-CG1 4.39Å; L72-R81 HydrophobicContact CB-CG 4.42Å; L72-R81 PolarHBondContact O-NE 3.35Å; L72-R81 PolarHBondContact O-NH2 2.81Å; L72-F83 HydrophobicContact CB-CZ 4.21Å
73	V	46.7	Very low	45	Very low	74 Å²	74	60 Å²	60	45%	0.448	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123.3	176.8	-178.9	0	0	0	0	107.7	V34	V34-V73 WeakPolarHBondContact CA-O 3.43Å; V34-V73 HydrophobicContact CB-CB 4.36Å; V34-V73 PolarHBondContact N-O 2.96Å; V34-V73 PolarHBondContact O-N 3.36Å; V34-V73 VanDerWaalsContact O-O 3.12Å
74	S	45	Very low	45	Very low	31 Å²	31	65 Å²	65	22%	0.217	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.5	174.1	-172.7	0	0	0	0	109.4	I76	S74-I76 PolarHBondContact O-N 2.98Å; S74-I76 PolarHBondContact OG-N 3.04Å
75	E	43.4	Very low	45.4	Very low	104 Å²	104	62.2 Å²	62.2	49%	0.486	34%	0.341	S	S	.	.	S	Bend	trans	-77.1	-8.6	171.4	-67.5	166.8	-179.7	0	0	111.4	T32	T32-E75 WeakPolarHBondContact CB-OE2 3.4Å; T32-E75 PolarHBondContact O-N 3.03Å; T32-E75 PolarHBondContact OG1-OE2 3.44Å
76	I	46.8	Very low	45.6	Very low	19 Å²	19	58.5 Å²	58.5	10%	0.097	32%	0.322	C	S	.	.	S	Bend	trans	-89.9	119.2	178.9	-54.7	173.6	0	0	0	109.6	S74 S78 V79 T102	S74-I76 PolarHBondContact O-N 2.98Å; S74-I76 PolarHBondContact OG-N 3.04Å; I76-S78 PolarHBondContact O-N 2.81Å; I76-V79 HydrophobicContact CB-CG2 3.8Å; I76-V79 HydrophobicContact CG2-CG2 3.97Å; I76-T102 HydrophobicContact CG2-CG2 3.73Å
77	P	39.9	Very low	45.4	Very low	124 Å²	124	62.4 Å²	62.4	81%	0.805	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-13.9	-174.5	-25.3	35.3	0	0	0	116.4
78	S	48.2	Very low	45.6	Very low	31 Å²	31	69.5 Å²	69.5	22%	0.217	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	2	-166.6	-40.4	0	0	0	0	114.5	I76 T102	I76-S78 PolarHBondContact O-N 2.81Å; S78-T102 PolarHBondContact OG-OG1 3.45Å
79	V	48.2	Very low	46	Very low	32 Å²	32	66.4 Å²	66.4	19%	0.194	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-88.3	122.8	-163.2	179.4	0	0	0	0	113.4	L72 I76 M96 A97	L72-V79 HydrophobicContact CD2-CG1 4.39Å; I76-V79 HydrophobicContact CB-CG2 3.8Å; I76-V79 HydrophobicContact CG2-CG2 3.97Å; V79-M96 HydrophobicContact CB-CE 4.33Å; V79-M96 HydrophobicContact CG1-CE 3.77Å; V79-M96 HydrophobicContact CG1-CG 3.72Å; V79-M96 HydrophobicContact CG2-CE 3.52Å; V79-A97 WeakPolarHBondContact CA-O 3.4Å
80	T	47.7	Very low	46.4	Very low	63 Å²	63	69.4 Å²	69.4	39%	0.387	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	137.3	171.8	-54.2	0	0	0	0	110.8	A97	T80-A97 PolarHBondContact N-O 3.19Å; T80-A97 PolarHBondContact O-N 2.85Å
81	R	51.3	Low	46.7	Very low	129 Å²	129	68.5 Å²	68.5	49%	0.487	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	134.5	-176.5	-57.7	179.1	-176.1	155.4	3.2	112.1	L72	L72-R81 HydrophobicContact CB-CG 4.42Å; L72-R81 PolarHBondContact O-NE 3.35Å; L72-R81 PolarHBondContact O-NH2 2.81Å
82	L	46.3	Very low	47.3	Very low	44 Å²	44	67.8 Å²	67.8	23%	0.23	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.5	162.5	-73.9	172.1	0	0	0	110.3	T94 M95 Y123 M130	L82-T94 WeakPolarHBondContact O-CA 3.31Å; L82-T94 PolarHBondContact O-OG1 3.04Å; L82-M95 HydrophobicContact CB-CB 4.25Å; L82-M95 PolarHBondContact N-O 3.38Å; L82-M95 PolarHBondContact O-N 3.23Å; L82-Y123 HydrophobicContact CD1-CD1 4.43Å; L82-M130 HydrophobicContact CD1-CE 3.95Å; L82-M130 HydrophobicContact CD1-SD 4.17Å; L82-M130 HydrophobicContact CD2-SD 4.42Å
83	F	46.1	Very low	47.6	Very low	60 Å²	60	68.1 Å²	68.1	26%	0.263	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.5	171.9	-64.2	-72.6	0	0	0	110	V66 L70 L72 I92	V66-F83 HydrophobicContact CG1-CB 4.47Å; L70-F83 HydrophobicContact CB-CE2 4.37Å; L70-F83 HydrophobicContact CB-CZ 4.29Å; L70-F83 HydrophobicContact CD2-CD1 4.2Å; L70-F83 HydrophobicContact CD2-CE1 3.85Å; L70-F83 HydrophobicContact CD2-CZ 4.21Å; L70-F83 WeakPolarHBondContact O-CE2 3.35Å; L72-F83 HydrophobicContact CB-CZ 4.21Å; F83-I92 HydrophobicContact CD1-CG2 4.15Å
84	R	45.4	Very low	48.2	Very low	127 Å²	127	64.9 Å²	64.9	48%	0.479	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	115.9	173.7	-176.7	178.8	-171.7	138.7	-0.8	109.6	N86 H93 G122 Y123	R84-N86 PolarHBondContact O-N 2.8Å; R84-H93 PolarHBondContact N-O 3.33Å; R84-H93 WeakPolarHBondContact O-CB 3.36Å; R84-H93 PolarHBondContact O-N 2.96Å; R84-H93 VanDerWaalsContact O-O 3.09Å; R84-G122 PolarHBondContact NH1-O 2.85Å; R84-Y123 HydrophobicContact CB-CE1 4.05Å; R84-Y123 WeakPolarHBondContact CD-OH 3.36Å; R84-Y123 HydrophobicContact CG-CE1 4.43Å
85	L	44.7	Very low	48.5	Very low	36 Å²	36	64.3 Å²	64.3	19%	0.188	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	126.9	175	-156.1	117.4	0	0	0	110	M63 V66 K87 I92	M63-L85 WeakPolarHBondContact O-CD1 3.42Å; M63-L85 WeakPolarHBondContact O-CD2 3.48Å; V66-L85 HydrophobicContact CG2-CB 3.84Å; V66-L85 HydrophobicContact CG2-CD1 4.01Å; L85-K87 HydrophobicContact CD2-CG 4.17Å; L85-I92 HydrophobicContact CD1-CG1 4.09Å
86	N	48.2	Very low	49.2	Very low	46 Å²	46	59.6 Å²	59.6	25%	0.246	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.2	171.5	-174	-17	0	0	0	108.9	R84 E88 T89 E90 S91 H93	R84-N86 PolarHBondContact O-N 2.8Å; N86-E88 VanDerWaalsContact C-N 3.29Å; N86-E88 PolarHBondContact O-N 3.24Å; N86-E88 PolarHBondContact OD1-N 3.39Å; N86-T89 WeakPolarHBondContact CB-OG1 3.43Å; N86-T89 PolarHBondContact ND2-OG1 2.97Å; N86-T89 VanDerWaalsContact ND2-OG1 3.14Å; N86-E90 PolarHBondContact O-N 3.48Å; N86-S91 PolarHBondContact N-O 2.91Å; N86-S91 PolarHBondContact O-N 3.33Å; N86-H93 WeakPolarHBondContact CB-CE1 3.32Å; N86-H93 WeakPolarHBondContact CB-ND1 3.4Å; N86-H93 VanDerWaalsContact CB-NE2 3.26Å; N86-H93 WeakPolarHBondContact CB-NE2 3.46Å; N86-H93 PolarHBondContact ND2-NE2 3.28Å
87	K	41.3	Very low	49.5	Very low	146 Å²	146	59.7 Å²	59.7	64%	0.635	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-17	-175.3	-62.5	-173.2	178.5	-167.6	0	114	L64 L85	L64-K87 HydrophobicContact CD2-CD 3.71Å; L64-K87 HydrophobicContact CD2-CG 4.22Å; L85-K87 HydrophobicContact CD2-CG 4.17Å
88	E	45.2	Very low	50.4	Low	182 Å²	182	53.8 Å²	53.8	85%	0.85	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-19	-177.1	-62.9	173.9	166.7	0	0	112.5	N86	N86-E88 VanDerWaalsContact C-N 3.29Å; N86-E88 PolarHBondContact O-N 3.24Å; N86-E88 PolarHBondContact OD1-N 3.39Å
89	T	49.8	Very low	50.9	Low	66 Å²	66	54.8 Å²	54.8	41%	0.405	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	14.8	-177	51.1	0	0	0	0	112.8	N86 S91 H93	N86-T89 WeakPolarHBondContact CB-OG1 3.43Å; N86-T89 PolarHBondContact ND2-OG1 2.97Å; N86-T89 VanDerWaalsContact ND2-OG1 3.14Å; T89-S91 VanDerWaalsContact O-CB 3.28Å; T89-S91 WeakPolarHBondContact O-CB 3.35Å; T89-S91 PolarHBondContact O-N 3.39Å; T89-S91 PolarHBondContact O-OG 2.91Å; T89-S91 PolarHBondContact OG1-OG 3.44Å; T89-H93 PolarHBondContact OG1-NE2 3.41Å
90	E	51.1	Low	51.3	Low	87 Å²	87	56 Å²	56	41%	0.407	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.4	38.5	-179.6	-60.2	-169.8	177.5	0	0	114.2	K60 M63 N86	K60-E90 IonicContact NZ-OE1 2.85Å; K60-E90 PolarHBondContact NZ-OE1 2.7Å; K60-E90 IonicContact NZ-OE2 2.89Å; K60-E90 PolarHBondContact NZ-OE2 3.47Å; M63-E90 HydrophobicContact CE-CB 4.35Å; M63-E90 WeakPolarHBondContact CE-O 3.4Å; N86-E90 PolarHBondContact O-N 3.48Å
91	S	53.2	Low	51.9	Low	0 Å²	0	59 Å²	59	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.3	-167.5	64.3	0	0	0	0	114	N86 T89 H93 R155 V156	N86-S91 PolarHBondContact N-O 2.91Å; N86-S91 PolarHBondContact O-N 3.33Å; T89-S91 VanDerWaalsContact O-CB 3.28Å; T89-S91 WeakPolarHBondContact O-CB 3.35Å; T89-S91 PolarHBondContact O-N 3.39Å; T89-S91 PolarHBondContact O-OG 2.91Å; T89-S91 PolarHBondContact OG1-OG 3.44Å; S91-H93 PolarHBondContact O-CE1 2.77Å; S91-H93 PolarHBondContact OG-CE1 3.46Å; S91-H93 PolarHBondContact OG-NE2 2.72Å; S91-R155 WeakPolarHBondContact OG-CD 3.36Å; S91-R155 WeakPolarHBondContact OG-CG 3.34Å; S91-V156 WeakPolarHBondContact CA-O 3.49Å; S91-V156 WeakPolarHBondContact CB-O 3.42Å
92	I	56.9	Low	52	Low	8 Å²	8	55.6 Å²	55.6	4%	0.041	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	108.4	179.5	-48.7	-172.4	0	0	0	108.2	L70 F83 L85 R155 V156 F158	L70-I92 HydrophobicContact CD2-CD1 3.92Å; F83-I92 HydrophobicContact CD1-CG2 4.15Å; L85-I92 HydrophobicContact CD1-CG1 4.09Å; I92-R155 CarbonylContact O-C 3.58Å; I92-R155 WeakPolarHBondContact O-CA 3.36Å; I92-V156 HydrophobicContact CB-CB 4.38Å; I92-V156 PolarHBondContact N-O 2.61Å; I92-V156 PolarHBondContact O-N 2.8Å; I92-F158 HydrophobicContact CD1-CE2 3.82Å; I92-F158 HydrophobicContact CG1-CE2 4.21Å
93	H	55.3	Low	52.4	Low	21 Å²	21	55.4 Å²	55.4	10%	0.097	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	129	169.6	-64.9	49.1	0	0	0	108.1	R84 N86 T89 S91 F154 R155 L192	R84-H93 PolarHBondContact N-O 3.33Å; R84-H93 WeakPolarHBondContact O-CB 3.36Å; R84-H93 PolarHBondContact O-N 2.96Å; R84-H93 VanDerWaalsContact O-O 3.09Å; N86-H93 WeakPolarHBondContact CB-CE1 3.32Å; N86-H93 WeakPolarHBondContact CB-ND1 3.4Å; N86-H93 VanDerWaalsContact CB-NE2 3.26Å; N86-H93 WeakPolarHBondContact CB-NE2 3.46Å; N86-H93 PolarHBondContact ND2-NE2 3.28Å; T89-H93 PolarHBondContact OG1-NE2 3.41Å; S91-H93 PolarHBondContact O-CE1 2.77Å; S91-H93 PolarHBondContact OG-CE1 3.46Å; S91-H93 PolarHBondContact OG-NE2 2.72Å; H93-F154 CarbonylContact C-O 3.55Å; H93-F154 WeakPolarHBondContact CA-O 3.45Å; H93-R155 PolarHBondContact NE2-NE 3.07Å; H93-L192 VanDerWaalsContact CD2-CD1 3.41Å; H93-L192 WeakPolarHBondContact CD2-CD1 3.42Å
94	T	57.6	Low	52.8	Low	7 Å²	7	53.9 Å²	53.9	4%	0.043	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.8	178.2	-176.8	0	0	0	0	110	L82 Q153 F154	L82-T94 WeakPolarHBondContact O-CA 3.31Å; L82-T94 PolarHBondContact O-OG1 3.04Å; T94-Q153 WeakPolarHBondContact O-CA 3.42Å; T94-F154 HydrophobicContact CG2-CB 3.84Å; T94-F154 HydrophobicContact CG2-CD2 4.19Å; T94-F154 HydrophobicContact CG2-CG 4.45Å; T94-F154 PolarHBondContact N-O 3.11Å; T94-F154 PolarHBondContact O-N 3.49Å
95	M	51.3	Low	52.7	Low	18 Å²	18	52 Å²	52	9%	0.089	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.3	179.4	-170.6	-179.5	-73	0	0	109.5	L82 Y123 L151 I152 Q153	L82-M95 HydrophobicContact CB-CB 4.25Å; L82-M95 PolarHBondContact N-O 3.38Å; L82-M95 PolarHBondContact O-N 3.23Å; M95-Y123 HydrophobicContact CE-CE2 4.19Å; M95-L151 HydrophobicContact CG-CD2 4.24Å; M95-L151 HydrophobicContact SD-CD1 4.15Å; M95-L151 HydrophobicContact SD-CD2 4.04Å; M95-L151 HydrophobicContact SD-CG 4.47Å; M95-I152 WeakPolarHBondContact CA-O 3.39Å; M95-Q153 HydrophobicContact CE-CG 4.48Å
96	M	58.4	Low	52.5	Low	5 Å²	5	59 Å²	59	3%	0.025	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119.2	-176.9	-174.3	-176.7	178.5	0	0	108.9	V33 V79 I98 I152 F154	V33-M96 HydrophobicContact CG2-CE 3.42Å; V33-M96 VanDerWaalsContact CG2-CE 3.42Å; V33-M96 HydrophobicContact CG2-SD 3.88Å; V79-M96 HydrophobicContact CB-CE 4.33Å; V79-M96 HydrophobicContact CG1-CE 3.77Å; V79-M96 HydrophobicContact CG1-CG 3.72Å; V79-M96 HydrophobicContact CG2-CE 3.52Å; M96-I98 HydrophobicContact CE-CD1 3.62Å; M96-I98 HydrophobicContact CE-CG1 3.91Å; M96-I98 HydrophobicContact CG-CD1 4.42Å; M96-I98 HydrophobicContact CG-CG1 4.1Å; M96-I98 HydrophobicContact SD-CD1 4.02Å; M96-I98 HydrophobicContact SD-CG1 4.34Å; M96-I152 HydrophobicContact CB-CB 4.49Å; M96-I152 PolarHBondContact N-O 3.09Å; M96-I152 PolarHBondContact O-N 2.89Å; M96-F154 HydrophobicContact CB-CE2 4.27Å; M96-F154 HydrophobicContact SD-CE2 4.49Å
97	A	53.7	Low	52.4	Low	21 Å²	21	64.5 Å²	64.5	17%	0.174	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.6	172.8	0	0	0	0	0	110.1	V79 T80 V149 C150 L151	V79-A97 WeakPolarHBondContact CA-O 3.4Å; T80-A97 PolarHBondContact N-O 3.19Å; T80-A97 PolarHBondContact O-N 2.85Å; A97-V149 HydrophobicContact CB-CG1 3.86Å; A97-C150 WeakPolarHBondContact CA-O 3.43Å; A97-L151 HydrophobicContact CB-CD2 3.89Å
98	I	59.4	Low	52.7	Low	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.2	177.5	-48.5	-177.5	0	0	0	109	M96 R100 L103 V149 C150 I152	M96-I98 HydrophobicContact CE-CD1 3.62Å; M96-I98 HydrophobicContact CE-CG1 3.91Å; M96-I98 HydrophobicContact CG-CD1 4.42Å; M96-I98 HydrophobicContact CG-CG1 4.1Å; M96-I98 HydrophobicContact SD-CD1 4.02Å; M96-I98 HydrophobicContact SD-CG1 4.34Å; I98-R100 PolarHBondContact O-N 2.61Å; I98-L103 HydrophobicContact CD1-CD1 4.27Å; I98-L103 HydrophobicContact CG2-CD1 4.38Å; I98-V149 CarbonylContact O-C 3.57Å; I98-C150 PolarHBondContact N-O 3.34Å; I98-C150 PolarHBondContact O-N 3.34Å; I98-I152 HydrophobicContact CD1-CD1 3.76Å
99	D	57	Low	52.7	Low	51 Å²	51	58.7 Å²	58.7	27%	0.273	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	129.1	172.1	-177.4	-45.2	0	0	0	110.9	D101 T102 L103	D99-D101 VanDerWaalsContact C-N 3.33Å; D99-D101 PolarHBondContact O-N 3.1Å; D99-D101 PolarHBondContact OD1-N 2.85Å; D99-T102 VanDerWaalsContact O-CB 3.31Å; D99-T102 WeakPolarHBondContact O-CB 3.3Å; D99-T102 PolarHBondContact O-N 2.61Å; D99-T102 VanDerWaalsContact O-N 3.1Å; D99-L103 PolarHBondContact O-N 2.87Å
100	R	57.7	Low	52.6	Low	59 Å²	59	59 Å²	59	22%	0.223	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-39.1	-173.7	-169.6	-173.9	-167.9	-165.6	1	112.9	I98 T102 L103 C104 C111 D148	I98-R100 PolarHBondContact O-N 2.61Å; R100-T102 PolarHBondContact O-N 2.84Å; R100-L103 PolarHBondContact O-N 3.37Å; R100-C104 VanDerWaalsContact O-CB 3.28Å; R100-C104 WeakPolarHBondContact O-CB 3.33Å; R100-C104 PolarHBondContact O-N 3.32Å; R100-C111 PolarHBondContact NE-O 3.48Å; R100-C111 PolarHBondContact NH2-O 3.36Å; R100-D148 HydrophobicContact CB-CB 3.85Å; R100-D148 WeakPolarHBondContact CB-O 3.27Å; R100-D148 WeakPolarHBondContact CD-OD1 3.4Å; R100-D148 IonicContact CZ-OD1 3.83Å; R100-D148 PolarHBondContact N-O 2.81Å; R100-D148 IonicContact NE-OD1 3.31Å; R100-D148 IonicContact NH1-OD1 3.15Å; R100-D148 PolarHBondContact NH1-OD1 2.96Å
101	D	59.7	Low	52.6	Low	126 Å²	126	56.1 Å²	56.1	67%	0.674	30%	0.302	S	S	*	.	H	α-helix	trans	-69.2	-28.5	179.9	-76.9	-15	0	0	0	111.2	D99	D99-D101 VanDerWaalsContact C-N 3.33Å; D99-D101 PolarHBondContact O-N 3.1Å; D99-D101 PolarHBondContact OD1-N 2.85Å
102	T	54.5	Low	52.3	Low	57 Å²	57	60 Å²	60	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-69.6	-37.6	173.9	-52	0	0	0	0	111.3	I76 S78 D99 R100	I76-T102 HydrophobicContact CG2-CG2 3.73Å; S78-T102 PolarHBondContact OG-OG1 3.45Å; D99-T102 VanDerWaalsContact O-CB 3.31Å; D99-T102 WeakPolarHBondContact O-CB 3.3Å; D99-T102 PolarHBondContact O-N 2.61Å; D99-T102 VanDerWaalsContact O-N 3.1Å; R100-T102 PolarHBondContact O-N 2.84Å
103	L	54.8	Low	51.8	Low	39 Å²	39	64.1 Å²	64.1	20%	0.204	35%	0.351	C	S	.	.	H	α-helix	trans	-77.2	-41.7	177.9	-156.4	78.9	0	0	0	112.6	I98 D99 R100 S105 L109 C150	I98-L103 HydrophobicContact CD1-CD1 4.27Å; I98-L103 HydrophobicContact CG2-CD1 4.38Å; D99-L103 PolarHBondContact O-N 2.87Å; R100-L103 PolarHBondContact O-N 3.37Å; L103-S105 VanDerWaalsContact C-N 3.27Å; L103-S105 PolarHBondContact O-N 2.95Å; L103-L109 CarbonylContact C-O 3.18Å; L103-L109 HydrophobicContact CD2-CB 4.22Å; L103-L109 HydrophobicContact CG-CB 4.28Å; L103-L109 VanDerWaalsContact O-O 3.14Å; L103-C150 HydrophobicContact CD2-CB 4.27Å; L103-C150 VanDerWaalsContact CD2-SG 3.59Å
104	C	54.1	Low	51.2	Low	29 Å²	29	65.5 Å²	65.5	20%	0.196	36%	0.362	C	S	.	.	H	α-helix	trans	-72.1	-10.8	-174.1	-84.1	0	0	0	0	115.3	R100 K106 N107 L109 C110	R100-C104 VanDerWaalsContact O-CB 3.28Å; R100-C104 WeakPolarHBondContact O-CB 3.33Å; R100-C104 PolarHBondContact O-N 3.32Å; C104-K106 PolarHBondContact O-N 3.35Å; C104-K106 VanDerWaalsContact O-N 3.11Å; C104-N107 PolarHBondContact O-N 2.84Å; C104-L109 WeakPolarHBondContact CA-O 3.4Å; C104-C110 WeakPolarHBondContact CA-SG 3.23Å; C104-C110 HydrophobicContact CB-CB 4.47Å; C104-C110 WeakPolarHBondContact CB-SG 3.15Å; C104-C110 VanDerWaalsContact SG-CA 3.51Å; C104-C110 WeakPolarHBondContact SG-CB 3.18Å; C104-C110 CovalentContact SG-SG 2.04Å; C104-C110 PolarHBondContact SG-SG 2.96Å
105	S	42.1	Very low	50.2	Low	88 Å²	88	70.1 Å²	70.1	62%	0.615	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	115.2	-178.7	76.9	0	0	0	0	111.1	L103	L103-S105 VanDerWaalsContact C-N 3.27Å; L103-S105 PolarHBondContact O-N 2.95Å
106	K	41.3	Very low	49.8	Very low	183 Å²	183	72.7 Å²	72.7	80%	0.796	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	53.2	-173.5	-52.7	178.6	-179.4	174	0	116.9	C104 Q108	C104-K106 PolarHBondContact O-N 3.35Å; C104-K106 VanDerWaalsContact O-N 3.11Å; K106-Q108 VanDerWaalsContact C-N 3.32Å; K106-Q108 PolarHBondContact O-N 2.99Å
107	N	45	Very low	48.9	Very low	160 Å²	160	79.8 Å²	79.8	86%	0.856	44%	0.435	S	S	*	.	S	Bend	trans	62.6	6.1	143.4	-66.5	12.6	0	0	0	119.9	C104	C104-N107 PolarHBondContact O-N 2.84Å
108	Q	49.4	Very low	48.2	Very low	112 Å²	112	85 Å²	85	52%	0.523	46%	0.459	S	S	.	.	S	Bend	trans	-119.2	-16.7	-177.3	-69.7	-164.4	33.8	0	0	116.9	E27 K106	E27-Q108 PolarHBondContact OE2-NE2 2.93Å; K106-Q108 VanDerWaalsContact C-N 3.32Å; K106-Q108 PolarHBondContact O-N 2.99Å
109	L	43.5	Very low	47.3	Very low	94 Å²	94	87 Å²	87	49%	0.492	47%	0.474	S	S	.	.			trans	-142.1	119.6	167	-86.5	102.5	0	0	0	111.4	L103 C104	L103-L109 CarbonylContact C-O 3.18Å; L103-L109 HydrophobicContact CD2-CB 4.22Å; L103-L109 HydrophobicContact CG-CB 4.28Å; L103-L109 VanDerWaalsContact O-O 3.14Å; C104-L109 WeakPolarHBondContact CA-O 3.4Å
110	C	48.9	Very low	46.6	Very low	72 Å²	72	87.3 Å²	87.3	49%	0.486	48%	0.475	S	S	.	.			trans	-139	132.4	170.8	-81	0	0	0	0	108.9	C104	C104-C110 WeakPolarHBondContact CA-SG 3.23Å; C104-C110 HydrophobicContact CB-CB 4.47Å; C104-C110 WeakPolarHBondContact CB-SG 3.15Å; C104-C110 VanDerWaalsContact SG-CA 3.51Å; C104-C110 WeakPolarHBondContact SG-CB 3.18Å; C104-C110 CovalentContact SG-SG 2.04Å; C104-C110 PolarHBondContact SG-SG 2.96Å
111	C	51.3	Low	45.9	Very low	28 Å²	28	89 Å²	89	19%	0.189	49%	0.489	C	S	.	.			trans	-70.8	130.8	170.5	-54.4	0	0	0	0	110	R100 C150	R100-C111 PolarHBondContact NE-O 3.48Å; R100-C111 PolarHBondContact NH2-O 3.36Å; C111-C150 HydrophobicContact CB-CB 4.34Å; C111-C150 WeakPolarHBondContact CB-SG 3.3Å; C111-C150 WeakPolarHBondContact SG-CB 3.04Å; C111-C150 CovalentContact SG-SG 2.04Å; C111-C150 PolarHBondContact SG-SG 2.85Å
112	S	45.9	Very low	45.1	Very low	80 Å²	80	85.4 Å²	85.4	56%	0.559	48%	0.481	S	S	*	.	S	Bend	trans	-68.2	-40.2	-165.7	-52	0	0	0	0	113.7	D196	S112-D196 WeakPolarHBondContact CB-OD2 3.42Å; S112-D196 PolarHBondContact OG-OD2 3.3Å
113	N	47	Very low	44.5	Very low	95 Å²	95	85 Å²	85	51%	0.508	47%	0.473	S	S	.	.			trans	-141	113.6	-163.2	-165.5	-9.6	0	0	0	114.1	T115	N113-T115 VanDerWaalsContact C-N 3.3Å; N113-T115 VanDerWaalsContact CG-OG1 3.32Å; N113-T115 PolarHBondContact O-N 3.15Å; N113-T115 PolarHBondContact OD1-OG1 2.99Å
114	P	41.5	Very low	44	Very low	51 Å²	51	86 Å²	86	33%	0.331	48%	0.478	S	S	.	.			trans	-86.5	51.9	-174.8	37.2	-37.9	0	0	0	113.2	A147	P114-A147 HydrophobicContact CB-CB 3.96Å; P114-A147 WeakPolarHBondContact CB-O 3.28Å
115	T	38.1	Very low	43.7	Very low	104 Å²	104	87.6 Å²	87.6	64%	0.638	49%	0.485	S	S	*	.			trans	-137.2	34.7	-172.1	55.5	0	0	0	0	116.7	N113	N113-T115 VanDerWaalsContact C-N 3.3Å; N113-T115 VanDerWaalsContact CG-OG1 3.32Å; N113-T115 PolarHBondContact O-N 3.15Å; N113-T115 PolarHBondContact OD1-OG1 2.99Å
116	I	42.4	Very low	43.9	Very low	72 Å²	72	91 Å²	91	37%	0.369	50%	0.502	S	S	.	.			trans	-106.2	90.1	177.5	-49.5	-178.8	0	0	0	112.3	N118 S119 N195	I116-N118 VanDerWaalsContact C-N 3.28Å; I116-N118 PolarHBondContact O-N 3.43Å; I116-S119 VanDerWaalsContact CG2-OG 3.3Å; I116-S119 WeakPolarHBondContact CG2-OG 3.39Å; I116-N195 HydrophobicContact CD1-CB 3.94Å
117	K	39	Very low	44.2	Very low	153 Å²	153	85.8 Å²	85.8	67%	0.665	49%	0.489	S	S	*	.			trans	-81	-4.2	174.8	-149.8	171.7	-172	174.5	0	114	N121	K117-N121 PolarHBondContact O-ND2 3.37Å; K117-N121 PolarHBondContact O-OD1 2.92Å
118	N	39.3	Very low	44.1	Very low	130 Å²	130	80.8 Å²	80.8	70%	0.695	48%	0.475	S	S	*	.	S	Bend	trans	-103.5	-33.7	-164.5	-71	-10.6	0	0	0	115.1	I116 I120 N121	I116-N118 VanDerWaalsContact C-N 3.28Å; I116-N118 PolarHBondContact O-N 3.43Å; N118-I120 VanDerWaalsContact C-N 3.31Å; N118-I120 PolarHBondContact O-N 3.05Å; N118-N121 PolarHBondContact O-N 2.87Å
119	S	41.3	Very low	43.7	Very low	45 Å²	45	84 Å²	84	32%	0.315	48%	0.483	S	S	.	.	S	Bend	trans	-72.2	-23.9	178.8	47.8	0	0	0	0	113.1	I116	I116-S119 VanDerWaalsContact CG2-OG 3.3Å; I116-S119 WeakPolarHBondContact CG2-OG 3.39Å
120	I	41.8	Very low	43.5	Very low	56 Å²	56	83.4 Å²	83.4	29%	0.287	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-76.4	-27.3	178.4	-45.1	-176.9	0	0	0	111.8	N118 G122 Y123 I124 M130 L151	N118-I120 VanDerWaalsContact C-N 3.31Å; N118-I120 PolarHBondContact O-N 3.05Å; I120-G122 PolarHBondContact O-N 3.48Å; I120-Y123 WeakPolarHBondContact O-CB 3.28Å; I120-Y123 PolarHBondContact O-N 3.39Å; I120-I124 HydrophobicContact CB-CD1 4.28Å; I120-I124 HydrophobicContact CG2-CD1 3.85Å; I120-I124 HydrophobicContact CG2-CG1 3.86Å; I120-I124 WeakPolarHBondContact O-CG1 3.39Å; I120-M130 HydrophobicContact CG2-CE 3.54Å; I120-L151 HydrophobicContact CD1-CD1 4.44Å; I120-L151 HydrophobicContact CG1-CD1 4.21Å
121	N	42.5	Very low	43	Very low	96 Å²	96	84.2 Å²	84.2	51%	0.513	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-57.7	-19.4	-171.9	-73	-28.1	0	0	0	115.2	K117 N118 Y123	K117-N121 PolarHBondContact O-ND2 3.37Å; K117-N121 PolarHBondContact O-OD1 2.92Å; N118-N121 PolarHBondContact O-N 2.87Å; N121-Y123 VanDerWaalsContact C-N 3.26Å; N121-Y123 PolarHBondContact O-N 2.88Å
122	G	42.5	Very low	42.4	Very low	50 Å²	50	91.5 Å²	91.5	52%	0.515	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-78.8	0.1	172.7	0	0	0	0	0	115.6	R84 I120	R84-G122 PolarHBondContact NH1-O 2.85Å; I120-G122 PolarHBondContact O-N 3.48Å
123	Y	41.9	Very low	41.9	Very low	48 Å²	48	94.5 Å²	94.5	19%	0.188	53%	0.532	C	S	.	.	S	Bend	trans	-131.5	4.7	-172.6	-64.9	-87	0	0	0	113.9	L82 R84 M95 I120 N121 P131	L82-Y123 HydrophobicContact CD1-CD1 4.43Å; R84-Y123 HydrophobicContact CB-CE1 4.05Å; R84-Y123 WeakPolarHBondContact CD-OH 3.36Å; R84-Y123 HydrophobicContact CG-CE1 4.43Å; M95-Y123 HydrophobicContact CE-CE2 4.19Å; I120-Y123 WeakPolarHBondContact O-CB 3.28Å; I120-Y123 PolarHBondContact O-N 3.39Å; N121-Y123 VanDerWaalsContact C-N 3.26Å; N121-Y123 PolarHBondContact O-N 2.88Å; Y123-P131 WeakPolarHBondContact O-CD 3.2Å
124	I	44.8	Very low	41	Very low	59 Å²	59	94 Å²	94	30%	0.303	55%	0.548	S	S	.	.			trans	-107.2	140.9	179.6	-34.9	-179.1	0	0	0	109.1	I120 R129	I120-I124 HydrophobicContact CB-CD1 4.28Å; I120-I124 HydrophobicContact CG2-CD1 3.85Å; I120-I124 HydrophobicContact CG2-CG1 3.86Å; I120-I124 WeakPolarHBondContact O-CG1 3.39Å; I124-R129 VanDerWaalsContact CG2-N 3.27Å; I124-R129 WeakPolarHBondContact CG2-O 3.34Å
125	D	48.8	Very low	40.4	Very low	63 Å²	63	94.9 Å²	94.9	34%	0.337	57%	0.567	S	S	.	*			trans	-73.3	170.2	168	75.7	21.9	0	0	0	112.1	S127 G128 R129	D125-S127 PolarHBondContact O-N 3.41Å; D125-S127 VanDerWaalsContact OD1-CA 3.27Å; D125-S127 WeakPolarHBondContact OD1-CA 3.37Å; D125-S127 VanDerWaalsContact OD1-CB 3.28Å; D125-S127 WeakPolarHBondContact OD1-CB 3.35Å; D125-S127 PolarHBondContact OD1-N 3.46Å; D125-S127 PolarHBondContact OD1-OG 2.94Å; D125-S127 PolarHBondContact OD2-OG 3.28Å; D125-G128 PolarHBondContact O-N 2.88Å; D125-G128 PolarHBondContact OD1-N 2.97Å; D125-R129 PolarHBondContact N-O 3.41Å; D125-R129 PolarHBondContact OD1-N 3.27Å; D125-R129 VanDerWaalsContact OD1-N 3.08Å
126	T	45.3	Very low	39.8	Very low	160 Å²	160	94.1 Å²	94.1	98%	0.982	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-3.6	-179.3	51.5	0	0	0	0	114.5
127	S	48.6	Very low	39.3	Very low	73 Å²	73	98.3 Å²	98.3	51%	0.51	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.6	1.4	173.5	83	0	0	0	0	113.7	D125 R129	D125-S127 PolarHBondContact O-N 3.41Å; D125-S127 VanDerWaalsContact OD1-CA 3.27Å; D125-S127 WeakPolarHBondContact OD1-CA 3.37Å; D125-S127 VanDerWaalsContact OD1-CB 3.28Å; D125-S127 WeakPolarHBondContact OD1-CB 3.35Å; D125-S127 PolarHBondContact OD1-N 3.46Å; D125-S127 PolarHBondContact OD1-OG 2.94Å; D125-S127 PolarHBondContact OD2-OG 3.28Å; S127-R129 WeakPolarHBondContact OG-CD 3.45Å; S127-R129 WeakPolarHBondContact OG-CG 3.47Å
128	G	42.1	Very low	38.8	Very low	56 Å²	56	97.8 Å²	97.8	58%	0.577	61%	0.607	S	S	*	*	S	Bend	trans	80.5	21.6	-176.4	0	0	0	0	0	113.7	D125	D125-G128 PolarHBondContact O-N 2.88Å; D125-G128 PolarHBondContact OD1-N 2.97Å
129	R	41.1	Very low	38.5	Very low	178 Å²	178	99.5 Å²	99.5	67%	0.672	61%	0.609	S	S	*	*	S	Bend	trans	-120.8	148	-178.2	-57	176.6	-168.9	-155.1	-0.7	110.8	I124 D125 S127	I124-R129 VanDerWaalsContact CG2-N 3.27Å; I124-R129 WeakPolarHBondContact CG2-O 3.34Å; D125-R129 PolarHBondContact N-O 3.41Å; D125-R129 PolarHBondContact OD1-N 3.27Å; D125-R129 VanDerWaalsContact OD1-N 3.08Å; S127-R129 WeakPolarHBondContact OG-CD 3.45Å; S127-R129 WeakPolarHBondContact OG-CG 3.47Å
130	M	40.1	Very low	38.1	Very low	83 Å²	83	106.1 Å²	106.1	41%	0.409	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-75.4	130.4	172.1	-72.9	-178.6	166.8	0	0	110.2	L82 I120 M132	L82-M130 HydrophobicContact CD1-CE 3.95Å; L82-M130 HydrophobicContact CD1-SD 4.17Å; L82-M130 HydrophobicContact CD2-SD 4.42Å; I120-M130 HydrophobicContact CG2-CE 3.54Å; M130-M132 PolarHBondContact O-N 3.31Å
131	P	38.4	Very low	37.7	Very low	89 Å²	89	109.1 Å²	109.1	58%	0.578	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-71.1	123.1	-179.3	28.5	-33.4	0	0	0	110.7	Y123	Y123-P131 WeakPolarHBondContact O-CD 3.2Å
132	M	38.4	Very low	37.6	Very low	181 Å²	181	110.1 Å²	110.1	89%	0.892	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-94.1	123.4	-173.6	-51.7	-157.7	95.1	0	0	112.4	M130	M130-M132 PolarHBondContact O-N 3.31Å
133	T	36.1	Very low	37.5	Very low	143 Å²	143	111.9 Å²	111.9	88%	0.877	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-86.5	135.1	164.9	49.5	0	0	0	0	110.3	G135	T133-G135 PolarHBondContact O-N 2.89Å
134	G	26.7	Very low	37.5	Very low	83 Å²	83	113.9 Å²	113.9	86%	0.856	67%	0.674	S	S	*	*			trans	-71.4	115.4	-165.4	0	0	0	0	0	115.7
135	G	28.3	Very low	37.4	Very low	70 Å²	70	118.7 Å²	118.7	72%	0.722	69%	0.692	S	S	*	*			trans	-152	107.8	165.3	0	0	0	0	0	109.4	T133 Q137	T133-G135 PolarHBondContact O-N 2.89Å; G135-Q137 PolarHBondContact O-N 2.84Å; G135-Q137 VanDerWaalsContact O-N 3.14Å
136	G	27.4	Very low	37.3	Very low	88 Å²	88	119.6 Å²	119.6	91%	0.907	70%	0.701	S	S	*	*			trans	-82.2	93.1	-157.3	0	0	0	0	0	116.6
137	Q	30.3	Very low	37.4	Very low	161 Å²	161	114.4 Å²	114.4	75%	0.752	67%	0.673	S	S	*	*			trans	-138.7	156.2	151.5	-72.1	-164.5	6.8	0	0	110.5	G135 F139	G135-Q137 PolarHBondContact O-N 2.84Å; G135-Q137 VanDerWaalsContact O-N 3.14Å; Q137-F139 HydrophobicContact CB-CD2 4.45Å; Q137-F139 HydrophobicContact CB-CE2 3.76Å
138	T	28.8	Very low	37.8	Very low	141 Å²	141	114.2 Å²	114.2	87%	0.865	67%	0.667	S	S	*	*			trans	-87.2	114.6	-167.3	50.5	0	0	0	0	113.2
139	F	32.8	Very low	38.3	Very low	167 Å²	167	113.9 Å²	113.9	73%	0.732	65%	0.654	S	S	*	*			trans	-131	157.3	177.3	-67	-76.1	0	0	0	113	Q137	Q137-F139 HydrophobicContact CB-CD2 4.45Å; Q137-F139 HydrophobicContact CB-CE2 3.76Å
140	K	33	Very low	38.9	Very low	184 Å²	184	105.6 Å²	105.6	80%	0.8	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-71.8	139.8	-175.6	-64.2	175.6	-178.1	171.8	0	111.2	Y142	K140-Y142 PolarHBondContact O-N 3.37Å
141	S	34.7	Very low	39.7	Very low	118 Å²	118	103 Å²	103	83%	0.825	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-73.9	116.8	163.3	55.1	0	0	0	0	110	D143	S141-D143 PolarHBondContact O-N 3.5Å
142	Y	39.2	Very low	40.6	Very low	118 Å²	118	99.3 Å²	99.3	46%	0.463	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-73.4	119.3	169.5	-83.7	-102.8	0	0	0	109.7	K140 T146 V149	K140-Y142 PolarHBondContact O-N 3.37Å; Y142-T146 WeakPolarHBondContact CD1-OG1 3.35Å; Y142-V149 HydrophobicContact CD1-CG2 4.34Å; Y142-V149 HydrophobicContact CE1-CG2 3.98Å
143	D	41.6	Very low	41.5	Very low	87 Å²	87	93 Å²	93	47%	0.465	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-77.6	141.1	165.9	-176.1	8.3	0	0	0	108.9	S141 K145 T146	S141-D143 PolarHBondContact O-N 3.5Å; D143-K145 PolarHBondContact O-N 2.94Å; D143-K145 WeakPolarHBondContact OD2-CD 3.33Å; D143-K145 IonicContact OD2-NZ 3.12Å; D143-T146 PolarHBondContact O-N 2.84Å; D143-T146 PolarHBondContact O-OG1 2.91Å
144	S	40.1	Very low	42.5	Very low	89 Å²	89	86.8 Å²	86.8	62%	0.622	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	9.2	172.4	63.9	0	0	0	0	117.5
145	K	42.9	Very low	43.9	Very low	160 Å²	160	85.6 Å²	85.6	70%	0.696	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	-6	-178.6	-60.3	178.6	-172.3	161.3	0	113.4	D143	D143-K145 PolarHBondContact O-N 2.94Å; D143-K145 WeakPolarHBondContact OD2-CD 3.33Å; D143-K145 IonicContact OD2-NZ 3.12Å
146	T	48.3	Very low	45.1	Very low	83 Å²	83	83 Å²	83	51%	0.509	46%	0.455	S	S	.	.			trans	-85.5	111.9	172.6	44.7	0	0	0	0	108.7	Y142 D143	Y142-T146 WeakPolarHBondContact CD1-OG1 3.35Å; D143-T146 PolarHBondContact O-N 2.84Å; D143-T146 PolarHBondContact O-OG1 2.91Å
147	A	47.3	Very low	46.4	Very low	50 Å²	50	80.9 Å²	80.9	41%	0.413	42%	0.422	S	S	.	.			trans	-88.9	-23.9	-166.6	0	0	0	0	0	113.5	P114 V149	P114-A147 HydrophobicContact CB-CB 3.96Å; P114-A147 WeakPolarHBondContact CB-O 3.28Å; A147-V149 PolarHBondContact O-N 3.22Å
148	D	55.7	Low	47.4	Very low	70 Å²	70	74.4 Å²	74.4	37%	0.374	39%	0.391	S	S	.	.			trans	-95.5	63.3	-165.3	-65.2	-79.3	0	0	0	113.2	R100	R100-D148 HydrophobicContact CB-CB 3.85Å; R100-D148 WeakPolarHBondContact CB-O 3.27Å; R100-D148 WeakPolarHBondContact CD-OD1 3.4Å; R100-D148 IonicContact CZ-OD1 3.83Å; R100-D148 PolarHBondContact N-O 2.81Å; R100-D148 IonicContact NE-OD1 3.31Å; R100-D148 IonicContact NH1-OD1 3.15Å; R100-D148 PolarHBondContact NH1-OD1 2.96Å
149	V	52.8	Low	48.2	Very low	49 Å²	49	70 Å²	70	30%	0.297	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	122.9	175.4	-178.3	0	0	0	0	110.6	A97 I98 Y142 A147	A97-V149 HydrophobicContact CB-CG1 3.86Å; I98-V149 CarbonylContact O-C 3.57Å; Y142-V149 HydrophobicContact CD1-CG2 4.34Å; Y142-V149 HydrophobicContact CE1-CG2 3.98Å; A147-V149 PolarHBondContact O-N 3.22Å
150	C	53.3	Low	48.7	Very low	3 Å²	3	64.3 Å²	64.3	2%	0.02	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	136.2	168.2	-72.9	0	0	0	0	110.4	A97 I98 L103 C111	A97-C150 WeakPolarHBondContact CA-O 3.43Å; I98-C150 PolarHBondContact N-O 3.34Å; I98-C150 PolarHBondContact O-N 3.34Å; L103-C150 HydrophobicContact CD2-CB 4.27Å; L103-C150 VanDerWaalsContact CD2-SG 3.59Å; C111-C150 HydrophobicContact CB-CB 4.34Å; C111-C150 WeakPolarHBondContact CB-SG 3.3Å; C111-C150 WeakPolarHBondContact SG-CB 3.04Å; C111-C150 CovalentContact SG-SG 2.04Å; C111-C150 PolarHBondContact SG-SG 2.85Å
151	L	57.4	Low	49.4	Very low	29 Å²	29	59.3 Å²	59.3	15%	0.152	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.3	174	-67.5	174.3	0	0	0	109.8	M95 A97 I120 N195	M95-L151 HydrophobicContact CG-CD2 4.24Å; M95-L151 HydrophobicContact SD-CD1 4.15Å; M95-L151 HydrophobicContact SD-CD2 4.04Å; M95-L151 HydrophobicContact SD-CG 4.47Å; A97-L151 HydrophobicContact CB-CD2 3.89Å; I120-L151 HydrophobicContact CD1-CD1 4.44Å; I120-L151 HydrophobicContact CG1-CD1 4.21Å; L151-N195 PolarHBondContact O-ND2 3.24Å
152	I	57	Low	49.8	Very low	12 Å²	12	59.2 Å²	59.2	6%	0.062	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.3	176.6	-52.5	179.9	0	0	0	108	M95 M96 I98 F154 L191 I194	M95-I152 WeakPolarHBondContact CA-O 3.39Å; M96-I152 HydrophobicContact CB-CB 4.49Å; M96-I152 PolarHBondContact N-O 3.09Å; M96-I152 PolarHBondContact O-N 2.89Å; I98-I152 HydrophobicContact CD1-CD1 3.76Å; I152-F154 HydrophobicContact CB-CE2 4.14Å; I152-F154 HydrophobicContact CB-CZ 4.45Å; I152-F154 HydrophobicContact CG2-CD2 4.26Å; I152-F154 HydrophobicContact CG2-CE1 4.19Å; I152-F154 HydrophobicContact CG2-CE2 3.49Å; I152-F154 VanDerWaalsContact CG2-CE2 3.49Å; I152-F154 HydrophobicContact CG2-CZ 3.45Å; I152-F154 VanDerWaalsContact CG2-CZ 3.45Å; I152-L191 HydrophobicContact CG2-CD1 3.57Å; I152-I194 HydrophobicContact CG1-CG1 4.4Å; I152-I194 HydrophobicContact CG2-CG1 4.11Å
153	Q	56.8	Low	50	Low	48 Å²	48	58.2 Å²	58.2	22%	0.224	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.3	-178.3	-168	178	-80.2	0	0	111.7	T94 M95 L191 L192 D193	T94-Q153 WeakPolarHBondContact O-CA 3.42Å; M95-Q153 HydrophobicContact CE-CG 4.48Å; Q153-L191 WeakPolarHBondContact O-CD1 3.3Å; Q153-L192 HydrophobicContact CB-CB 4.41Å; Q153-L192 HydrophobicContact CG-CB 4.32Å; Q153-L192 HydrophobicContact CG-CD1 4.24Å; Q153-L192 VanDerWaalsContact NE2-CD1 3.31Å; Q153-L192 PolarHBondContact O-N 3.22Å; Q153-D193 PolarHBondContact N-O 2.94Å; Q153-D193 PolarHBondContact O-N 2.91Å
154	F	58.1	Low	49.9	Very low	13 Å²	13	58.3 Å²	58.3	6%	0.057	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	156.7	176.9	-46.8	-103	0	0	0	110.7	H93 T94 M96 I152 V189 E190 L191 I221	H93-F154 CarbonylContact C-O 3.55Å; H93-F154 WeakPolarHBondContact CA-O 3.45Å; T94-F154 HydrophobicContact CG2-CB 3.84Å; T94-F154 HydrophobicContact CG2-CD2 4.19Å; T94-F154 HydrophobicContact CG2-CG 4.45Å; T94-F154 PolarHBondContact N-O 3.11Å; T94-F154 PolarHBondContact O-N 3.49Å; M96-F154 HydrophobicContact CB-CE2 4.27Å; M96-F154 HydrophobicContact SD-CE2 4.49Å; I152-F154 HydrophobicContact CB-CE2 4.14Å; I152-F154 HydrophobicContact CB-CZ 4.45Å; I152-F154 HydrophobicContact CG2-CD2 4.26Å; I152-F154 HydrophobicContact CG2-CE1 4.19Å; I152-F154 HydrophobicContact CG2-CE2 3.49Å; I152-F154 VanDerWaalsContact CG2-CE2 3.49Å; I152-F154 HydrophobicContact CG2-CZ 3.45Å; I152-F154 VanDerWaalsContact CG2-CZ 3.45Å; F154-V189 HydrophobicContact CB-CG1 4.41Å; F154-V189 HydrophobicContact CD1-CG1 4.36Å; F154-E190 CarbonylContact C-O 3.58Å; F154-E190 VanDerWaalsContact CA-O 3.27Å; F154-E190 WeakPolarHBondContact CA-O 3.39Å; F154-L191 HydrophobicContact CD1-CB 4.47Å; F154-L191 HydrophobicContact CD1-CD1 3.65Å; F154-L191 HydrophobicContact CE1-CD1 3.58Å; F154-L191 HydrophobicContact CG-CD1 4.27Å; F154-L191 HydrophobicContact CZ-CD1 4.14Å; F154-I221 HydrophobicContact CD1-CD1 4.22Å; F154-I221 HydrophobicContact CE1-CD1 3.79Å
155	R	57.1	Low	49.9	Very low	58 Å²	58	57.5 Å²	57.5	22%	0.219	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.9	167.2	-175.4	-176	-66.2	150.2	-7.7	108.7	S91 I92 H93 I157 V189 E190 L192	S91-R155 WeakPolarHBondContact OG-CD 3.36Å; S91-R155 WeakPolarHBondContact OG-CG 3.34Å; I92-R155 CarbonylContact O-C 3.58Å; I92-R155 WeakPolarHBondContact O-CA 3.36Å; H93-R155 PolarHBondContact NE2-NE 3.07Å; R155-I157 HydrophobicContact CG-CG1 4.05Å; R155-V189 WeakPolarHBondContact O-CA 3.33Å; R155-E190 HydrophobicContact CB-CB 4.28Å; R155-E190 VanDerWaalsContact CD-OE2 3.25Å; R155-E190 WeakPolarHBondContact CD-OE2 3.25Å; R155-E190 IonicContact CZ-OE2 3.09Å; R155-E190 PolarHBondContact N-O 2.9Å; R155-E190 IonicContact NE-OE2 2.65Å; R155-E190 IonicContact NH1-OE1 3.72Å; R155-E190 PolarHBondContact NH1-OE1 3.48Å; R155-E190 IonicContact NH1-OE2 3.74Å; R155-E190 PolarHBondContact NH1-OE2 3.19Å; R155-E190 PolarHBondContact O-N 3.31Å; R155-L192 HydrophobicContact CB-CD1 3.89Å; R155-L192 HydrophobicContact CB-CD2 4.1Å; R155-L192 HydrophobicContact CB-CG 3.93Å
156	V	53.1	Low	49.5	Very low	15 Å²	15	59.3 Å²	59.3	9%	0.091	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	121.6	170.5	-171.4	0	0	0	0	108.7	S91 I92 F158 V187 E188 V189	S91-V156 WeakPolarHBondContact CA-O 3.49Å; S91-V156 WeakPolarHBondContact CB-O 3.42Å; I92-V156 HydrophobicContact CB-CB 4.38Å; I92-V156 PolarHBondContact N-O 2.61Å; I92-V156 PolarHBondContact O-N 2.8Å; V156-F158 HydrophobicContact CB-CE2 4.34Å; V156-F158 HydrophobicContact CG1-CD2 4.29Å; V156-F158 HydrophobicContact CG1-CE2 3.61Å; V156-F158 HydrophobicContact CG1-CZ 3.88Å; V156-V187 HydrophobicContact CG1-CG1 3.7Å; V156-E188 WeakPolarHBondContact CA-O 3.31Å; V156-V189 HydrophobicContact CG1-CG2 4.39Å; V156-V189 HydrophobicContact CG2-CG2 4.32Å
157	I	54.2	Low	49	Very low	44 Å²	44	61.5 Å²	61.5	23%	0.226	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	140.2	178.6	-51.5	175.4	0	0	0	108	R155 V187 E188	R155-I157 HydrophobicContact CG-CG1 4.05Å; I157-V187 WeakPolarHBondContact O-CA 3.37Å; I157-E188 HydrophobicContact CB-CB 4.34Å; I157-E188 PolarHBondContact N-O 2.87Å; I157-E188 PolarHBondContact O-N 2.94Å
158	F	50.6	Low	48.1	Very low	24 Å²	24	62.9 Å²	62.9	11%	0.105	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.1	175.2	-65.7	-97.6	0	0	0	108.6	F40 I92 V156 V187	F40-F158 HydrophobicContact CD1-CE1 4.07Å; F40-F158 HydrophobicContact CD1-CZ 4.32Å; F40-F158 HydrophobicContact CE1-CD1 4.21Å; F40-F158 AromaticContact CE1-CE1 3.89Å; F40-F158 HydrophobicContact CE1-CE1 3.89Å; F40-F158 HydrophobicContact CE1-CZ 4.14Å; I92-F158 HydrophobicContact CD1-CE2 3.82Å; I92-F158 HydrophobicContact CG1-CE2 4.21Å; V156-F158 HydrophobicContact CB-CE2 4.34Å; V156-F158 HydrophobicContact CG1-CD2 4.29Å; V156-F158 HydrophobicContact CG1-CE2 3.61Å; V156-F158 HydrophobicContact CG1-CZ 3.88Å; F158-V187 HydrophobicContact CD1-CG1 4.25Å; F158-V187 HydrophobicContact CD1-CG2 3.73Å; F158-V187 HydrophobicContact CE1-CG1 3.97Å; F158-V187 HydrophobicContact CE1-CG2 3.82Å; F158-V187 HydrophobicContact CZ-CG1 4.29Å
159	S	46.9	Very low	47.1	Very low	48 Å²	48	66.2 Å²	66.2	34%	0.336	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.1	175	-62.6	0	0	0	0	109.7	I185 T186	S159-I185 WeakPolarHBondContact O-CA 3.49Å; S159-T186 WeakPolarHBondContact CB-OG1 3.45Å; S159-T186 PolarHBondContact N-O 3.14Å; S159-T186 VanDerWaalsContact N-O 3.08Å; S159-T186 PolarHBondContact O-N 2.71Å; S159-T186 PolarHBondContact O-OG1 3.22Å
160	M	43.4	Very low	46	Very low	49 Å²	49	71.3 Å²	71.3	24%	0.241	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.2	-178.6	-174.5	171.7	62.6	0	0	109.6	L59 Y162 I185	L59-M160 HydrophobicContact CD1-CE 4.47Å; L59-M160 HydrophobicContact CD2-CB 4.41Å; L59-M160 HydrophobicContact CD2-CE 4.14Å; M160-Y162 HydrophobicContact CE-CE2 4.01Å; M160-Y162 WeakPolarHBondContact CE-OH 3.34Å; M160-I185 HydrophobicContact CB-CG1 4.43Å; M160-I185 HydrophobicContact CG-CG1 4.16Å; M160-I185 HydrophobicContact SD-CG1 4.48Å
161	H	46.1	Very low	44.9	Very low	79 Å²	79	78.3 Å²	78.3	37%	0.366	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	149.1	-176.7	-55.6	-83.3	0	0	0	109.9	A183 Y184 T186	H161-A183 CarbonylContact O-C 3.49Å; H161-A183 WeakPolarHBondContact O-CA 3.45Å; H161-Y184 HydrophobicContact CB-CD1 4.32Å; H161-Y184 HydrophobicContact CB-CD2 4.02Å; H161-Y184 HydrophobicContact CB-CE1 3.86Å; H161-Y184 HydrophobicContact CB-CE2 3.53Å; H161-Y184 HydrophobicContact CB-CG 4.39Å; H161-Y184 VanDerWaalsContact CB-CZ 3.43Å; H161-Y184 AromaticContact CD2-CE2 3.68Å; H161-Y184 AromaticContact CG-CE2 3.81Å; H161-Y184 PolarHBondContact N-O 3.47Å; H161-Y184 PolarHBondContact O-N 3.45Å; H161-T186 PolarHBondContact NE2-OG1 3.39Å
162	Y	44.1	Very low	43.7	Very low	115 Å²	115	88 Å²	88	45%	0.451	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134.9	175.9	-64.6	-86.4	0	0	0	109.2	A55 M160 M182 A183	A55-Y162 WeakPolarHBondContact CB-OH 3.24Å; M160-Y162 HydrophobicContact CE-CE2 4.01Å; M160-Y162 WeakPolarHBondContact CE-OH 3.34Å; Y162-M182 WeakPolarHBondContact CA-O 3.08Å; Y162-A183 HydrophobicContact CD1-CB 3.68Å; Y162-A183 HydrophobicContact CE1-CB 3.62Å
163	Q	43.3	Very low	42.4	Very low	98 Å²	98	94.9 Å²	94.9	46%	0.458	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125.5	173.8	-173.4	172	-59	0	0	110.2	D165 M182 Y184	Q163-D165 PolarHBondContact NE2-OD1 3.48Å; Q163-D165 PolarHBondContact O-N 3.47Å; Q163-M182 PolarHBondContact N-O 3.32Å; Q163-M182 PolarHBondContact O-N 2.6Å; Q163-Y184 HydrophobicContact CB-CE1 4.42Å
164	D	40.2	Very low	41.1	Very low	89 Å²	89	101.6 Å²	101.6	48%	0.476	52%	0.518	S	S	.	.			trans	-89	99.4	172.5	-77.6	20.1	0	0	0	108.6	F166 K181	D164-F166 VanDerWaalsContact C-N 3.35Å; D164-F166 PolarHBondContact O-N 3.27Å; D164-K181 VanDerWaalsContact OD1-CD 3.31Å; D164-K181 WeakPolarHBondContact OD1-CD 3.39Å; D164-K181 WeakPolarHBondContact OD1-CE 3.45Å; D164-K181 IonicContact OD1-NZ 3.17Å; D164-K181 PolarHBondContact OD1-NZ 2.86Å; D164-K181 WeakPolarHBondContact OD2-CE 3.27Å; D164-K181 IonicContact OD2-NZ 3.37Å; D164-K181 PolarHBondContact OD2-NZ 3.25Å
165	D	40.1	Very low	40	Very low	71 Å²	71	107.8 Å²	107.8	38%	0.38	56%	0.557	S	S	.	*			trans	-72.2	85.7	-178.3	-83.1	-18.4	0	0	0	112	Q163 V167 M182	Q163-D165 PolarHBondContact NE2-OD1 3.48Å; Q163-D165 PolarHBondContact O-N 3.47Å; D165-V167 PolarHBondContact O-N 3.5Å; D165-M182 WeakPolarHBondContact OD2-CE 3.16Å
166	F	34.2	Very low	38.8	Very low	199 Å²	199	112.2 Å²	112.2	87%	0.873	59%	0.585	S	S	*	*			trans	-67.8	94	160.9	-98.9	-87.8	0	0	0	109.8	D164 G168	D164-F166 VanDerWaalsContact C-N 3.35Å; D164-F166 PolarHBondContact O-N 3.27Å; F166-G168 VanDerWaalsContact C-N 3.26Å; F166-G168 PolarHBondContact O-N 2.8Å
167	V	36.6	Very low	37.7	Very low	128 Å²	128	115.3 Å²	115.3	78%	0.776	62%	0.62	S	S	*	*			trans	-67.2	84.5	173.6	-177.1	0	0	0	0	109.9	D165 N169	D165-V167 PolarHBondContact O-N 3.5Å; V167-N169 HydrophobicContact CG1-CB 4.43Å; V167-N169 PolarHBondContact O-N 2.75Å
168	G	29.4	Very low	36.6	Very low	80 Å²	80	118.2 Å²	118.2	83%	0.825	65%	0.645	S	S	*	*			trans	-72.7	68.9	179.2	0	0	0	0	0	113	F166	F166-G168 VanDerWaalsContact C-N 3.26Å; F166-G168 PolarHBondContact O-N 2.8Å
169	N	35.3	Very low	35.9	Very low	139 Å²	139	123.2 Å²	123.2	74%	0.743	68%	0.677	S	S	*	*			trans	-124.6	92.6	175.2	-155.2	-1.1	0	0	0	110.9	V167 N171	V167-N169 HydrophobicContact CG1-CB 4.43Å; V167-N169 PolarHBondContact O-N 2.75Å; N169-N171 VanDerWaalsContact C-N 3.31Å; N169-N171 PolarHBondContact O-N 3.31Å
170	N	28.8	Very low	35.2	Very low	157 Å²	157	125.7 Å²	125.7	84%	0.84	68%	0.684	S	S	*	*			trans	-71.3	77	-177.1	-79.9	-36.2	0	0	0	112.3
171	N	30.8	Very low	35	Very low	149 Å²	149	128.9 Å²	128.9	80%	0.797	70%	0.696	S	S	*	*			trans	177	88.1	148.5	-92.1	-38.4	0	0	0	111.4	N169	N169-N171 VanDerWaalsContact C-N 3.31Å; N169-N171 PolarHBondContact O-N 3.31Å
172	Y	32.6	Very low	34.4	Very low	234 Å²	234	127.3 Å²	127.3	92%	0.918	69%	0.69	S	S	*	*			trans	-173.5	123.5	136.8	-102.5	-67.9	0	0	0	109.2
173	N	28.5	Very low	34.1	Very low	155 Å²	155	123.1 Å²	123.1	83%	0.829	68%	0.679	S	S	*	*			trans	-85.9	146.5	170.4	-81	-40.5	0	0	0	109.8
174	Q	30	Very low	34.1	Very low	189 Å²	189	121.2 Å²	121.2	88%	0.883	67%	0.668	S	S	*	*			trans	71.8	107.6	175	-54.2	177.8	-32.6	0	0	116.4
175	V	33.9	Very low	34.2	Very low	143 Å²	143	118.9 Å²	118.9	87%	0.867	66%	0.655	S	S	*	*				-172.8	159.7	116.9	147.2	0	0	0	0	108.6
176	D	31.8	Very low	34.5	Very low	151 Å²	151	117.2 Å²	117.2	81%	0.807	65%	0.647	S	S	*	*			trans	-68	142.1	-163.2	-52.1	-76.2	0	0	0	116.7
177	G	30.5	Very low	35.1	Very low	81 Å²	81	109.9 Å²	109.9	84%	0.835	62%	0.619	S	S	*	*				104.1	1.6	97.5	0	0	0	0	0	121
178	S	31.6	Very low	35.7	Very low	105 Å²	105	109.3 Å²	109.3	73%	0.734	61%	0.608	S	S	*	*			trans	-155.3	110	171.4	58.8	0	0	0	0	114.1
179	T	35.4	Very low	36.5	Very low	129 Å²	129	106.8 Å²	106.8	79%	0.791	58%	0.576	S	S	*	*			trans	-94.9	105.2	169.7	51.8	0	0	0	0	110.1
180	E	33.6	Very low	37.1	Very low	100 Å²	100	104 Å²	104	47%	0.467	56%	0.558	S	S	.	*			trans	-69.2	138	171	-61.1	-175.4	154.8	0	0	109.9
181	K	37.4	Very low	38.1	Very low	115 Å²	115	99 Å²	99	50%	0.5	53%	0.532	S	S	.	.			trans	-107.6	126.3	173.6	-66.6	-171.7	172.7	-142.4	0	109.1	D164	D164-K181 VanDerWaalsContact OD1-CD 3.31Å; D164-K181 WeakPolarHBondContact OD1-CD 3.39Å; D164-K181 WeakPolarHBondContact OD1-CE 3.45Å; D164-K181 IonicContact OD1-NZ 3.17Å; D164-K181 PolarHBondContact OD1-NZ 2.86Å; D164-K181 WeakPolarHBondContact OD2-CE 3.27Å; D164-K181 IonicContact OD2-NZ 3.37Å; D164-K181 PolarHBondContact OD2-NZ 3.25Å
182	M	35	Very low	39	Very low	47 Å²	47	94.3 Å²	94.3	23%	0.232	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	133.8	173.4	-81.8	-165.7	-79.5	0	0	110.8	W5 Y162 Q163 D165	W5-M182 PolarHBondContact NE1-SD 2.99Å; Y162-M182 WeakPolarHBondContact CA-O 3.08Å; Q163-M182 PolarHBondContact N-O 3.32Å; Q163-M182 PolarHBondContact O-N 2.6Å; D165-M182 WeakPolarHBondContact OD2-CE 3.16Å
183	A	37.3	Very low	39.8	Very low	27 Å²	27	86.3 Å²	86.3	22%	0.223	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	139.9	169.6	0	0	0	0	0	109.6	C4 H161 Y162	C4-A183 PolarHBondContact N-O 2.82Å; H161-A183 CarbonylContact O-C 3.49Å; H161-A183 WeakPolarHBondContact O-CA 3.45Å; Y162-A183 HydrophobicContact CD1-CB 3.68Å; Y162-A183 HydrophobicContact CE1-CB 3.62Å
184	Y	42.7	Very low	40.9	Very low	58 Å²	58	82 Å²	82	23%	0.227	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	143.2	173.4	60.7	-88.8	0	0	0	113	M1 I2 H161 Q163	M1-Y184 HydrophobicContact CG-CD2 4.27Å; I2-Y184 WeakPolarHBondContact O-CA 3.32Å; I2-Y184 WeakPolarHBondContact O-CB 3.47Å; H161-Y184 HydrophobicContact CB-CD1 4.32Å; H161-Y184 HydrophobicContact CB-CD2 4.02Å; H161-Y184 HydrophobicContact CB-CE1 3.86Å; H161-Y184 HydrophobicContact CB-CE2 3.53Å; H161-Y184 HydrophobicContact CB-CG 4.39Å; H161-Y184 VanDerWaalsContact CB-CZ 3.43Å; H161-Y184 AromaticContact CD2-CE2 3.68Å; H161-Y184 AromaticContact CG-CE2 3.81Å; H161-Y184 PolarHBondContact N-O 3.47Å; H161-Y184 PolarHBondContact O-N 3.45Å; Q163-Y184 HydrophobicContact CB-CE1 4.42Å
185	I	43.8	Very low	41.8	Very low	39 Å²	39	74.8 Å²	74.8	20%	0.2	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	134.7	179	-61.2	173.3	0	0	0	109.3	I2 L41 S159 M160 V187	I2-I185 PolarHBondContact N-O 2.75Å; I2-I185 PolarHBondContact O-N 3.02Å; L41-I185 HydrophobicContact CD2-CD1 4.03Å; S159-I185 WeakPolarHBondContact O-CA 3.49Å; M160-I185 HydrophobicContact CB-CG1 4.43Å; M160-I185 HydrophobicContact CG-CG1 4.16Å; M160-I185 HydrophobicContact SD-CG1 4.48Å; I185-V187 HydrophobicContact CG2-CG2 4.23Å
186	T	45.3	Very low	41.9	Very low	37 Å²	37	71.4 Å²	71.4	23%	0.227	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	148.2	166.8	47	0	0	0	0	109.6	S159 H161	S159-T186 WeakPolarHBondContact CB-OG1 3.45Å; S159-T186 PolarHBondContact N-O 3.14Å; S159-T186 VanDerWaalsContact N-O 3.08Å; S159-T186 PolarHBondContact O-N 2.71Å; S159-T186 PolarHBondContact O-OG1 3.22Å; H161-T186 PolarHBondContact NE2-OG1 3.39Å
187	V	46.9	Very low	41.9	Very low	45 Å²	45	71.4 Å²	71.4	27%	0.273	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	119.8	179	-173.2	0	0	0	0	107.5	V156 I157 F158 I185	V156-V187 HydrophobicContact CG1-CG1 3.7Å; I157-V187 WeakPolarHBondContact O-CA 3.37Å; F158-V187 HydrophobicContact CD1-CG1 4.25Å; F158-V187 HydrophobicContact CD1-CG2 3.73Å; F158-V187 HydrophobicContact CE1-CG1 3.97Å; F158-V187 HydrophobicContact CE1-CG2 3.82Å; F158-V187 HydrophobicContact CZ-CG1 4.29Å; I185-V187 HydrophobicContact CG2-CG2 4.23Å
188	E	48.5	Very low	41.8	Very low	116 Å²	116	71.4 Å²	71.4	54%	0.542	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.8	179.3	-62.7	178.2	172.4	0	0	109.5	V156 I157	V156-E188 WeakPolarHBondContact CA-O 3.31Å; I157-E188 HydrophobicContact CB-CB 4.34Å; I157-E188 PolarHBondContact N-O 2.87Å; I157-E188 PolarHBondContact O-N 2.94Å
189	V	47.2	Very low	41.6	Very low	26 Å²	26	72.1 Å²	72.1	16%	0.158	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	106.4	177.7	-173.8	0	0	0	0	109.3	I22 F154 R155 V156 I223	I22-V189 HydrophobicContact CD1-CG1 4.29Å; F154-V189 HydrophobicContact CB-CG1 4.41Å; F154-V189 HydrophobicContact CD1-CG1 4.36Å; R155-V189 WeakPolarHBondContact O-CA 3.33Å; V156-V189 HydrophobicContact CG1-CG2 4.39Å; V156-V189 HydrophobicContact CG2-CG2 4.32Å; V189-I223 HydrophobicContact CB-CD1 4.04Å
190	E	48.4	Very low	41.1	Very low	80 Å²	80	74 Å²	74	37%	0.374	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128.5	179	174	-168.8	-165.8	0	0	108.9	F154 R155 L192	F154-E190 CarbonylContact C-O 3.58Å; F154-E190 VanDerWaalsContact CA-O 3.27Å; F154-E190 WeakPolarHBondContact CA-O 3.39Å; R155-E190 HydrophobicContact CB-CB 4.28Å; R155-E190 VanDerWaalsContact CD-OE2 3.25Å; R155-E190 WeakPolarHBondContact CD-OE2 3.25Å; R155-E190 IonicContact CZ-OE2 3.09Å; R155-E190 PolarHBondContact N-O 2.9Å; R155-E190 IonicContact NE-OE2 2.65Å; R155-E190 IonicContact NH1-OE1 3.72Å; R155-E190 PolarHBondContact NH1-OE1 3.48Å; R155-E190 IonicContact NH1-OE2 3.74Å; R155-E190 PolarHBondContact NH1-OE2 3.19Å; R155-E190 PolarHBondContact O-N 3.31Å; E190-L192 HydrophobicContact CG-CD2 3.97Å
191	L	49.2	Very low	40.7	Very low	54 Å²	54	77.8 Å²	77.8	28%	0.283	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	121.7	167.1	-178.1	74	0	0	0	108.4	I152 Q153 F154 I194 P219 I221	I152-L191 HydrophobicContact CG2-CD1 3.57Å; Q153-L191 WeakPolarHBondContact O-CD1 3.3Å; F154-L191 HydrophobicContact CD1-CB 4.47Å; F154-L191 HydrophobicContact CD1-CD1 3.65Å; F154-L191 HydrophobicContact CE1-CD1 3.58Å; F154-L191 HydrophobicContact CG-CD1 4.27Å; F154-L191 HydrophobicContact CZ-CD1 4.14Å; L191-I194 HydrophobicContact CD2-CD1 4.09Å; L191-I194 HydrophobicContact CD2-CG1 4.28Å; L191-P219 HydrophobicContact CD2-CG 3.32Å; L191-I221 HydrophobicContact CB-CD1 4.46Å
192	L	49.4	Very low	40.1	Very low	49 Å²	49	79.4 Å²	79.4	26%	0.257	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-42.6	-177.6	-67.8	-177.7	0	0	0	113.4	H93 Q153 R155 E190	H93-L192 VanDerWaalsContact CD2-CD1 3.41Å; H93-L192 WeakPolarHBondContact CD2-CD1 3.42Å; Q153-L192 HydrophobicContact CB-CB 4.41Å; Q153-L192 HydrophobicContact CG-CB 4.32Å; Q153-L192 HydrophobicContact CG-CD1 4.24Å; Q153-L192 VanDerWaalsContact NE2-CD1 3.31Å; Q153-L192 PolarHBondContact O-N 3.22Å; R155-L192 HydrophobicContact CB-CD1 3.89Å; R155-L192 HydrophobicContact CB-CD2 4.1Å; R155-L192 HydrophobicContact CB-CG 3.93Å; E190-L192 HydrophobicContact CG-CD2 3.97Å
193	D	49.7	Very low	39.7	Very low	66 Å²	66	84.1 Å²	84.1	35%	0.353	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	150.9	-176.6	-158.2	-7	0	0	0	112.6	Q153	Q153-D193 PolarHBondContact N-O 2.94Å; Q153-D193 PolarHBondContact O-N 2.91Å
194	I	50.3	Low	39.1	Very low	65 Å²	65	88.3 Å²	88.3	33%	0.333	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	101.2	160.1	-59.9	173.7	0	0	0	105	I152 L191 D196 P219	I152-I194 HydrophobicContact CG1-CG1 4.4Å; I152-I194 HydrophobicContact CG2-CG1 4.11Å; L191-I194 HydrophobicContact CD2-CD1 4.09Å; L191-I194 HydrophobicContact CD2-CG1 4.28Å; I194-D196 PolarHBondContact O-N 2.84Å; I194-P219 HydrophobicContact CD1-CG 4.45Å
195	N	49.2	Very low	38.3	Very low	38 Å²	38	90.4 Å²	90.4	20%	0.203	49%	0.486	C	S	.	.	S	Bend	trans	-47.1	100.6	-164.8	-73.9	-92.5	0	0	0	114.7	I116 L151	I116-N195 HydrophobicContact CD1-CB 3.94Å; L151-N195 PolarHBondContact O-ND2 3.24Å
196	D	37.8	Very low	37.6	Very low	71 Å²	71	93.9 Å²	93.9	38%	0.38	51%	0.511	S	S	.	.			trans	-149.8	98.5	157.8	-132.4	-11	0	0	0	110	S112 I194 S198	S112-D196 WeakPolarHBondContact CB-OD2 3.42Å; S112-D196 PolarHBondContact OG-OD2 3.3Å; I194-D196 PolarHBondContact O-N 2.84Å; D196-S198 PolarHBondContact O-N 2.91Å
197	N	31.5	Very low	36.6	Very low	151 Å²	151	98.5 Å²	98.5	81%	0.807	53%	0.533	S	S	*	.			trans	-83.3	61.5	-172.6	-104	-74.3	0	0	0	112.2
198	S	27.8	Very low	35.6	Very low	82 Å²	82	101.5 Å²	101.5	57%	0.573	55%	0.553	S	S	*	*	S	Bend	trans	-156.1	138.3	166.6	54.1	0	0	0	0	111.3	D196	D196-S198 PolarHBondContact O-N 2.91Å
199	P	26.8	Very low	34.5	Very low	120 Å²	120	105.4 Å²	105.4	78%	0.779	57%	0.569	S	S	*	*	S	Bend	trans	-69.1	156.1	174.5	30.8	-35.2	0	0	0	111.6
200	Q	25.8	Very low	33.3	Very low	168 Å²	168	109.9 Å²	109.9	79%	0.785	60%	0.596	S	S	*	*			trans	77.8	104.6	178.9	-52.3	-178.6	-10.3	0	0	116.3	I202	Q200-I202 PolarHBondContact O-N 2.82Å
201	F	25.4	Very low	32.1	Very low	179 Å²	179	111.8 Å²	111.8	79%	0.785	61%	0.613	S	S	*	*			trans	-64.7	107.9	154.3	-77.7	-86.7	0	0	0	109.5	L203	F201-L203 PolarHBondContact O-N 2.71Å; F201-L203 VanDerWaalsContact O-N 3.16Å
202	I	24.2	Very low	30.9	Very low	149 Å²	149	112.5 Å²	112.5	76%	0.764	62%	0.62	S	S	*	*			trans	-81.4	94.6	175.8	-57.3	179.1	0	0	0	109.4	Q200	Q200-I202 PolarHBondContact O-N 2.82Å
203	L	26.6	Very low	29.5	Very low	146 Å²	146	117.4 Å²	117.4	76%	0.764	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-81.3	126.3	170.1	-74.8	170.7	0	0	0	111	F201	F201-L203 PolarHBondContact O-N 2.71Å; F201-L203 VanDerWaalsContact O-N 3.16Å
204	P	24.6	Very low	28.4	Very low	115 Å²	115	118.8 Å²	118.8	75%	0.747	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-71.4	151.7	169	29.6	-33.1	0	0	0	112
205	V	25.9	Very low	27.1	Very low	103 Å²	103	126.4 Å²	126.4	62%	0.624	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-57	139	-170.9	175.7	0	0	0	0	113.2	K1372	V205-K1372 HydrophobicContact CG1-CD 4.11Å
206	P	28.7	Very low	25.8	Very low	112 Å²	112	129.1 Å²	129.1	73%	0.727	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-84.8	158.7	-164.8	33.3	-38.5	0	0	0	116
207	I	25.6	Very low	25.2	Very low	134 Å²	134	130.5 Å²	130.5	69%	0.687	71%	0.714	S	S	*	*			trans	-126.8	135.6	164.2	-66	-179.9	0	0	0	106.9	Y1376	I207-Y1376 HydrophobicContact CG2-CE2 4.25Å
208	P	25.9	Very low	24.9	Very low	107 Å²	107	129.8 Å²	129.8	70%	0.695	71%	0.708	S	S	*	*			trans	-81.2	131.1	-154.2	29.3	-36.3	0	0	0	115.3
209	K	24.1	Very low	24.8	Very low	199 Å²	199	129 Å²	129	87%	0.865	70%	0.701	S	S	*	*			trans	-135.2	154.5	147.1	-78.2	-166.2	175.3	-174.8	0	109.3	T211	K209-T211 PolarHBondContact O-N 3.23Å
210	T	23.1	Very low	24.9	Very low	119 Å²	119	129.1 Å²	129.1	73%	0.73	70%	0.7	S	S	*	*			trans	-74.9	101.1	-172.3	45.1	0	0	0	0	112.5	T662	T210-T662 HydrophobicContact CG2-CG2 4.26Å
211	T	22.9	Very low	25	Very low	120 Å²	120	122.7 Å²	122.7	74%	0.736	67%	0.67	S	S	*	*			trans	-151.9	141.5	162.7	-37.4	0	0	0	0	109.3	K209 L213	K209-T211 PolarHBondContact O-N 3.23Å; T211-L213 PolarHBondContact O-N 3.35Å
212	T	23.5	Very low	25.1	Very low	69 Å²	69	118.3 Å²	118.3	42%	0.423	65%	0.652	S	S	.	*			trans	-66.6	127.8	-178.6	-42.9	0	0	0	0	111.1	N661	T212-N661 HydrophobicContact CG2-CB 4.24Å; T212-N661 PolarHBondContact OG1-ND2 2.82Å
213	L	20.8	Very low	25.2	Very low	152 Å²	152	114.6 Å²	114.6	80%	0.796	63%	0.633	S	S	*	*			trans	-112.9	94.6	166.3	-86	168.2	0	0	0	109.3	T211	T211-L213 PolarHBondContact O-N 3.35Å
214	L	26	Very low	25.2	Very low	95 Å²	95	111.3 Å²	111.3	50%	0.497	62%	0.623	S	S	.	*			trans	-68.9	144.8	153.4	-90.9	160	0	0	0	108.5	T685	L214-T685 HydrophobicContact CD2-CG2 3.89Å
215	Y	22.7	Very low	25.2	Very low	226 Å²	226	110.1 Å²	110.1	89%	0.886	61%	0.613	S	S	*	*	S	Bend	trans	-72.9	154.1	178.2	-95.9	-110.2	0	0	0	111.8
216	S	22.7	Very low	25.1	Very low	95 Å²	95	114.6 Å²	114.6	66%	0.664	63%	0.627	S	S	*	*	S	Bend	trans	67.9	96.5	-178.3	-160.5	0	0	0	0	115.7	I218	S216-I218 VanDerWaalsContact C-N 3.35Å; S216-I218 PolarHBondContact O-N 3.49Å
217	P	24.2	Very low	24.8	Very low	100 Å²	100	115.3 Å²	115.3	65%	0.649	62%	0.621	S	S	*	*			trans	-80.1	78.7	174.9	34.5	-34.7	0	0	0	111.5
218	I	25.4	Very low	24.7	Very low	136 Å²	136	114.8 Å²	114.8	70%	0.697	63%	0.629	S	S	*	*			trans	-67.5	124.4	149.1	-59.2	177.7	0	0	0	105.7	S216 V220	S216-I218 VanDerWaalsContact C-N 3.35Å; S216-I218 PolarHBondContact O-N 3.49Å; I218-V220 PolarHBondContact O-N 2.92Å
219	P	27	Very low	24.5	Very low	64 Å²	64	118.5 Å²	118.5	42%	0.416	64%	0.639	S	S	.	*			trans	-67.3	105.7	-178.7	27.4	-34.9	0	0	0	109.8	L191 I194 I221	L191-P219 HydrophobicContact CD2-CG 3.32Å; I194-P219 HydrophobicContact CD1-CG 4.45Å; P219-I221 PolarHBondContact O-N 3.11Å
220	V	27.2	Very low	24.4	Very low	124 Å²	124	112.5 Å²	112.5	75%	0.752	63%	0.633	S	S	*	*			trans	-63.3	104.5	177.5	178.6	0	0	0	0	109.1	I218 E222	I218-V220 PolarHBondContact O-N 2.92Å; V220-E222 PolarHBondContact O-N 2.85Å
221	I	28.2	Very low	24.3	Very low	33 Å²	33	114.5 Å²	114.5	17%	0.169	64%	0.639	C	S	.	*	B	Isolated β-bridge	trans	-79.5	112.2	163.1	-59.5	169.9	0	0	0	106.4	I22 F154 L191 P219 I223	I22-I221 HydrophobicContact CB-CG2 4.07Å; I22-I221 HydrophobicContact CG1-CG2 3.96Å; I22-I221 HydrophobicContact CG2-CG2 3.75Å; F154-I221 HydrophobicContact CD1-CD1 4.22Å; F154-I221 HydrophobicContact CE1-CD1 3.79Å; L191-I221 HydrophobicContact CB-CD1 4.46Å; P219-I221 PolarHBondContact O-N 3.11Å; I221-I223 VanDerWaalsContact C-N 3.33Å; I221-I223 HydrophobicContact CB-CG1 4.36Å; I221-I223 HydrophobicContact CG2-CD1 4.4Å; I221-I223 HydrophobicContact CG2-CG1 3.65Å; I221-I223 PolarHBondContact O-N 3.34Å
222	E	27.1	Very low	24.2	Very low	87 Å²	87	113.9 Å²	113.9	41%	0.407	63%	0.627	S	S	.	*			trans	-71.6	89.7	170.6	-172	-171.9	178.2	0	0	109.2	K23 V220 S224	K23-E222 VanDerWaalsContact CD-OE2 3.31Å; K23-E222 WeakPolarHBondContact CD-OE2 3.43Å; K23-E222 WeakPolarHBondContact CE-OE2 3.26Å; K23-E222 IonicContact NZ-OE1 3.67Å; K23-E222 IonicContact NZ-OE2 2.76Å; K23-E222 PolarHBondContact NZ-OE2 2.69Å; V220-E222 PolarHBondContact O-N 2.85Å; E222-S224 PolarHBondContact O-N 2.84Å
223	I	27.8	Very low	24.1	Very low	70 Å²	70	116.1 Å²	116.1	36%	0.359	64%	0.641	S	S	.	*			trans	-86.2	86.9	170.7	-52.1	-179	0	0	0	107.9	V20 V189 I221 V225	V20-I223 HydrophobicContact CG1-CG2 4.08Å; V189-I223 HydrophobicContact CB-CD1 4.04Å; I221-I223 VanDerWaalsContact C-N 3.33Å; I221-I223 HydrophobicContact CB-CG1 4.36Å; I221-I223 HydrophobicContact CG2-CD1 4.4Å; I221-I223 HydrophobicContact CG2-CG1 3.65Å; I221-I223 PolarHBondContact O-N 3.34Å; I223-V225 HydrophobicContact CG2-CG2 4.33Å; I223-V225 PolarHBondContact O-N 2.93Å
224	S	25.7	Very low	24.2	Very low	78 Å²	78	113.8 Å²	113.8	55%	0.545	64%	0.637	S	S	.	*			trans	-74.8	119.9	176.2	46.5	0	0	0	0	111.7	E222	E222-S224 PolarHBondContact O-N 2.84Å
225	V	25.2	Very low	24	Very low	90 Å²	90	116.7 Å²	116.7	55%	0.545	65%	0.651	S	S	.	*			trans	-127.3	112	168.6	-178	0	0	0	0	106.4	I223	I223-V225 HydrophobicContact CG2-CG2 4.33Å; I223-V225 PolarHBondContact O-N 2.93Å
226	E	22.9	Very low	24	Very low	197 Å²	197	113.5 Å²	113.5	92%	0.921	64%	0.644	S	S	*	*			trans	-73	130	-178.3	-66.2	177.5	138.5	0	0	110.8
227	E	23.8	Very low	23.9	Very low	127 Å²	127	116.1 Å²	116.1	59%	0.593	65%	0.649	S	S	*	*			trans	-98.7	167.5	-179.1	-62.5	-163.9	125.2	0	0	112.9
228	S	22.6	Very low	24	Very low	123 Å²	123	116.3 Å²	116.3	86%	0.86	65%	0.651	S	S	*	*			trans	-146.8	155.4	155.7	54.9	0	0	0	0	110.7
229	M	21.6	Very low	23.8	Very low	185 Å²	185	119.5 Å²	119.5	91%	0.911	66%	0.659	S	S	*	*			trans	-119	158	-150.2	-55.1	167.5	72	0	0	115.2
230	G	21.2	Very low	23.7	Very low	72 Å²	72	120.9 Å²	120.9	74%	0.742	68%	0.677	S	S	*	*			trans	109	150.1	162.1	0	0	0	0	0	114.9
231	L	22.1	Very low	23.4	Very low	162 Å²	162	122.1 Å²	122.1	85%	0.848	68%	0.678	S	S	*	*			cis	-140.5	-151.2	6.7	-144	84.5	0	0	0	112.7
232	H	21.2	Very low	23.3	Very low	106 Å²	106	128.3 Å²	128.3	49%	0.491	71%	0.712	S	S	.	*			trans	-125.2	145.5	-159.4	-110.7	-125.9	0	0	0	115
233	T	21.2	Very low	23.2	Very low	116 Å²	116	130.7 Å²	130.7	71%	0.712	73%	0.726	S	S	*	*			trans	64.8	150.4	148.2	60.7	0	0	0	0	120
234	C	21.7	Very low	23	Very low	104 Å²	104	135 Å²	135	70%	0.703	75%	0.75	S	S	*	*			cis	-170.9	178.3	-14.8	-104.8	0	0	0	0	111.2
235	I	22.5	Very low	22.9	Very low	155 Å²	155	136.9 Å²	136.9	80%	0.795	76%	0.763	S	S	*	*			trans	118.2	94.5	152.1	-57.6	176.7	0	0	0	117.8
236	H	22.3	Very low	22.9	Very low	159 Å²	159	137.5 Å²	137.5	74%	0.736	77%	0.772	S	S	*	*			trans	44.2	118	135.3	-71.6	-81.7	0	0	0	124.9
237	L	22	Very low	23	Very low	150 Å²	150	135.4 Å²	135.4	79%	0.785	77%	0.765	S	S	*	*				55	155	110.9	-94.4	82.1	0	0	0	120.9
238	P	25.5	Very low	23.1	Very low	104 Å²	104	140 Å²	140	68%	0.675	78%	0.779	S	S	*	*			cis	-143.8	168.9	30.9	43.4	-25	0	0	0	119.3
239	K	22	Very low	23.2	Very low	203 Å²	203	140.8 Å²	140.8	88%	0.883	77%	0.773	S	S	*	*			trans	71	154.2	167.7	-64.9	174.7	-178.2	179.8	0	115.2
240	A	23.2	Very low	23.3	Very low	94 Å²	94	138.1 Å²	138.1	78%	0.777	77%	0.767	S	S	*	*			cis	-123.1	-173.8	11.1	0	0	0	0	0	114
241	L	22.5	Very low	23.5	Very low	149 Å²	149	140.1 Å²	140.1	78%	0.78	77%	0.765	S	S	*	*			trans	-59.6	146	175.7	-68.9	62.9	0	0	0	110.8
242	D	24.6	Very low	23.7	Very low	164 Å²	164	141.4 Å²	141.4	88%	0.877	77%	0.767	S	S	*	*				-131.7	157.3	128.7	-145.8	-22.7	0	0	0	109
243	L	24.7	Very low	23.7	Very low	136 Å²	136	146.7 Å²	146.7	71%	0.712	78%	0.784	S	S	*	*			trans	-114.9	114	-173.3	-83.5	156.7	0	0	0	109.5	S245	L243-S245 PolarHBondContact O-N 2.83Å; L243-S245 VanDerWaalsContact O-N 3.12Å
244	D	25	Very low	23.8	Very low	162 Å²	162	150.6 Å²	150.6	87%	0.866	79%	0.785	S	S	*	*			trans	-65.7	113.7	-175.2	-142.9	-23.4	0	0	0	111	S246	D244-S246 PolarHBondContact O-N 2.89Å
245	S	23.9	Very low	23.9	Very low	117 Å²	117	152.5 Å²	152.5	82%	0.818	79%	0.787	S	S	*	*			trans	-95.1	81.4	-159.4	49.4	0	0	0	0	112.3	L243	L243-S245 PolarHBondContact O-N 2.83Å; L243-S245 VanDerWaalsContact O-N 3.12Å
246	S	24.4	Very low	24.1	Very low	103 Å²	103	151.2 Å²	151.2	72%	0.72	78%	0.778	S	S	*	*			trans	-135.8	25	-179.6	56	0	0	0	0	115.7	D244	D244-S246 PolarHBondContact O-N 2.89Å
247	I	25.4	Very low	24.5	Very low	152 Å²	152	148.9 Å²	148.9	78%	0.779	78%	0.78	S	S	*	*			trans	-130.9	87.1	168.1	-51.3	179.1	0	0	0	110.4
248	Y	25.9	Very low	24.9	Very low	224 Å²	224	149 Å²	149	88%	0.878	78%	0.78	S	S	*	*			trans	-142.8	94	157.8	-88.3	-70.4	0	0	0	109.4
249	D	24.9	Very low	25.3	Very low	140 Å²	140	146.5 Å²	146.5	75%	0.749	76%	0.763	S	S	*	*			trans	-74	135.6	165.4	-169.2	5.3	0	0	0	109
250	V	22.6	Very low	25.8	Very low	129 Å²	129	145.5 Å²	145.5	78%	0.782	76%	0.761	S	S	*	*			trans	-106.5	91.4	-172.6	-179.1	0	0	0	0	108.9
251	T	25.9	Very low	26.3	Very low	114 Å²	114	144.1 Å²	144.1	70%	0.699	75%	0.746	S	S	*	*			trans	-118.5	126.9	172	42.3	0	0	0	0	111
252	E	25.6	Very low	27.1	Very low	189 Å²	189	140 Å²	140	88%	0.883	73%	0.725	S	S	*	*			trans	-74.4	140.2	-177.7	-66.5	179.3	103.8	0	0	112.1	R254	E252-R254 PolarHBondContact O-N 2.79Å
253	Y	22.2	Very low	27.7	Very low	216 Å²	216	137.4 Å²	137.4	85%	0.847	71%	0.71	S	S	*	*			trans	-75.2	116.3	163.8	-85.1	-94.2	0	0	0	110.4	I255	Y253-I255 HydrophobicContact CD1-CD1 4.04Å; Y253-I255 HydrophobicContact CD1-CG1 4.2Å
254	R	23.7	Very low	28.2	Very low	198 Å²	198	136.3 Å²	136.3	75%	0.747	70%	0.704	S	S	*	*			trans	-118.8	100.6	158.2	-169.7	169.1	178.3	-166.5	-8.7	110.4	E252 E256	E252-R254 PolarHBondContact O-N 2.79Å; R254-E256 HydrophobicContact CG-CG 4.39Å; R254-E256 IonicContact CZ-OE1 3.12Å; R254-E256 IonicContact CZ-OE2 2.67Å; R254-E256 IonicContact NE-OE1 3.64Å; R254-E256 PolarHBondContact NE-OE1 2.99Å; R254-E256 IonicContact NE-OE2 2.65Å; R254-E256 VanDerWaalsContact NH2-CD 3.28Å; R254-E256 IonicContact NH2-OE1 2.73Å; R254-E256 PolarHBondContact NH2-OE1 2.79Å; R254-E256 IonicContact NH2-OE2 2.66Å; R254-E256 PolarHBondContact NH2-OE2 3.27Å; R254-E256 VanDerWaalsContact NH2-OE2 3.09Å
255	I	23.9	Very low	28.6	Very low	145 Å²	145	135.8 Å²	135.8	74%	0.744	70%	0.697	S	S	*	*			trans	-97.3	111.3	177.1	-60	172.9	0	0	0	108.4	Y253	Y253-I255 HydrophobicContact CD1-CD1 4.04Å; Y253-I255 HydrophobicContact CD1-CG1 4.2Å
256	E	26.8	Very low	29.1	Very low	127 Å²	127	137.6 Å²	137.6	59%	0.593	70%	0.696	S	S	*	*			trans	-128.8	120.3	173.7	-75.1	-178.1	-171.2	0	0	112	R254	R254-E256 HydrophobicContact CG-CG 4.39Å; R254-E256 IonicContact CZ-OE1 3.12Å; R254-E256 IonicContact CZ-OE2 2.67Å; R254-E256 IonicContact NE-OE1 3.64Å; R254-E256 PolarHBondContact NE-OE1 2.99Å; R254-E256 IonicContact NE-OE2 2.65Å; R254-E256 VanDerWaalsContact NH2-CD 3.28Å; R254-E256 IonicContact NH2-OE1 2.73Å; R254-E256 PolarHBondContact NH2-OE1 2.79Å; R254-E256 IonicContact NH2-OE2 2.66Å; R254-E256 PolarHBondContact NH2-OE2 3.27Å; R254-E256 VanDerWaalsContact NH2-OE2 3.09Å
257	S	29.5	Very low	29.5	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	70%	0.695	S	S	*	*			trans	54.3	87.9	167.6	56	0	0	0	0	118.7
258	L	30.5	Very low	29.8	Very low	153 Å²	153	139.6 Å²	139.6	80%	0.801	69%	0.693	S	S	*	*			trans	-79	147.5	140.2	-84.9	164.6	0	0	0	109.3	D262	L258-D262 HydrophobicContact CD2-CB 4.27Å
259	T	35.2	Very low	30	Very low	51 Å²	51	137.4 Å²	137.4	31%	0.313	69%	0.688	S	S	.	*			trans	-99.5	162.5	-175.1	78.6	0	0	0	0	112.6	S261 D262	T259-S261 PolarHBondContact O-N 3.14Å; T259-S261 VanDerWaalsContact O-N 3.15Å; T259-S261 PolarHBondContact OG1-N 3.47Å; T259-D262 WeakPolarHBondContact CA-OD2 3.48Å; T259-D262 WeakPolarHBondContact CB-OD2 3.41Å; T259-D262 PolarHBondContact N-OD2 3.28Å; T259-D262 PolarHBondContact O-N 3.42Å; T259-D262 PolarHBondContact OG1-OD2 2.82Å
260	Q	30.5	Very low	30.3	Very low	181 Å²	181	138.6 Å²	138.6	85%	0.846	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-11.3	178.6	-128	169.6	2.5	0	0	113.7
261	S	34.8	Very low	30.5	Very low	66 Å²	66	137.1 Å²	137.1	46%	0.462	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	-44.7	170.8	172.1	0	0	0	0	111.9	T259 I263 L264 Q265	T259-S261 PolarHBondContact O-N 3.14Å; T259-S261 VanDerWaalsContact O-N 3.15Å; T259-S261 PolarHBondContact OG1-N 3.47Å; S261-I263 VanDerWaalsContact C-N 3.25Å; S261-I263 PolarHBondContact O-N 2.55Å; S261-L264 PolarHBondContact O-N 2.97Å; S261-Q265 PolarHBondContact O-N 2.89Å
262	D	38.3	Very low	30.7	Very low	62 Å²	62	141.5 Å²	141.5	33%	0.332	70%	0.701	S	S	.	*	H	α-helix	trans	-66.9	-32.8	-171.2	-48	-48.8	0	0	0	111.1	L258 T259 L264	L258-D262 HydrophobicContact CD2-CB 4.27Å; T259-D262 WeakPolarHBondContact CA-OD2 3.48Å; T259-D262 WeakPolarHBondContact CB-OD2 3.41Å; T259-D262 PolarHBondContact N-OD2 3.28Å; T259-D262 PolarHBondContact O-N 3.42Å; T259-D262 PolarHBondContact OG1-OD2 2.82Å; D262-L264 VanDerWaalsContact C-N 3.27Å; D262-L264 PolarHBondContact O-N 3.28Å
263	I	37.6	Very low	30.6	Very low	109 Å²	109	136.8 Å²	136.8	56%	0.559	69%	0.689	S	S	*	*	H	α-helix	trans	-70.6	-20.2	175.4	-62	173.8	0	0	0	112.3	S261	S261-I263 VanDerWaalsContact C-N 3.25Å; S261-I263 PolarHBondContact O-N 2.55Å
264	L	34.7	Very low	31	Very low	113 Å²	113	134 Å²	134	59%	0.592	69%	0.689	S	S	*	*	H	α-helix	trans	-93.8	-31.2	-177	-156.2	70	0	0	0	113.3	S261 D262 K267	S261-L264 PolarHBondContact O-N 2.97Å; D262-L264 VanDerWaalsContact C-N 3.27Å; D262-L264 PolarHBondContact O-N 3.28Å; L264-K267 PolarHBondContact O-N 2.97Å
265	Q	35	Very low	31.1	Very low	152 Å²	152	132.7 Å²	132.7	71%	0.71	70%	0.696	S	S	*	*	H	α-helix	trans	-72	-38.7	174.8	-65.4	-160.6	15.5	0	0	112.4	S261 K267 N268	S261-Q265 PolarHBondContact O-N 2.89Å; Q265-K267 PolarHBondContact O-N 2.99Å; Q265-K267 VanDerWaalsContact O-N 3.14Å; Q265-N268 PolarHBondContact O-N 2.74Å
266	L	34.7	Very low	31.2	Very low	155 Å²	155	133 Å²	133	81%	0.812	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-12.9	173.8	-86.4	164	0	0	0	113.9
267	K	31.1	Very low	31.1	Very low	159 Å²	159	129.9 Å²	129.9	69%	0.691	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-6.1	-178.5	-135.1	171.8	-173.6	175.1	0	114.7	L264 Q265	L264-K267 PolarHBondContact O-N 2.97Å; Q265-K267 PolarHBondContact O-N 2.99Å; Q265-K267 VanDerWaalsContact O-N 3.14Å
268	N	32.1	Very low	31	Very low	137 Å²	137	132.1 Å²	132.1	73%	0.733	71%	0.708	S	S	*	*	S	Bend	trans	-117.4	13.7	-174.8	-84.8	-32.9	0	0	0	114.3	Q265	Q265-N268 PolarHBondContact O-N 2.74Å
269	K	30.1	Very low	30.9	Very low	178 Å²	178	132.2 Å²	132.2	77%	0.774	71%	0.709	S	S	*	*	S	Bend	trans	-124.4	125.4	163.1	-76.7	-177.2	178.4	175	0	108.9
270	L	30.8	Very low	30.4	Very low	165 Å²	165	138.2 Å²	138.2	86%	0.864	73%	0.731	S	S	*	*			trans	68.5	127	-167.9	-46	171.4	0	0	0	111.4
271	S	27.1	Very low	30.1	Very low	99 Å²	99	135.8 Å²	135.8	69%	0.692	72%	0.723	S	S	*	*			cis	-137.9	137.2	31.7	49.1	0	0	0	0	113.7
272	H	30.7	Very low	29.7	Very low	206 Å²	206	140.2 Å²	140.2	95%	0.954	74%	0.737	S	S	*	*	S	Bend	trans	-155.1	46	143.3	-110.8	74.2	0	0	0	110.9
273	S	23.6	Very low	29	Very low	90 Å²	90	145.9 Å²	145.9	63%	0.629	77%	0.766	S	S	*	*	S	Bend	trans	-150.4	136.7	145.4	67.9	0	0	0	0	110.4
274	N	30.4	Very low	28.5	Very low	157 Å²	157	146 Å²	146	84%	0.84	77%	0.774	S	S	*	*			trans	54.3	72.8	149.6	-54.7	-8.1	0	0	0	119.7
275	L	26.4	Very low	27.9	Very low	171 Å²	171	150.4 Å²	150.4	90%	0.895	79%	0.789	S	S	*	*			trans	-155	129.5	145.5	-112.7	169.3	0	0	0	110.1
276	V	25.4	Very low	27.3	Very low	151 Å²	151	148.3 Å²	148.3	92%	0.915	79%	0.791	S	S	*	*			trans	-148.9	127.3	175.7	176.6	0	0	0	0	109.1
277	G	25.3	Very low	26.8	Very low	62 Å²	62	147.8 Å²	147.8	64%	0.639	79%	0.788	S	S	*	*			trans	149.9	111.1	162.8	0	0	0	0	0	115.9
278	I	26.8	Very low	26.4	Very low	158 Å²	158	149.1 Å²	149.1	81%	0.81	80%	0.797	S	S	*	*			trans	52.8	89.8	140.7	-48.9	166.1	0	0	0	114.2
279	D	27.8	Very low	26.1	Very low	155 Å²	155	149.5 Å²	149.5	83%	0.829	79%	0.794	S	S	*	*				57.7	87.9	51.8	-167.8	22.6	0	0	0	114.3
280	K	25	Very low	25.8	Very low	177 Å²	177	148.5 Å²	148.5	77%	0.77	79%	0.794	S	S	*	*			trans	-175.7	133.3	154.9	-107.6	164.7	-174.5	177.7	0	111.6
281	N	23.8	Very low	25.6	Very low	129 Å²	129	145.3 Å²	145.3	69%	0.69	79%	0.786	S	S	*	*			trans	49.9	152.5	141.7	-70.3	29.1	0	0	0	123.6
282	E	27.1	Very low	25.3	Very low	160 Å²	160	146 Å²	146	75%	0.748	79%	0.789	S	S	*	*			trans	70.2	63.1	147.3	-72.5	151.7	-116.7	0	0	118.6
283	L	22.5	Very low	25.1	Very low	180 Å²	180	142 Å²	142	94%	0.942	78%	0.779	S	S	*	*			trans	-116.8	96.9	141.2	-91.9	169.9	0	0	0	110.1
284	P	27.4	Very low	25.1	Very low	112 Å²	112	144.9 Å²	144.9	73%	0.727	79%	0.788	S	S	*	*			trans	-103.5	131.3	172.8	34.7	-26.9	0	0	0	112.6
285	F	22.9	Very low	25.3	Very low	205 Å²	205	142.2 Å²	142.2	90%	0.899	78%	0.779	S	S	*	*			trans	-79.4	154.6	152.9	-77.4	-99.3	0	0	0	109.6
286	S	23.2	Very low	25.2	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	78%	0.775	S	S	*	*			trans	58.2	127.3	154.6	-166.6	0	0	0	0	119.1
287	L	23.5	Very low	25.3	Very low	145 Å²	145	139.6 Å²	139.6	76%	0.759	76%	0.764	S	S	*	*			trans	-157	69.7	152.2	-122.2	168.7	0	0	0	112.8	H289	L287-H289 VanDerWaalsContact CD2-CD2 3.46Å; L287-H289 WeakPolarHBondContact CD2-CD2 3.13Å
288	E	22.5	Very low	25.2	Very low	186 Å²	186	144 Å²	144	87%	0.869	77%	0.768	S	S	*	*			trans	-90.8	120.1	148.5	-76.9	-157.5	141.7	0	0	109.7
289	H	24.9	Very low	25.1	Very low	146 Å²	146	141.2 Å²	141.2	68%	0.676	75%	0.754	S	S	*	*			trans	-63	152.5	155.2	-77.9	-120.3	0	0	0	108.4	L287	L287-H289 VanDerWaalsContact CD2-CD2 3.46Å; L287-H289 WeakPolarHBondContact CD2-CD2 3.13Å
290	M	24.7	Very low	24.9	Very low	157 Å²	157	143.5 Å²	143.5	77%	0.773	75%	0.752	S	S	*	*			cis	-163.8	148.7	10.1	-120	153.7	50.6	0	0	105.2
291	S	25.4	Very low	24.9	Very low	98 Å²	98	141.6 Å²	141.6	69%	0.685	75%	0.749	S	S	*	*			cis	178.6	161.2	44.7	42.5	0	0	0	0	111.6
292	C	21.2	Very low	24.8	Very low	112 Å²	112	143.6 Å²	143.6	76%	0.757	76%	0.755	S	S	*	*			trans	29.4	142.1	133.9	-51.7	0	0	0	0	120.9
293	T	26.6	Very low	24.6	Very low	122 Å²	122	141.5 Å²	141.5	75%	0.748	75%	0.752	S	S	*	*			cis	-173.1	144.4	11.9	5.9	0	0	0	0	113.4
294	D	24	Very low	24.7	Very low	152 Å²	152	138.5 Å²	138.5	81%	0.813	74%	0.737	S	S	*	*			trans	63.4	166.9	137.3	-95.9	-1.9	0	0	0	123.5
295	P	35.1	Very low	24.7	Very low	100 Å²	100	140.4 Å²	140.4	65%	0.649	74%	0.738	S	S	*	*			trans	-136.7	-137.4	-137.3	44.8	-23.2	0	0	0	115.3
296	L	24.5	Very low	24.9	Very low	158 Å²	158	136.5 Å²	136.5	83%	0.827	73%	0.727	S	S	*	*			trans	91.3	150.1	176.5	-51.9	166.4	0	0	0	114.4
297	V	26.8	Very low	25.1	Very low	110 Å²	110	137.6 Å²	137.6	67%	0.667	73%	0.729	S	S	*	*			cis	-157.7	144.7	8.4	94.5	0	0	0	0	113.2
298	Q	24.1	Very low	25.5	Very low	155 Å²	155	136 Å²	136	72%	0.724	73%	0.727	S	S	*	*			trans	35.5	158.2	134.2	-72.1	-178.2	-17.2	0	0	123.6
299	N	24.3	Very low	25.7	Very low	98 Å²	98	133 Å²	133	52%	0.524	72%	0.722	S	S	.	*			cis	-170.7	167.4	9.2	-121.3	-14.7	0	0	0	115.4
300	Y	23.9	Very low	25.7	Very low	203 Å²	203	135 Å²	135	80%	0.796	73%	0.731	S	S	*	*			trans	67	153.4	149	-75.7	-53.2	0	0	0	120.9
301	I	23.9	Very low	25.9	Very low	137 Å²	137	136.1 Å²	136.1	70%	0.703	74%	0.735	S	S	*	*			cis	-142.8	141.2	18.9	-76.6	-168.6	0	0	0	113.2
302	E	22.9	Very low	26	Very low	172 Å²	172	138.5 Å²	138.5	80%	0.804	75%	0.745	S	S	*	*			trans	29.6	159	142.8	-55.9	179.8	139.6	0	0	124.2
303	V	23.2	Very low	26.3	Very low	116 Å²	116	139.9 Å²	139.9	70%	0.703	75%	0.745	S	S	*	*			cis	-161.7	130.2	-2.7	117.7	0	0	0	0	109.3
304	D	24.6	Very low	26.5	Very low	116 Å²	116	143 Å²	143	62%	0.62	75%	0.751	S	S	*	*				65.4	143.1	103.7	-126.5	-1.3	0	0	0	116.7
305	M	27.3	Very low	26.6	Very low	152 Å²	152	139.3 Å²	139.3	75%	0.749	75%	0.749	S	S	*	*			cis	-144	155.8	20.6	-85.3	-90.6	-172.9	0	0	114.7
306	N	26.3	Very low	26.1	Very low	124 Å²	124	144.4 Å²	144.4	66%	0.663	76%	0.761	S	S	*	*			trans	-19.1	158.3	151.8	-52.6	-75	0	0	0	118.8
307	T	26.9	Very low	26.1	Very low	130 Å²	130	144.9 Å²	144.9	80%	0.798	76%	0.759	S	S	*	*			cis	-169.5	159.9	35.4	-17.7	0	0	0	0	111.7
308	P	33.3	Very low	26	Very low	111 Å²	111	145.8 Å²	145.8	72%	0.721	76%	0.759	S	S	*	*			trans	-105.5	168.6	173.5	38.4	-33.7	0	0	0	115.3
309	V	25.5	Very low	26.1	Very low	125 Å²	125	143.9 Å²	143.9	76%	0.758	76%	0.759	S	S	*	*			trans	156.9	122.6	136.6	159.3	0	0	0	0	115.5
310	Q	26	Very low	26.3	Very low	188 Å²	188	144.7 Å²	144.7	88%	0.879	77%	0.767	S	S	*	*			trans	50.3	172	147.2	-64.6	-177.1	-36.7	0	0	124.3
311	Q	27.8	Very low	26.7	Very low	180 Å²	180	141.7 Å²	141.7	84%	0.841	77%	0.765	S	S	*	*			trans	-102.1	160.7	-163	-53.2	161.9	-55.5	0	0	113.8
312	T	27.3	Very low	27.1	Very low	147 Å²	147	142.7 Å²	142.7	90%	0.902	77%	0.772	S	S	*	*				-175.6	170.5	125.5	19.2	0	0	0	0	111.9
313	N	28.9	Very low	27.4	Very low	142 Å²	142	142.1 Å²	142.1	76%	0.759	77%	0.769	S	S	*	*			trans	-109.7	155	-169.4	-87.8	13.7	0	0	0	114.9
314	E	29.3	Very low	27.7	Very low	188 Å²	188	144.8 Å²	144.8	88%	0.879	78%	0.778	S	S	*	*			trans	66.7	141.4	157.3	-69.5	168.3	-132.9	0	0	119.3
315	G	26.6	Very low	27.9	Very low	74 Å²	74	145.6 Å²	145.6	76%	0.763	78%	0.782	S	S	*	*			trans	-175.1	-34	-177.6	0	0	0	0	0	122.7
316	F	24.4	Very low	27.9	Very low	206 Å²	206	144 Å²	144	90%	0.904	78%	0.781	S	S	*	*			trans	66	161.2	172.7	-103.4	-88.6	0	0	0	121.8
317	E	25.3	Very low	27.9	Very low	168 Å²	168	144.2 Å²	144.2	79%	0.785	79%	0.789	S	S	*	*			trans	66.3	153.8	165.2	-63.6	-145.9	144.1	0	0	121.1
318	L	24.9	Very low	27.7	Very low	129 Å²	129	143.1 Å²	143.1	68%	0.675	79%	0.787	S	S	*	*			cis	-166.8	166.2	-40.8	-141.3	144.2	0	0	0	109.3
319	T	26.5	Very low	27.3	Very low	115 Å²	115	145.5 Å²	145.5	71%	0.706	79%	0.793	S	S	*	*			trans	76.2	146.7	168.3	76.9	0	0	0	0	117.4
320	T	28.3	Very low	27.3	Very low	115 Å²	115	147.7 Å²	147.7	71%	0.706	79%	0.792	S	S	*	*			cis	-157.2	154.9	-8.5	6.1	0	0	0	0	113.3
321	N	31.7	Very low	27.4	Very low	141 Å²	141	144.5 Å²	144.5	75%	0.754	79%	0.785	S	S	*	*			trans	110.6	128.7	148.7	-65.2	-22.8	0	0	0	121.4
322	N	33.2	Very low	27.4	Very low	157 Å²	157	141.6 Å²	141.6	84%	0.84	77%	0.774	S	S	*	*			trans	62.3	87.9	158.2	-65.7	7.3	0	0	0	119.5
323	Q	27.8	Very low	27.4	Very low	161 Å²	161	142 Å²	142	75%	0.752	77%	0.771	S	S	*	*			trans	-52.4	151.7	161	-58.4	157.5	-25.9	0	0	113.5	L325	Q323-L325 HydrophobicContact CB-CG 4.3Å; Q323-L325 HydrophobicContact CG-CD1 4.19Å; Q323-L325 HydrophobicContact CG-CG 4.23Å
324	L	31.1	Very low	27.5	Very low	171 Å²	171	144.6 Å²	144.6	90%	0.895	77%	0.771	S	S	*	*				-122.6	114.7	121	-162.4	80.2	0	0	0	107.8
325	L	27.6	Very low	27.5	Very low	133 Å²	133	142.8 Å²	142.8	70%	0.696	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-90.6	117	177.9	-82.1	164.9	0	0	0	110	Q323	Q323-L325 HydrophobicContact CB-CG 4.3Å; Q323-L325 HydrophobicContact CG-CD1 4.19Å; Q323-L325 HydrophobicContact CG-CG 4.23Å
326	T	28.2	Very low	27.7	Very low	120 Å²	120	145.7 Å²	145.7	74%	0.736	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-100.5	132.5	155.1	43.5	0	0	0	0	109
327	P	25.7	Very low	28	Very low	128 Å²	128	145.7 Å²	145.7	83%	0.831	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-74.1	137.2	-176.3	29.1	-34.2	0	0	0	111.6
328	S	23.4	Very low	28.4	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-75	125	178.7	56.2	0	0	0	0	112.4	K330	S328-K330 PolarHBondContact O-N 3.2Å
329	L	24.9	Very low	28.6	Very low	161 Å²	161	144.3 Å²	144.3	84%	0.843	76%	0.758	S	S	*	*			trans	-87	89.9	161.1	-169.2	78.4	0	0	0	109.3	V331	L329-V331 HydrophobicContact CD2-CG2 4.32Å; L329-V331 HydrophobicContact CG-CG2 4.19Å; L329-V331 PolarHBondContact O-N 3.29Å
330	K	25.6	Very low	28.8	Very low	171 Å²	171	144.9 Å²	144.9	74%	0.743	76%	0.761	S	S	*	*			trans	-95.5	89.2	176.3	-168.5	-179.8	-173.9	-178.7	0	110.2	S328 I332	S328-K330 PolarHBondContact O-N 3.2Å; K330-I332 HydrophobicContact CD-CD1 4.35Å; K330-I332 HydrophobicContact CG-CD1 4.48Å; K330-I332 HydrophobicContact CG-CG1 4.2Å
331	V	26.5	Very low	28.9	Very low	121 Å²	121	144.7 Å²	144.7	73%	0.733	75%	0.752	S	S	*	*			trans	-81.5	130.9	168.5	-177.1	0	0	0	0	108.5	L329	L329-V331 HydrophobicContact CD2-CG2 4.32Å; L329-V331 HydrophobicContact CG-CG2 4.19Å; L329-V331 PolarHBondContact O-N 3.29Å
332	I	28.1	Very low	29	Very low	118 Å²	118	146.7 Å²	146.7	61%	0.605	75%	0.75	S	S	*	*			trans	-125.7	123.1	173.7	-55.1	172.6	0	0	0	106.7	K330	K330-I332 HydrophobicContact CD-CD1 4.35Å; K330-I332 HydrophobicContact CG-CD1 4.48Å; K330-I332 HydrophobicContact CG-CG1 4.2Å
333	N	28.2	Very low	29.1	Very low	156 Å²	156	147.4 Å²	147.4	83%	0.834	74%	0.742	S	S	*	*			trans	-153	162.1	145.3	-151.8	6.6	0	0	0	111
334	Y	30.7	Very low	29.3	Very low	196 Å²	196	149 Å²	149	77%	0.769	74%	0.742	S	S	*	*			trans	-102.5	154.8	-176.5	-92	-107.4	0	0	0	112.5
335	L	30.1	Very low	29.6	Very low	151 Å²	151	146.5 Å²	146.5	79%	0.791	73%	0.728	S	S	*	*			trans	79.1	141.7	156.6	-70.2	155.8	0	0	0	120.5
336	D	30.5	Very low	29.7	Very low	134 Å²	134	148.1 Å²	148.1	72%	0.717	73%	0.729	S	S	*	*			trans	68.8	87.4	158.6	-60.9	-20.6	0	0	0	122.2
337	R	30.4	Very low	30	Very low	206 Å²	206	147.3 Å²	147.3	78%	0.777	72%	0.72	S	S	*	*				68.7	135.5	123.1	-75.7	-178	174.6	-114.8	-0.3	123.3
338	E	32.8	Very low	30.3	Very low	144 Å²	144	145.8 Å²	145.8	67%	0.673	70%	0.704	S	S	*	*			trans	65.1	86.6	142.3	-67.6	172.1	-130.6	0	0	119.3
339	T	28.7	Very low	30.9	Very low	124 Å²	124	143.9 Å²	143.9	76%	0.761	70%	0.695	S	S	*	*				-173.1	152.6	127.8	15.7	0	0	0	0	111.9	E341	T339-E341 PolarHBondContact O-N 2.9Å
340	V	32.4	Very low	31.4	Very low	127 Å²	127	140 Å²	140	77%	0.77	67%	0.674	S	S	*	*			trans	-87	85.2	168.8	-178.1	0	0	0	0	109	Y342	V340-Y342 HydrophobicContact CG1-CE2 3.98Å
341	E	29.9	Very low	31.9	Very low	112 Å²	112	139.4 Å²	139.4	52%	0.523	68%	0.679	S	S	.	*			trans	-92.9	118	179.2	-63.2	-147.9	131.7	0	0	112.8	T339 Y343	T339-E341 PolarHBondContact O-N 2.9Å; E341-Y343 HydrophobicContact CB-CE1 4.18Å; E341-Y343 HydrophobicContact CB-CE2 3.94Å; E341-Y343 PolarHBondContact O-N 2.88Å; E341-Y343 VanDerWaalsContact OE2-CE1 3.31Å; E341-Y343 WeakPolarHBondContact OE2-CE1 3.31Å; E341-Y343 PolarHBondContact OE2-OH 3.21Å
342	Y	33	Very low	32.5	Very low	183 Å²	183	136.5 Å²	136.5	72%	0.718	67%	0.674	S	S	*	*			trans	-84.2	101.2	170.6	-70.4	-92.9	0	0	0	110.2	V340 W344	V340-Y342 HydrophobicContact CG1-CE2 3.98Å; Y342-W344 PolarHBondContact O-N 2.77Å; Y342-W344 PolarHBondContact O-NE1 2.87Å
343	Y	35.3	Very low	32.8	Very low	171 Å²	171	139.2 Å²	139.2	67%	0.671	69%	0.687	S	S	*	*			trans	-82	114	-179.8	-66.9	-66.9	0	0	0	113.6	E341 I345	E341-Y343 HydrophobicContact CB-CE1 4.18Å; E341-Y343 HydrophobicContact CB-CE2 3.94Å; E341-Y343 PolarHBondContact O-N 2.88Å; E341-Y343 VanDerWaalsContact OE2-CE1 3.31Å; E341-Y343 WeakPolarHBondContact OE2-CE1 3.31Å; E341-Y343 PolarHBondContact OE2-OH 3.21Å; Y343-I345 PolarHBondContact O-N 3.03Å
344	W	33	Very low	33.1	Very low	196 Å²	196	141.2 Å²	141.2	74%	0.742	69%	0.689	S	S	*	*			trans	-93.1	79.7	179.3	-52.7	92.4	0	0	0	112.4	Y342 K346 L387	Y342-W344 PolarHBondContact O-N 2.77Å; Y342-W344 PolarHBondContact O-NE1 2.87Å; W344-K346 PolarHBondContact O-N 3.23Å; W344-K346 VanDerWaalsContact O-N 3.11Å; W344-L387 HydrophobicContact CZ3-CD2 4.17Å
345	I	36.2	Very low	33.1	Very low	118 Å²	118	142.4 Å²	142.4	61%	0.605	69%	0.693	S	S	*	*			trans	-79	96.7	179.1	-50.2	-177.3	0	0	0	110.8	Y343 L347	Y343-I345 PolarHBondContact O-N 3.03Å; I345-L347 VanDerWaalsContact C-N 3.33Å; I345-L347 HydrophobicContact CG2-CD2 4.25Å; I345-L347 HydrophobicContact CG2-CG 4.06Å; I345-L347 PolarHBondContact O-N 2.85Å
346	K	30.3	Very low	33.2	Very low	167 Å²	167	142.2 Å²	142.2	73%	0.726	69%	0.692	S	S	*	*			trans	-77.6	77.2	175.2	-167.5	177.5	-177.2	177.8	0	111.7	W344 L348 T385	W344-K346 PolarHBondContact O-N 3.23Å; W344-K346 VanDerWaalsContact O-N 3.11Å; K346-L348 PolarHBondContact O-N 2.86Å; K346-T385 HydrophobicContact CD-CG2 4.47Å; K346-T385 HydrophobicContact CG-CG2 3.85Å
347	L	34	Very low	33.1	Very low	102 Å²	102	143.6 Å²	143.6	53%	0.534	70%	0.695	S	S	.	*			trans	-61.8	125.8	172.9	-73	171.5	0	0	0	111	I345 I388	I345-L347 VanDerWaalsContact C-N 3.33Å; I345-L347 HydrophobicContact CG2-CD2 4.25Å; I345-L347 HydrophobicContact CG2-CG 4.06Å; I345-L347 PolarHBondContact O-N 2.85Å; L347-I388 HydrophobicContact CD1-CD1 4.19Å
348	L	31.9	Very low	33.2	Very low	97 Å²	97	140 Å²	140	51%	0.508	70%	0.696	S	S	.	*			trans	-108.2	83.7	-179	-163.2	83	0	0	0	109.5	K346 T383 T385	K346-L348 PolarHBondContact O-N 2.86Å; L348-T383 HydrophobicContact CD1-CG2 3.9Å; L348-T383 HydrophobicContact CD2-CG2 4.01Å; L348-T383 HydrophobicContact CG-CG2 3.7Å; L348-T385 HydrophobicContact CD1-CG2 4.38Å
349	A	37.5	Very low	33.2	Very low	66 Å²	66	140.6 Å²	140.6	55%	0.545	70%	0.704	S	S	.	*			trans	-64.6	140.5	176.2	0	0	0	0	0	110.5	T383	A349-T383 VanDerWaalsContact O-CA 3.27Å; A349-T383 WeakPolarHBondContact O-CA 3.45Å
350	I	35.3	Very low	33.5	Very low	80 Å²	80	139.1 Å²	139.1	41%	0.41	70%	0.704	S	S	.	*			trans	-137.8	121.4	-180	-61.5	153.3	0	0	0	106.9	K381 T383	I350-K381 HydrophobicContact CD1-CD 3.74Å; I350-K381 HydrophobicContact CG1-CB 4.35Å; I350-K381 HydrophobicContact CG1-CD 3.97Å; I350-K381 HydrophobicContact CG2-CB 3.98Å; I350-K381 HydrophobicContact CG2-CD 3.85Å; I350-K381 HydrophobicContact CG2-CG 3.74Å; I350-T383 HydrophobicContact CG1-CG2 4.02Å
351	D	35.7	Very low	33.5	Very low	159 Å²	159	139.1 Å²	139.1	85%	0.85	71%	0.709	S	S	*	*			trans	-77.5	151.3	178.8	-153.7	-5.7	0	0	0	111.9
352	G	39.5	Very low	33.7	Very low	60 Å²	60	136.5 Å²	136.5	62%	0.619	71%	0.713	S	S	*	*			trans	-100.1	172.4	-148.9	0	0	0	0	0	117.7
353	I	34.3	Very low	33.6	Very low	174 Å²	174	133 Å²	133	89%	0.892	70%	0.699	S	S	*	*			trans	-124.3	150.4	162	-66.7	-178.5	0	0	0	108.1
354	K	33.5	Very low	33.4	Very low	198 Å²	198	129.1 Å²	129.1	86%	0.861	69%	0.687	S	S	*	*			trans	-68.3	165.6	-171.8	-70.3	177.7	176	176.5	0	114.2
355	Y	31.6	Very low	33.6	Very low	221 Å²	221	124.7 Å²	124.7	87%	0.867	68%	0.678	S	S	*	*			trans	-51.5	159.7	165.7	-81.2	-100.3	0	0	0	114.3
356	L	31.6	Very low	33.6	Very low	147 Å²	147	124 Å²	124	77%	0.77	68%	0.679	S	S	*	*			trans	94.7	103.6	165.5	-63.9	149.1	0	0	0	117.9
357	E	29.2	Very low	34.3	Very low	164 Å²	164	123 Å²	123	77%	0.766	68%	0.681	S	S	*	*			trans	61.2	113.9	133.7	-61.1	177.7	152.3	0	0	121.9
358	T	31.4	Very low	34.4	Very low	131 Å²	131	123.2 Å²	123.2	80%	0.804	68%	0.683	S	S	*	*			trans	69.8	107.8	148.8	53.8	0	0	0	0	122.1
359	D	32.9	Very low	34.6	Very low	156 Å²	156	128 Å²	128	83%	0.834	70%	0.7	S	S	*	*			trans	55.4	109	136.5	-57.9	-8	0	0	0	124.9
360	A	34.9	Very low	34.3	Very low	92 Å²	92	132.1 Å²	132.1	76%	0.76	71%	0.71	S	S	*	*			trans	84.4	115.9	130.2	0	0	0	0	0	125.3
361	S	32.7	Very low	34.3	Very low	127 Å²	127	133.5 Å²	133.5	89%	0.888	72%	0.724	S	S	*	*			trans	90	128	136.7	75.5	0	0	0	0	124.4
362	G	33.2	Very low	34.1	Very low	58 Å²	58	130.3 Å²	130.3	60%	0.598	71%	0.714	S	S	*	*			trans	99	144.2	147.7	0	0	0	0	0	121.1
363	Y	31.9	Very low	33.5	Very low	108 Å²	108	134.3 Å²	134.3	42%	0.424	72%	0.721	S	S	.	*			trans	-136.5	-158.3	171.3	1.7	111.3	0	0	0	111	F377 N379	Y363-F377 HydrophobicContact CD1-CB 4.04Å; Y363-F377 AromaticContact CD1-CD1 3.76Å; Y363-F377 HydrophobicContact CD1-CD1 3.76Å; Y363-F377 HydrophobicContact CD1-CE1 4.46Å; Y363-F377 AromaticContact CD1-CG 3.8Å; Y363-F377 HydrophobicContact CD1-CG 3.8Å; Y363-F377 HydrophobicContact CE1-CB 3.9Å; Y363-F377 HydrophobicContact CE1-CD1 4.27Å; Y363-F377 HydrophobicContact CE1-CG 4.19Å; Y363-F377 HydrophobicContact CG-CD1 4.2Å; Y363-F377 WeakPolarHBondContact O-CE1 3.38Å; Y363-F377 WeakPolarHBondContact O-CZ 3.16Å; Y363-N379 PolarHBondContact OH-N 2.88Å; Y363-N379 PolarHBondContact OH-ND2 2.92Å; Y363-N379 PolarHBondContact OH-OD1 3.12Å
364	Q	31.7	Very low	33.4	Very low	90 Å²	90	135 Å²	135	42%	0.421	72%	0.72	S	S	.	*			cis	-129	-138.4	10.7	-67.2	-178.1	161.8	0	0	110.5	F377	Q364-F377 HydrophobicContact CB-CE2 4.29Å; Q364-F377 HydrophobicContact CG-CD2 3.58Å; Q364-F377 HydrophobicContact CG-CE2 3.54Å; Q364-F377 HydrophobicContact CG-CG 4.16Å; Q364-F377 HydrophobicContact CG-CZ 4.13Å; Q364-F377 VanDerWaalsContact OE1-CA 3.26Å
365	D	36.1	Very low	33.4	Very low	104 Å²	104	130.9 Å²	130.9	56%	0.556	70%	0.704	S	S	*	*			cis	-159.8	-162.8	10.1	-144.5	-65.8	0	0	0	113.3	H375	D365-H375 IonicContact OD1-CE1 3.11Å; D365-H375 PolarHBondContact OD1-CE1 3.1Å; D365-H375 IonicContact OD1-ND1 2.6Å; D365-H375 PolarHBondContact OD1-ND1 2.87Å; D365-H375 IonicContact OD2-CE1 3Å; D365-H375 IonicContact OD2-ND1 3.4Å; D365-H375 PolarHBondContact OD2-ND1 3.26Å
366	V	37.1	Very low	33.3	Very low	102 Å²	102	125.6 Å²	125.6	62%	0.618	70%	0.7	S	S	*	*			trans	-107.8	157.9	-149.7	163	0	0	0	0	117.3
367	N	44.3	Very low	33.6	Very low	146 Å²	146	123.2 Å²	123.2	78%	0.781	68%	0.683	S	S	*	*			trans	-164.1	145.4	150.9	-94.4	-55	0	0	0	112.3
368	N	37.5	Very low	34	Very low	107 Å²	107	123.9 Å²	123.9	57%	0.572	69%	0.686	S	S	*	*			cis	-166	129.5	-27.5	-145.3	-35.8	0	0	0	113.9	M370	N368-M370 VanDerWaalsContact OD1-CG 3.31Å; N368-M370 WeakPolarHBondContact OD1-CG 3.31Å
369	K	35.4	Very low	34	Very low	199 Å²	199	124 Å²	124	87%	0.865	68%	0.682	S	S	*	*	S	Bend	trans	171.4	76.8	145.7	-103.1	-175.2	176.3	-177.7	0	108.5
370	M	30.6	Very low	34.2	Very low	151 Å²	151	122.5 Å²	122.5	74%	0.744	68%	0.679	S	S	*	*				80.8	140.2	83.2	-80.2	-165.7	96.6	0	0	113.7	N368	N368-M370 VanDerWaalsContact OD1-CG 3.31Å; N368-M370 WeakPolarHBondContact OD1-CG 3.31Å
371	P	35.5	Very low	34.4	Very low	109 Å²	109	124.5 Å²	124.5	71%	0.708	67%	0.67	S	S	*	*			cis	-132.3	179.8	-32	42.4	-26.8	0	0	0	110.5
372	S	31.1	Very low	34.7	Very low	93 Å²	93	126.4 Å²	126.4	65%	0.65	67%	0.665	S	S	*	*			cis	-159.3	137.9	19.9	48.2	0	0	0	0	112.1
373	N	27.7	Very low	35.4	Very low	143 Å²	143	127 Å²	127	77%	0.765	66%	0.657	S	S	*	*			trans	52.5	142.7	142.4	-50	6.6	0	0	0	119.5
374	E	32.8	Very low	36.2	Very low	188 Å²	188	124.2 Å²	124.2	88%	0.879	66%	0.661	S	S	*	*			cis	-131.3	170.3	18.4	-66.4	177.8	145.3	0	0	112.6
375	H	33.1	Very low	37.2	Very low	113 Å²	113	123.8 Å²	123.8	52%	0.523	67%	0.665	S	S	.	*			trans	-112.4	138.7	-167.4	-73.8	-140.1	0	0	0	114.2	D365	D365-H375 IonicContact OD1-CE1 3.11Å; D365-H375 PolarHBondContact OD1-CE1 3.1Å; D365-H375 IonicContact OD1-ND1 2.6Å; D365-H375 PolarHBondContact OD1-ND1 2.87Å; D365-H375 IonicContact OD2-CE1 3Å; D365-H375 IonicContact OD2-ND1 3.4Å; D365-H375 PolarHBondContact OD2-ND1 3.26Å
376	S	29.7	Very low	38.1	Very low	110 Å²	110	124.7 Å²	124.7	77%	0.769	67%	0.668	S	S	*	*			trans	-175.5	100.3	139.8	28.4	0	0	0	0	115.2
377	F	36.7	Very low	38.6	Very low	97 Å²	97	125.5 Å²	125.5	43%	0.425	67%	0.669	S	S	.	*			trans	42.2	101.3	142.6	-64.4	-144.3	0	0	0	118.7	Y363 Q364	Y363-F377 HydrophobicContact CD1-CB 4.04Å; Y363-F377 AromaticContact CD1-CD1 3.76Å; Y363-F377 HydrophobicContact CD1-CD1 3.76Å; Y363-F377 HydrophobicContact CD1-CE1 4.46Å; Y363-F377 AromaticContact CD1-CG 3.8Å; Y363-F377 HydrophobicContact CD1-CG 3.8Å; Y363-F377 HydrophobicContact CE1-CB 3.9Å; Y363-F377 HydrophobicContact CE1-CD1 4.27Å; Y363-F377 HydrophobicContact CE1-CG 4.19Å; Y363-F377 HydrophobicContact CG-CD1 4.2Å; Y363-F377 WeakPolarHBondContact O-CE1 3.38Å; Y363-F377 WeakPolarHBondContact O-CZ 3.16Å; Q364-F377 HydrophobicContact CB-CE2 4.29Å; Q364-F377 HydrophobicContact CG-CD2 3.58Å; Q364-F377 HydrophobicContact CG-CE2 3.54Å; Q364-F377 HydrophobicContact CG-CG 4.16Å; Q364-F377 HydrophobicContact CG-CZ 4.13Å; Q364-F377 VanDerWaalsContact OE1-CA 3.26Å
378	Q	37.7	Very low	39.1	Very low	177 Å²	177	123.6 Å²	123.6	83%	0.827	66%	0.657	S	S	*	*			trans	-154.3	155.9	152.1	-116.4	173	41.8	0	0	113.1	T380	Q378-T380 PolarHBondContact O-N 2.89Å
379	N	31.9	Very low	40	Very low	133 Å²	133	125 Å²	125	71%	0.711	66%	0.66	S	S	*	*			trans	-80	94.4	-173.3	-101.2	-33.7	0	0	0	112	Y363 K381	Y363-N379 PolarHBondContact OH-N 2.88Å; Y363-N379 PolarHBondContact OH-ND2 2.92Å; Y363-N379 PolarHBondContact OH-OD1 3.12Å; N379-K381 PolarHBondContact O-N 2.97Å
380	T	37.8	Very low	41.8	Very low	125 Å²	125	121.9 Å²	121.9	77%	0.767	65%	0.652	S	S	*	*			trans	-77.6	87.3	178.4	53.1	0	0	0	0	112	Q378 H382	Q378-T380 PolarHBondContact O-N 2.89Å; T380-H382 PolarHBondContact O-N 3.35Å
381	K	37.2	Very low	43.3	Very low	135 Å²	135	122.2 Å²	122.2	59%	0.587	65%	0.651	S	S	*	*			trans	-54.6	127.8	170.3	-67.9	170.8	165.8	-175.2	0	110.9	I350 N379 T383	I350-K381 HydrophobicContact CD1-CD 3.74Å; I350-K381 HydrophobicContact CG1-CB 4.35Å; I350-K381 HydrophobicContact CG1-CD 3.97Å; I350-K381 HydrophobicContact CG2-CB 3.98Å; I350-K381 HydrophobicContact CG2-CD 3.85Å; I350-K381 HydrophobicContact CG2-CG 3.74Å; N379-K381 PolarHBondContact O-N 2.97Å; K381-T383 HydrophobicContact CB-CG2 4.16Å; K381-T383 PolarHBondContact O-N 2.82Å
382	H	40.8	Very low	45.2	Very low	166 Å²	166	124.7 Å²	124.7	77%	0.769	66%	0.656	S	S	*	*			trans	-69.5	127.3	163.5	-71.3	172.2	0	0	0	109.1	T380	T380-H382 PolarHBondContact O-N 3.35Å
383	T	47.4	Very low	47.3	Very low	70 Å²	70	127 Å²	127	43%	0.429	66%	0.66	S	S	.	*			trans	-132.7	115.8	-178.6	62.8	0	0	0	0	112.5	L348 A349 I350 K381	L348-T383 HydrophobicContact CD1-CG2 3.9Å; L348-T383 HydrophobicContact CD2-CG2 4.01Å; L348-T383 HydrophobicContact CG-CG2 3.7Å; A349-T383 VanDerWaalsContact O-CA 3.27Å; A349-T383 WeakPolarHBondContact O-CA 3.45Å; I350-T383 HydrophobicContact CG1-CG2 4.02Å; K381-T383 HydrophobicContact CB-CG2 4.16Å; K381-T383 PolarHBondContact O-N 2.82Å
384	G	48.3	Very low	49.9	Very low	50 Å²	50	122.8 Å²	122.8	52%	0.515	64%	0.638	S	S	.	*			trans	-93.2	143.6	167.5	0	0	0	0	0	111.3
385	T	52.4	Low	52.3	Low	82 Å²	82	118 Å²	118	50%	0.503	62%	0.622	S	S	.	*			trans	-126	130.8	171.4	50.5	0	0	0	0	109.5	K346 L348	K346-T385 HydrophobicContact CD-CG2 4.47Å; K346-T385 HydrophobicContact CG-CG2 3.85Å; L348-T385 HydrophobicContact CD1-CG2 4.38Å
386	I	55.8	Low	54.7	Low	122 Å²	122	114 Å²	114	63%	0.626	60%	0.604	S	S	*	*			trans	-116.3	142.3	175.6	-172.9	167.1	0	0	0	109.5	I388	I386-I388 HydrophobicContact CG2-CG1 4.21Å
387	L	46.9	Very low	57.3	Low	120 Å²	120	114.1 Å²	114.1	63%	0.628	60%	0.596	S	S	*	*			trans	-81.6	122.5	168.7	-119.2	70.3	0	0	0	108.6	W344	W344-L387 HydrophobicContact CZ3-CD2 4.17Å
388	I	54.3	Low	59.5	Low	105 Å²	105	112.6 Å²	112.6	54%	0.538	59%	0.592	S	S	.	*			trans	-104.9	110.6	173.2	-56.6	179.3	0	0	0	107.5	L347 I386 I390	L347-I388 HydrophobicContact CD1-CD1 4.19Å; I386-I388 HydrophobicContact CG2-CG1 4.21Å; I388-I390 HydrophobicContact CG2-CG1 4.02Å; I388-I390 PolarHBondContact O-N 3.46Å
389	H	56.6	Low	62	Low	138 Å²	138	108.5 Å²	108.5	64%	0.639	58%	0.575	S	S	*	*			trans	-82.4	103.9	171	-76.7	-103.7	0	0	0	109.1	H391	H389-H391 PolarHBondContact O-N 2.98Å
390	I	72.9	Confident	64.8	Low	133 Å²	133	102.2 Å²	102.2	68%	0.682	54%	0.541	S	S	*	.			trans	-87.8	104.5	170.6	-56.9	178.9	0	0	0	107.4	I388	I388-I390 HydrophobicContact CG2-CG1 4.02Å; I388-I390 PolarHBondContact O-N 3.46Å
391	H	63.7	Low	67.4	Low	158 Å²	158	100.8 Å²	100.8	73%	0.731	53%	0.528	S	S	*	.			trans	-81.8	113.6	165.6	-77.5	-97.1	0	0	0	108.5	H389	H389-H391 PolarHBondContact O-N 2.98Å
392	I	75	Confident	70	Confident	160 Å²	160	95.5 Å²	95.5	82%	0.821	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-72.6	130.6	162.6	-58.1	177.8	0	0	0	106.4
393	I	75.2	Confident	72.4	Confident	142 Å²	142	90.2 Å²	90.2	73%	0.728	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-99.9	134.2	176.8	-56.8	176.2	0	0	0	107
394	D	81.8	Confident	74.3	Confident	55 Å²	55	97.3 Å²	97.3	29%	0.294	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-61.7	142.4	175.8	-167.7	77.9	0	0	0	111.7	L430 N433	D394-L430 HydrophobicContact CB-CB 4.04Å; D394-L430 HydrophobicContact CB-CD1 4.49Å; D394-L430 WeakPolarHBondContact OD1-CB 3.38Å; D394-L430 WeakPolarHBondContact OD1-CG 3.1Å; D394-L430 PolarHBondContact OD1-N 3.35Å; D394-L430 PolarHBondContact OD2-N 2.81Å; D394-N433 PolarHBondContact OD2-ND2 3.3Å
395	T	82.5	Confident	76.3	Confident	88 Å²	88	98.8 Å²	98.8	54%	0.54	51%	0.505	S	S	.	.			trans	-133.6	135.7	178.5	49.3	0	0	0	0	108.9	D397	T395-D397 VanDerWaalsContact C-N 3.28Å; T395-D397 PolarHBondContact O-N 3.21Å
396	N	84.5	Confident	78.1	Confident	28 Å²	28	97 Å²	97	15%	0.15	49%	0.493	C	S	.	.	S	Bend	trans	-66.1	84	179.1	-153.7	98.1	0	0	0	110.2	D429 N433 D487 G489 H494	N396-D429 VanDerWaalsContact CA-OD2 3.26Å; N396-D429 WeakPolarHBondContact CA-OD2 3.28Å; N396-N433 HydrophobicContact CB-CB 4.11Å; N396-N433 PolarHBondContact N-ND2 3.16Å; N396-N433 WeakPolarHBondContact OD1-CA 3.08Å; N396-N433 WeakPolarHBondContact OD1-CB 3.03Å; N396-N433 PolarHBondContact OD1-OD1 3.01Å; N396-D487 PolarHBondContact ND2-OD2 2.61Å; N396-D487 PolarHBondContact OD1-OD2 3.5Å; N396-G489 WeakPolarHBondContact OD1-CA 3.39Å; N396-H494 PolarHBondContact ND2-CD2 3.28Å
397	D	83.4	Confident	79.8	Confident	113 Å²	113	96.8 Å²	96.8	60%	0.604	49%	0.493	S	S	*	.			trans	-126.1	-8.8	-173.1	93.3	-10.8	0	0	0	113.8	T395 D429	T395-D397 VanDerWaalsContact C-N 3.28Å; T395-D397 PolarHBondContact O-N 3.21Å; D397-D429 PolarHBondContact N-OD2 3.04Å
398	N	83.8	Confident	82	Confident	64 Å²	64	92.6 Å²	92.6	34%	0.342	47%	0.471	S	S	.	.	S	Bend	trans	-95.4	179.5	164	-66.5	-84.4	0	0	0	110.9	P428 D429 H494	N398-P428 HydrophobicContact CB-CB 4.09Å; N398-P428 HydrophobicContact CB-CG 3.86Å; N398-D429 WeakPolarHBondContact CB-OD1 3.34Å; N398-D429 PolarHBondContact N-OD2 3.36Å; N398-D429 VanDerWaalsContact N-OD2 3.1Å; N398-D429 PolarHBondContact ND2-OD1 2.54Å; N398-H494 PolarHBondContact O-CD2 2.82Å
399	I	89.1	Confident	83.7	Confident	91 Å²	91	92.7 Å²	92.7	47%	0.467	47%	0.472	S	S	.	.			trans	-134.2	150.8	178	76	177.7	0	0	0	109.4	I401 H494	I399-I401 PolarHBondContact O-N 2.99Å; I399-I401 VanDerWaalsContact O-N 3.17Å; I399-H494 HydrophobicContact CB-CB 4Å; I399-H494 HydrophobicContact CG2-CB 3.71Å
400	P	92.5	Very high	85.4	Confident	1 Å²	1	86.9 Å²	86.9	1%	0.006	45%	0.446	C	S	.	.			trans	-54.5	121.6	-179.9	-33.7	38.2	0	0	0	112.9	D427 L436 T485 D487 S496	P400-D427 VanDerWaalsContact CA-OD2 3.25Å; P400-D427 WeakPolarHBondContact CA-OD2 3.44Å; P400-D427 WeakPolarHBondContact CD-OD2 3.29Å; P400-D427 WeakPolarHBondContact CG-OD2 3.17Å; P400-L436 HydrophobicContact CB-CD2 3.6Å; P400-L436 HydrophobicContact CG-CD2 3.62Å; P400-T485 HydrophobicContact CB-CG2 4.02Å; P400-D487 HydrophobicContact CG-CB 4.42Å; P400-S496 WeakPolarHBondContact O-CB 3.31Å; P400-S496 PolarHBondContact O-OG 2.81Å
401	I	92	Very high	86.3	Confident	96 Å²	96	82.5 Å²	82.5	49%	0.492	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-91.5	117.3	179.6	-52	178.7	0	0	0	108.9	I399 G425 T426 P428	I399-I401 PolarHBondContact O-N 2.99Å; I399-I401 VanDerWaalsContact O-N 3.17Å; I401-G425 CarbonylContact O-C 3.59Å; I401-G425 VanDerWaalsContact O-CA 3.26Å; I401-G425 WeakPolarHBondContact O-CA 3.24Å; I401-T426 WeakPolarHBondContact CA-O 3.32Å; I401-T426 VanDerWaalsContact CB-O 3.29Å; I401-T426 WeakPolarHBondContact CB-O 3.46Å; I401-T426 PolarHBondContact N-O 2.64Å; I401-T426 PolarHBondContact O-N 2.78Å; I401-P428 HydrophobicContact CD1-CG 4.18Å
402	V	92.1	Very high	87.5	Confident	23 Å²	23	75.5 Å²	75.5	14%	0.139	40%	0.395	C	S	.	.			trans	-134.7	156	-179.7	-57.5	0	0	0	0	111.3	I423 T485 S496 T498	V402-I423 HydrophobicContact CB-CG2 4.45Å; V402-I423 HydrophobicContact CG1-CG2 4.4Å; V402-T485 HydrophobicContact CG1-CG2 3.96Å; V402-S496 VanDerWaalsContact CG2-OG 3.28Å; V402-S496 WeakPolarHBondContact CG2-OG 3.36Å; V402-T498 WeakPolarHBondContact CG2-OG1 3.45Å
403	P	90.1	Very high	88.2	Confident	55 Å²	55	73 Å²	73	36%	0.357	38%	0.383	S	S	.	.			trans	-60.6	137.1	172	24.8	-34.5	0	0	0	111.2	T405 T498	P403-T405 PolarHBondContact O-N 2.92Å; P403-T498 HydrophobicContact CG-CG2 4.36Å; P403-T498 WeakPolarHBondContact O-CA 3.38Å; P403-T498 VanDerWaalsContact O-CB 3.25Å; P403-T498 WeakPolarHBondContact O-CB 3.22Å; P403-T498 VanDerWaalsContact O-CG2 3.3Å; P403-T498 WeakPolarHBondContact O-CG2 3.41Å; P403-T498 PolarHBondContact O-OG1 3.26Å
404	R	88.3	Confident	89	Confident	220 Å²	220	67 Å²	67	83%	0.83	36%	0.355	S	S	*	.	S	Bend	trans	-65.8	-39.4	-178.1	-70.1	-176.4	177.3	179.4	-0.8	113.4	V499	R404-V499 PolarHBondContact O-N 3.07Å
405	T	90.3	Very high	89.5	Confident	80 Å²	80	72.4 Å²	72.4	49%	0.491	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	142.1	-178.4	-46.5	0	0	0	0	109.9	P403 N407 V499	P403-T405 PolarHBondContact O-N 2.92Å; T405-N407 WeakPolarHBondContact CG2-OD1 3.27Å; T405-V499 CarbonylContact C-O 3.57Å; T405-V499 WeakPolarHBondContact CA-O 3.25Å; T405-V499 HydrophobicContact CG2-CB 4.3Å; T405-V499 HydrophobicContact CG2-CG1 4.5Å
406	L	90.5	Very high	89.9	Confident	46 Å²	46	72.3 Å²	72.3	24%	0.241	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	104.8	177.3	-178.9	63.8	0	0	0	109.1	L408 A421 T498 V499 V500 D501	L406-L408 HydrophobicContact CD1-CD2 4.07Å; L406-L408 HydrophobicContact CD2-CD1 4.01Å; L406-L408 HydrophobicContact CD2-CD2 4.38Å; L406-L408 HydrophobicContact CD2-CG 4.42Å; L406-L408 HydrophobicContact CG-CD1 4.07Å; L406-L408 HydrophobicContact CG-CD2 3.97Å; L406-L408 HydrophobicContact CG-CG 3.96Å; L406-A421 HydrophobicContact CD2-CB 3.93Å; L406-T498 HydrophobicContact CB-CG2 4.05Å; L406-V499 PolarHBondContact N-O 2.99Å; L406-V500 WeakPolarHBondContact O-CA 3.3Å; L406-D501 PolarHBondContact O-N 3.11Å
407	N	91.5	Very high	90.2	Very high	117 Å²	117	73.4 Å²	73.4	63%	0.626	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	133.4	176.8	-60.5	3.7	0	0	0	109.2	T405 D501	T405-N407 WeakPolarHBondContact CG2-OD1 3.27Å; N407-D501 CarbonylContact C-O 3.59Å; N407-D501 WeakPolarHBondContact CA-O 3.33Å
408	L	91.9	Very high	90.7	Very high	32 Å²	32	70.5 Å²	70.5	17%	0.168	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	146.2	-174.5	-57.8	170.1	0	0	0	110.1	L406 L420 A421 V500 D501 V502 R503	L406-L408 HydrophobicContact CD1-CD2 4.07Å; L406-L408 HydrophobicContact CD2-CD1 4.01Å; L406-L408 HydrophobicContact CD2-CD2 4.38Å; L406-L408 HydrophobicContact CD2-CG 4.42Å; L406-L408 HydrophobicContact CG-CD1 4.07Å; L406-L408 HydrophobicContact CG-CD2 3.97Å; L406-L408 HydrophobicContact CG-CG 3.96Å; L408-L420 HydrophobicContact CB-CD1 3.95Å; L408-L420 HydrophobicContact CD1-CD1 3.93Å; L408-L420 HydrophobicContact CD1-CD2 4.29Å; L408-L420 HydrophobicContact CD1-CG 3.78Å; L408-A421 HydrophobicContact CD1-CB 3.58Å; L408-A421 HydrophobicContact CD2-CB 4.22Å; L408-V500 HydrophobicContact CD1-CG1 3.83Å; L408-D501 PolarHBondContact N-O 3.48Å; L408-V502 CarbonylContact O-C 3.56Å; L408-V502 WeakPolarHBondContact O-CA 3.09Å; L408-R503 PolarHBondContact O-N 2.82Å
409	D	90.7	Very high	91.2	Very high	107 Å²	107	72.6 Å²	72.6	57%	0.572	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.8	173.2	-65.4	-28.9	0	0	0	109	R503	D409-R503 VanDerWaalsContact OD1-CB 3.3Å; D409-R503 WeakPolarHBondContact OD1-CB 3.27Å; D409-R503 WeakPolarHBondContact OD1-CD 3.28Å
410	I	92.5	Very high	91.3	Very high	15 Å²	15	69.3 Å²	69.3	8%	0.077	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	141.5	173.9	-168.4	163	0	0	0	110.8	A414 T418 L420 V463 L467 V502 R503 I504 N505	I410-A414 HydrophobicContact CD1-CB 3.76Å; I410-A414 HydrophobicContact CG1-CB 3.67Å; I410-T418 HydrophobicContact CD1-CG2 4.31Å; I410-L420 HydrophobicContact CB-CD1 4.1Å; I410-L420 HydrophobicContact CD1-CD1 4.09Å; I410-L420 HydrophobicContact CG2-CD1 4.45Å; I410-V463 HydrophobicContact CD1-CG2 3.52Å; I410-L467 HydrophobicContact CD1-CD1 4.25Å; I410-L467 HydrophobicContact CG1-CD1 4.23Å; I410-L467 HydrophobicContact CG2-CD1 3.68Å; I410-V502 HydrophobicContact CG2-CG1 3.64Å; I410-R503 PolarHBondContact N-O 3.38Å; I410-I504 CarbonylContact O-C 3.56Å; I410-I504 WeakPolarHBondContact O-CA 3.17Å; I410-N505 PolarHBondContact O-N 3.36Å
411	S	90.1	Very high	91.3	Very high	42 Å²	42	70 Å²	70	29%	0.294	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	146.3	174.1	-165.3	0	0	0	0	110.6	D413 A414 V507	S411-D413 WeakPolarHBondContact CB-OD1 3.23Å; S411-D413 PolarHBondContact O-N 2.86Å; S411-D413 PolarHBondContact OG-OD1 3.29Å; S411-A414 WeakPolarHBondContact O-CB 3.33Å; S411-A414 PolarHBondContact O-N 2.79Å; S411-V507 WeakPolarHBondContact OG-CG2 3.43Å
412	E	89.9	Confident	91.3	Very high	11 Å²	11	71.6 Å²	71.6	5%	0.051	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-27.9	-178.3	68.5	-161.5	103.9	0	0	114.5	A414 L467 A469 I504 N505 D506 V507	E412-A414 PolarHBondContact O-N 2.86Å; E412-L467 HydrophobicContact CB-CB 3.97Å; E412-A469 HydrophobicContact CB-CB 4.43Å; E412-A469 VanDerWaalsContact CD-CB 3.47Å; E412-A469 VanDerWaalsContact OE1-CB 3.26Å; E412-A469 WeakPolarHBondContact OE1-CB 3.42Å; E412-A469 WeakPolarHBondContact OE2-CA 3.41Å; E412-A469 WeakPolarHBondContact OE2-CB 3.45Å; E412-A469 PolarHBondContact OE2-N 2.88Å; E412-I504 HydrophobicContact CB-CG2 3.7Å; E412-N505 PolarHBondContact N-O 3.45Å; E412-D506 VanDerWaalsContact OE1-CA 3.29Å; E412-D506 WeakPolarHBondContact OE1-CA 3.18Å; E412-V507 HydrophobicContact CG-CB 3.89Å; E412-V507 HydrophobicContact CG-CG2 3.88Å; E412-V507 PolarHBondContact OE1-N 3.35Å
413	D	89.9	Confident	91.2	Very high	108 Å²	108	70.5 Å²	70.5	58%	0.578	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-0.3	170.4	80.7	-46.1	0	0	0	113.9	S411 K415 V507	S411-D413 WeakPolarHBondContact CB-OD1 3.23Å; S411-D413 PolarHBondContact O-N 2.86Å; S411-D413 PolarHBondContact OG-OD1 3.29Å; D413-K415 PolarHBondContact O-N 3.1Å; D413-K415 VanDerWaalsContact O-N 3.07Å; D413-V507 HydrophobicContact CB-CG2 4.31Å
414	A	91.6	Very high	91	Very high	16 Å²	16	73.9 Å²	73.9	13%	0.132	39%	0.387	C	S	.	.			trans	-59.8	111.9	177.6	0	0	0	0	0	112.1	I410 S411 E412 T418	I410-A414 HydrophobicContact CD1-CB 3.76Å; I410-A414 HydrophobicContact CG1-CB 3.67Å; S411-A414 WeakPolarHBondContact O-CB 3.33Å; S411-A414 PolarHBondContact O-N 2.79Å; E412-A414 PolarHBondContact O-N 2.86Å; A414-T418 HydrophobicContact CB-CG2 4.47Å
415	K	92.3	Very high	90.9	Very high	168 Å²	168	64.1 Å²	64.1	73%	0.73	36%	0.355	S	S	*	.			trans	-57	143.5	-176.6	-63.5	176.3	-177	175.1	0	112.2	D413 G417 T418	D413-K415 PolarHBondContact O-N 3.1Å; D413-K415 VanDerWaalsContact O-N 3.07Å; K415-G417 PolarHBondContact O-N 2.85Å; K415-T418 VanDerWaalsContact O-CB 3.25Å; K415-T418 WeakPolarHBondContact O-CB 3.04Å; K415-T418 PolarHBondContact O-N 3.43Å; K415-T418 PolarHBondContact O-OG1 2.85Å
416	V	91.6	Very high	90.9	Very high	85 Å²	85	64.6 Å²	64.6	52%	0.515	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	132.8	170.7	-178.9	0	0	0	0	110	P466	V416-P466 HydrophobicContact CG2-CG 4.21Å
417	G	90.2	Very high	90.9	Very high	51 Å²	51	63.5 Å²	63.5	53%	0.526	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	-9.3	-171.2	0	0	0	0	0	115.1	K415 L419 V463	K415-G417 PolarHBondContact O-N 2.85Å; G417-L419 PolarHBondContact O-N 3.38Å; G417-V463 PolarHBondContact N-O 2.82Å
418	T	94.3	Very high	90.7	Very high	52 Å²	52	61.2 Å²	61.2	32%	0.319	34%	0.344	S	S	.	.			trans	-58	128.1	175.8	-63.1	0	0	0	0	111	I410 A414 K415 L420 T462 V463	I410-T418 HydrophobicContact CD1-CG2 4.31Å; A414-T418 HydrophobicContact CB-CG2 4.47Å; K415-T418 VanDerWaalsContact O-CB 3.25Å; K415-T418 WeakPolarHBondContact O-CB 3.04Å; K415-T418 PolarHBondContact O-N 3.43Å; K415-T418 PolarHBondContact O-OG1 2.85Å; T418-L420 PolarHBondContact O-N 3.12Å; T418-T462 CarbonylContact O-C 3.11Å; T418-T462 VanDerWaalsContact O-CA 3.23Å; T418-T462 WeakPolarHBondContact O-CA 3.36Å; T418-V463 PolarHBondContact O-N 2.82Å
419	L	93.9	Very high	90.6	Very high	108 Å²	108	60.3 Å²	60.3	57%	0.565	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	113.9	175.1	-179.6	70.1	0	0	0	109.5	G417 A421 T462	G417-L419 PolarHBondContact O-N 3.38Å; L419-A421 WeakPolarHBondContact CD1-O 3.07Å; L419-T462 HydrophobicContact CD1-CG2 4.06Å
420	L	91.2	Very high	90.2	Very high	23 Å²	23	60.8 Å²	60.8	12%	0.12	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-45.7	-179.6	170.5	62.2	0	0	0	111.2	L408 I410 T418 F452 I461 V502	L408-L420 HydrophobicContact CB-CD1 3.95Å; L408-L420 HydrophobicContact CD1-CD1 3.93Å; L408-L420 HydrophobicContact CD1-CD2 4.29Å; L408-L420 HydrophobicContact CD1-CG 3.78Å; I410-L420 HydrophobicContact CB-CD1 4.1Å; I410-L420 HydrophobicContact CD1-CD1 4.09Å; I410-L420 HydrophobicContact CG2-CD1 4.45Å; T418-L420 PolarHBondContact O-N 3.12Å; L420-F452 HydrophobicContact CD2-CD1 3.8Å; L420-F452 HydrophobicContact CD2-CE1 3.7Å; L420-F452 HydrophobicContact CD2-CE2 4.46Å; L420-F452 HydrophobicContact CD2-CG 4.25Å; L420-F452 HydrophobicContact CD2-CZ 4.06Å; L420-I461 HydrophobicContact CB-CG2 4.45Å; L420-I461 HydrophobicContact CD2-CG2 4.04Å; L420-I461 PolarHBondContact N-O 2.94Å; L420-V502 HydrophobicContact CD1-CG1 4.13Å; L420-V502 HydrophobicContact CD2-CG1 4.02Å; L420-V502 HydrophobicContact CD2-CG2 3.76Å
421	A	91.3	Very high	89.8	Confident	16 Å²	16	63.2 Å²	63.2	13%	0.132	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	175.9	175.1	0	0	0	0	0	112.1	L406 L408 L419 S460 I461	L406-A421 HydrophobicContact CD2-CB 3.93Å; L408-A421 HydrophobicContact CD1-CB 3.58Å; L408-A421 HydrophobicContact CD2-CB 4.22Å; L419-A421 WeakPolarHBondContact CD1-O 3.07Å; A421-S460 CarbonylContact O-C 3.47Å; A421-S460 WeakPolarHBondContact O-CA 3.5Å; A421-I461 PolarHBondContact N-O 3.37Å; A421-I461 PolarHBondContact O-N 2.87Å
422	R	92.5	Very high	89.5	Confident	128 Å²	128	65.5 Å²	65.5	48%	0.483	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.9	160.2	175.9	171.7	-71.5	-168.5	-4.3	109.7	N424 T458 G459 S460	R422-N424 PolarHBondContact O-N 3.26Å; R422-T458 WeakPolarHBondContact CD-O 3.45Å; R422-T458 VanDerWaalsContact CG-O 3.24Å; R422-T458 WeakPolarHBondContact CG-O 3.34Å; R422-T458 PolarHBondContact NE-O 3.42Å; R422-T458 VanDerWaalsContact NE-O 3.16Å; R422-T458 PolarHBondContact NH2-OG1 3.14Å; R422-G459 WeakPolarHBondContact CA-O 3.24Å; R422-S460 PolarHBondContact NE-OG 2.82Å; R422-S460 PolarHBondContact NH2-OG 3.32Å
423	I	90.4	Very high	89.2	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.005	38%	0.384	C	S	.	.			trans	-80.7	111.4	169.8	-56.8	-170.1	0	0	0	108.3	V402 G425 Y438 I454 G459 I461 V483 T498 V500	V402-I423 HydrophobicContact CB-CG2 4.45Å; V402-I423 HydrophobicContact CG1-CG2 4.4Å; I423-G425 PolarHBondContact O-N 2.68Å; I423-Y438 HydrophobicContact CB-CD1 4.28Å; I423-Y438 HydrophobicContact CB-CE1 4.02Å; I423-Y438 HydrophobicContact CG2-CD1 4.32Å; I423-Y438 HydrophobicContact CG2-CE1 3.83Å; I423-Y438 PolarHBondContact O-OH 2.91Å; I423-I454 HydrophobicContact CD1-CD1 4.46Å; I423-G459 PolarHBondContact N-O 3.38Å; I423-I461 HydrophobicContact CD1-CD1 4.27Å; I423-I461 HydrophobicContact CG1-CD1 4.25Å; I423-V483 HydrophobicContact CD1-CB 3.58Å; I423-V483 HydrophobicContact CD1-CG1 3.71Å; I423-V483 HydrophobicContact CD1-CG2 3.78Å; I423-T498 HydrophobicContact CD1-CG2 4.2Å; I423-V500 HydrophobicContact CD1-CG2 4.35Å
424	N	85.1	Confident	88.9	Confident	125 Å²	125	62.2 Å²	62.2	67%	0.668	37%	0.367	S	S	*	.			trans	-87.1	87.6	172.2	-66	-19	0	0	0	108.6	R422	R422-N424 PolarHBondContact O-N 3.26Å
425	G	87	Confident	88.7	Confident	15 Å²	15	66.2 Å²	66.2	16%	0.155	38%	0.381	C	S	.	.			trans	-85.8	155.2	166.7	0	0	0	0	0	112.2	I401 I423 L436 Y438	I401-G425 CarbonylContact O-C 3.59Å; I401-G425 VanDerWaalsContact O-CA 3.26Å; I401-G425 WeakPolarHBondContact O-CA 3.24Å; I423-G425 PolarHBondContact O-N 2.68Å; G425-L436 WeakPolarHBondContact O-CD1 3.44Å; G425-Y438 WeakPolarHBondContact CA-OH 3.08Å; G425-Y438 PolarHBondContact N-OH 2.67Å
426	T	90.3	Very high	88.7	Confident	91 Å²	91	59.3 Å²	59.3	56%	0.558	35%	0.352	S	S	*	.	B	Isolated β-bridge	trans	-139.8	137.7	169.8	55.5	0	0	0	0	110.2	I401	I401-T426 WeakPolarHBondContact CA-O 3.32Å; I401-T426 VanDerWaalsContact CB-O 3.29Å; I401-T426 WeakPolarHBondContact CB-O 3.46Å; I401-T426 PolarHBondContact N-O 2.64Å; I401-T426 PolarHBondContact O-N 2.78Å
427	D	90.5	Very high	88.6	Confident	22 Å²	22	58 Å²	58	12%	0.118	34%	0.34	C	S	.	.			trans	-111.2	138.9	167.6	-154.3	-68.8	0	0	0	110.1	P400 D429 L436	P400-D427 VanDerWaalsContact CA-OD2 3.25Å; P400-D427 WeakPolarHBondContact CA-OD2 3.44Å; P400-D427 WeakPolarHBondContact CD-OD2 3.29Å; P400-D427 WeakPolarHBondContact CG-OD2 3.17Å; D427-D429 PolarHBondContact OD1-N 3.14Å; D427-L436 HydrophobicContact CB-CD2 3.91Å
428	P	88	Confident	88.8	Confident	70 Å²	70	56.2 Å²	56.2	46%	0.455	32%	0.317	S	S	.	.	S	Bend	trans	-69.2	-22.7	172.9	-22	34.5	0	0	0	116.2	N398 I401	N398-P428 HydrophobicContact CB-CB 4.09Å; N398-P428 HydrophobicContact CB-CG 3.86Å; I401-P428 HydrophobicContact CD1-CG 4.18Å
429	D	89.2	Confident	88.5	Confident	12 Å²	12	58.9 Å²	58.9	6%	0.064	33%	0.326	C	S	.	.	S	Bend	trans	-74.3	177.8	-171.4	-68.5	-10.7	0	0	0	112.6	N396 D397 N398 D427 N433 G434	N396-D429 VanDerWaalsContact CA-OD2 3.26Å; N396-D429 WeakPolarHBondContact CA-OD2 3.28Å; D397-D429 PolarHBondContact N-OD2 3.04Å; N398-D429 WeakPolarHBondContact CB-OD1 3.34Å; N398-D429 PolarHBondContact N-OD2 3.36Å; N398-D429 VanDerWaalsContact N-OD2 3.1Å; N398-D429 PolarHBondContact ND2-OD1 2.54Å; D427-D429 PolarHBondContact OD1-N 3.14Å; D429-N433 HydrophobicContact CB-CB 3.62Å; D429-G434 VanDerWaalsContact C-CA 3.42Å; D429-G434 WeakPolarHBondContact O-CA 3.46Å
430	L	82.7	Confident	88.2	Confident	118 Å²	118	54.8 Å²	54.8	62%	0.618	31%	0.305	S	S	*	.			trans	-114.1	154.9	-174.6	-59.4	175.3	0	0	0	114	D394 D432 N433 G434	D394-L430 HydrophobicContact CB-CB 4.04Å; D394-L430 HydrophobicContact CB-CD1 4.49Å; D394-L430 WeakPolarHBondContact OD1-CB 3.38Å; D394-L430 WeakPolarHBondContact OD1-CG 3.1Å; D394-L430 PolarHBondContact OD1-N 3.35Å; D394-L430 PolarHBondContact OD2-N 2.81Å; L430-D432 PolarHBondContact O-N 2.95Å; L430-N433 WeakPolarHBondContact O-CB 3.26Å; L430-N433 PolarHBondContact O-N 3Å; L430-N433 VanDerWaalsContact O-N 3.17Å; L430-G434 PolarHBondContact O-N 2.85Å
431	G	83.4	Confident	87.7	Confident	66 Å²	66	57 Å²	57	68%	0.68	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	-127.6	175.9	0	0	0	0	0	112.7	K435	G431-K435 WeakPolarHBondContact O-CB 3.33Å
432	D	84	Confident	86.4	Confident	90 Å²	90	64.7 Å²	64.7	48%	0.481	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-19.6	175.4	-78.4	-45.3	0	0	0	112.7	L430 K435 F488	L430-D432 PolarHBondContact O-N 2.95Å; D432-K435 VanDerWaalsContact OD1-CD 3.26Å; D432-K435 WeakPolarHBondContact OD1-CD 3.24Å; D432-K435 IonicContact OD1-NZ 3.59Å; D432-K435 PolarHBondContact OD1-NZ 3.19Å; D432-F488 HydrophobicContact CB-CB 4.02Å; D432-F488 CarbonylContact O-C 3.37Å; D432-F488 WeakPolarHBondContact O-CA 3.47Å; D432-F488 WeakPolarHBondContact O-CB 3.44Å; D432-F488 PolarHBondContact O-N 3.06Å; D432-F488 VanDerWaalsContact O-N 3.11Å
433	N	82.7	Confident	84.4	Confident	29 Å²	29	61.1 Å²	61.1	16%	0.155	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-47.6	171.9	-57.3	-20	0	0	0	109.6	D394 N396 D429 L430 K435 D487	D394-N433 PolarHBondContact OD2-ND2 3.3Å; N396-N433 HydrophobicContact CB-CB 4.11Å; N396-N433 PolarHBondContact N-ND2 3.16Å; N396-N433 WeakPolarHBondContact OD1-CA 3.08Å; N396-N433 WeakPolarHBondContact OD1-CB 3.03Å; N396-N433 PolarHBondContact OD1-OD1 3.01Å; D429-N433 HydrophobicContact CB-CB 3.62Å; L430-N433 WeakPolarHBondContact O-CB 3.26Å; L430-N433 PolarHBondContact O-N 3Å; L430-N433 VanDerWaalsContact O-N 3.17Å; N433-K435 PolarHBondContact O-N 2.92Å; N433-D487 WeakPolarHBondContact O-CB 3.5Å
434	G	83.8	Confident	82.5	Confident	21 Å²	21	69.6 Å²	69.6	22%	0.216	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	2.5	177.1	0	0	0	0	0	116.9	D429 L430	D429-G434 VanDerWaalsContact C-CA 3.42Å; D429-G434 WeakPolarHBondContact O-CA 3.46Å; L430-G434 PolarHBondContact O-N 2.85Å
435	K	88.8	Confident	80.8	Confident	99 Å²	99	67 Å²	67	43%	0.43	37%	0.37	S	S	.	.			trans	-110.7	124.1	-163.6	178.8	-172.8	165.8	-170.6	0	111.2	G431 D432 N433 D487 F488	G431-K435 WeakPolarHBondContact O-CB 3.33Å; D432-K435 VanDerWaalsContact OD1-CD 3.26Å; D432-K435 WeakPolarHBondContact OD1-CD 3.24Å; D432-K435 IonicContact OD1-NZ 3.59Å; D432-K435 PolarHBondContact OD1-NZ 3.19Å; N433-K435 PolarHBondContact O-N 2.92Å; K435-D487 CarbonylContact O-C 3.54Å; K435-D487 VanDerWaalsContact O-CA 3.26Å; K435-D487 WeakPolarHBondContact O-CA 3.39Å; K435-F488 HydrophobicContact CB-CD2 4.07Å; K435-F488 HydrophobicContact CD-CD2 3.7Å; K435-F488 HydrophobicContact CD-CE2 4.03Å; K435-F488 HydrophobicContact CG-CD2 3.67Å; K435-F488 HydrophobicContact CG-CE2 3.91Å; K435-F488 VanDerWaalsContact O-CD2 3.27Å; K435-F488 WeakPolarHBondContact O-CD2 3.38Å; K435-F488 PolarHBondContact O-N 2.89Å
436	L	91.2	Very high	79.1	Confident	24 Å²	24	70.1 Å²	70.1	13%	0.126	40%	0.401	C	S	.	.			trans	-91.1	148.2	-170.5	-60.3	-175.8	0	0	0	114.4	P400 G425 D427 Y438 T485 S486	P400-L436 HydrophobicContact CB-CD2 3.6Å; P400-L436 HydrophobicContact CG-CD2 3.62Å; G425-L436 WeakPolarHBondContact O-CD1 3.44Å; D427-L436 HydrophobicContact CB-CD2 3.91Å; L436-Y438 HydrophobicContact CB-CE2 4.08Å; L436-Y438 WeakPolarHBondContact CD1-OH 3.31Å; L436-T485 HydrophobicContact CB-CG2 4.1Å; L436-T485 HydrophobicContact CD1-CG2 4Å; L436-T485 HydrophobicContact CD2-CG2 4.02Å; L436-T485 HydrophobicContact CG-CG2 4.27Å; L436-S486 CarbonylContact C-O 3.58Å; L436-S486 WeakPolarHBondContact CA-O 3.31Å
437	H	90.8	Very high	77.6	Confident	57 Å²	57	69.1 Å²	69.1	26%	0.264	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	125.3	172	-178	-104.7	0	0	0	110	S456 T485 S486 F488	H437-S456 WeakPolarHBondContact CA-O 3.23Å; H437-S456 WeakPolarHBondContact NE2-CB 3.42Å; H437-T485 WeakPolarHBondContact O-CA 3.41Å; H437-S486 PolarHBondContact N-O 3.13Å; H437-S486 PolarHBondContact O-N 2.75Å; H437-F488 HydrophobicContact CB-CE1 4.33Å; H437-F488 HydrophobicContact CB-CE2 3.8Å; H437-F488 HydrophobicContact CB-CZ 3.69Å; H437-F488 AromaticContact CD2-CZ 3.87Å; H437-F488 AromaticContact CG-CZ 4Å
438	Y	92.7	Very high	75.9	Confident	13 Å²	13	72 Å²	72	5%	0.051	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	136.7	-175.2	-59.3	-90.3	0	0	0	111.7	I423 G425 L436 S456 T485	I423-Y438 HydrophobicContact CB-CD1 4.28Å; I423-Y438 HydrophobicContact CB-CE1 4.02Å; I423-Y438 HydrophobicContact CG2-CD1 4.32Å; I423-Y438 HydrophobicContact CG2-CE1 3.83Å; I423-Y438 PolarHBondContact O-OH 2.91Å; G425-Y438 WeakPolarHBondContact CA-OH 3.08Å; G425-Y438 PolarHBondContact N-OH 2.67Å; L436-Y438 HydrophobicContact CB-CE2 4.08Å; L436-Y438 WeakPolarHBondContact CD1-OH 3.31Å; Y438-S456 PolarHBondContact N-O 2.84Å; Y438-S456 WeakPolarHBondContact O-CA 3.46Å; Y438-S456 VanDerWaalsContact O-CB 3.28Å; Y438-S456 WeakPolarHBondContact O-CB 3.49Å; Y438-T485 HydrophobicContact CD1-CG2 3.76Å; Y438-T485 VanDerWaalsContact CD1-OG1 3.27Å; Y438-T485 WeakPolarHBondContact CD1-OG1 3.12Å; Y438-T485 HydrophobicContact CE1-CG2 3.53Å; Y438-T485 HydrophobicContact CG-CG2 4.47Å
439	H	89.2	Confident	74.7	Confident	109 Å²	109	72.9 Å²	72.9	51%	0.505	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	131.6	-179.1	-170.3	72	0	0	0	112.6	M441 V483 L484	H439-M441 PolarHBondContact O-N 2.84Å; H439-V483 CarbonylContact O-C 3.59Å; H439-V483 WeakPolarHBondContact O-CA 3.25Å; H439-L484 PolarHBondContact N-O 2.71Å; H439-L484 PolarHBondContact O-N 3.07Å
440	L	87.6	Confident	74.3	Confident	21 Å²	21	74 Å²	74	11%	0.11	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	116.6	173.5	-81.6	159	0	0	0	110.2	M442 F450 I454 F481 V483	L440-M442 PolarHBondContact O-N 3.03Å; L440-F450 HydrophobicContact CD1-CE1 4.04Å; L440-F450 HydrophobicContact CD2-CE1 3.97Å; L440-F450 HydrophobicContact CD2-CZ 4.3Å; L440-I454 HydrophobicContact CB-CG2 4.41Å; L440-I454 HydrophobicContact CD1-CB 4.07Å; L440-I454 HydrophobicContact CD1-CG2 3.92Å; L440-I454 HydrophobicContact CG-CB 4.11Å; L440-I454 HydrophobicContact CG-CG2 3.73Å; L440-F481 HydrophobicContact CD2-CD2 3.42Å; L440-F481 VanDerWaalsContact CD2-CD2 3.42Å; L440-F481 HydrophobicContact CD2-CE2 3.44Å; L440-F481 VanDerWaalsContact CD2-CE2 3.44Å; L440-F481 HydrophobicContact CD2-CG 4.47Å; L440-F481 HydrophobicContact CD2-CZ 4.48Å; L440-V483 HydrophobicContact CD2-CG2 3.84Å; L440-V483 HydrophobicContact CG-CG2 4.47Å
441	M	79.7	Confident	74.5	Confident	69 Å²	69	69.1 Å²	69.1	34%	0.34	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	110.2	171	-57	-177.8	77.8	0	0	108.8	H439 D443 K482 L484	H439-M441 PolarHBondContact O-N 2.84Å; M441-D443 PolarHBondContact O-N 2.9Å; M441-K482 HydrophobicContact CB-CB 3.97Å; M441-K482 HydrophobicContact CG-CB 4.24Å; M441-K482 PolarHBondContact N-O 2.8Å; M441-K482 HydrophobicContact SD-CB 3.93Å; M441-K482 HydrophobicContact SD-CD 4.34Å; M441-L484 HydrophobicContact CE-CD1 4.44Å; M441-L484 HydrophobicContact CG-CB 3.68Å; M441-L484 HydrophobicContact SD-CB 4Å; M441-L484 HydrophobicContact SD-CD1 4Å
442	M	63.6	Low	74.8	Confident	178 Å²	178	66.2 Å²	66.2	88%	0.877	36%	0.363	S	S	*	.			trans	-72	91.7	170.9	-65.9	-175.2	177.8	0	0	109.5	L440	L440-M442 PolarHBondContact O-N 3.03Å
443	D	50.6	Low	75.1	Confident	53 Å²	53	64.6 Å²	64.6	28%	0.283	36%	0.356	S	S	.	.			trans	-119.1	118.4	-175.6	-165.6	13.4	0	0	0	111.2	M441 T445 K482	M441-D443 PolarHBondContact O-N 2.9Å; D443-T445 VanDerWaalsContact C-N 3.31Å; D443-T445 PolarHBondContact O-N 2.83Å; D443-K482 WeakPolarHBondContact OD2-CE 3.11Å; D443-K482 IonicContact OD2-NZ 2.67Å; D443-K482 PolarHBondContact OD2-NZ 2.89Å
444	Q	50.9	Low	75.5	Confident	179 Å²	179	64.2 Å²	64.2	84%	0.836	35%	0.353	S	S	*	.	S	Bend	trans	60.4	-16.3	163.3	-75.3	163.1	72	0	0	121.5	G446	Q444-G446 VanDerWaalsContact C-N 3.33Å; Q444-G446 PolarHBondContact O-N 2.85Å
445	T	50.1	Low	75.9	Confident	72 Å²	72	66.6 Å²	66.6	44%	0.442	36%	0.362	S	S	.	.			trans	-71.4	-21.1	-175.7	61.1	0	0	0	0	115.2	D443 I447	D443-T445 VanDerWaalsContact C-N 3.31Å; D443-T445 PolarHBondContact O-N 2.83Å; T445-I447 PolarHBondContact O-N 2.92Å; T445-I447 VanDerWaalsContact O-N 3.13Å
446	G	51.6	Low	75.9	Confident	79 Å²	79	64 Å²	64	81%	0.814	36%	0.356	S	S	*	.			trans	70.2	0.8	179.6	0	0	0	0	0	115.6	Q444 S448	Q444-G446 VanDerWaalsContact C-N 3.33Å; Q444-G446 PolarHBondContact O-N 2.85Å; G446-S448 PolarHBondContact O-N 2.67Å; G446-S448 VanDerWaalsContact O-N 3.16Å
447	I	57.6	Low	75.8	Confident	71 Å²	71	70.5 Å²	70.5	36%	0.364	39%	0.386	S	S	.	.			trans	-75.2	104.8	-177.9	-54.4	171.9	0	0	0	109.2	T445 N449 L479	T445-I447 PolarHBondContact O-N 2.92Å; T445-I447 VanDerWaalsContact O-N 3.13Å; I447-N449 PolarHBondContact O-N 3.27Å; I447-L479 HydrophobicContact CD1-CD2 4.08Å
448	S	55	Low	75.8	Confident	81 Å²	81	70.3 Å²	70.3	57%	0.566	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.2	176.6	55.3	0	0	0	0	114.4	G446	G446-S448 PolarHBondContact O-N 2.67Å; G446-S448 VanDerWaalsContact O-N 3.16Å
449	N	64.3	Low	75.7	Confident	89 Å²	89	69.7 Å²	69.7	48%	0.476	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	44.7	-173.6	-70.7	-37	0	0	0	112.4	I447 R465	I447-N449 PolarHBondContact O-N 3.27Å; N449-R465 PolarHBondContact OD1-NH1 2.77Å
450	F	80.2	Confident	75.9	Confident	37 Å²	37	65.2 Å²	65.2	16%	0.162	37%	0.367	C	S	.	.			trans	-51.6	128.1	-178.1	-176.8	-101.2	0	0	0	112.6	L440 F452 F481	L440-F450 HydrophobicContact CD1-CE1 4.04Å; L440-F450 HydrophobicContact CD2-CE1 3.97Å; L440-F450 HydrophobicContact CD2-CZ 4.3Å; F450-F452 VanDerWaalsContact CD1-O 3.25Å; F450-F452 WeakPolarHBondContact CD1-O 3.24Å; F450-F452 HydrophobicContact CE1-CB 3.79Å; F450-F452 HydrophobicContact CE1-CD2 4.25Å; F450-F452 WeakPolarHBondContact CE1-O 3.39Å; F450-F452 HydrophobicContact CE2-CD2 4.46Å; F450-F452 HydrophobicContact CZ-CB 4.24Å; F450-F452 AromaticContact CZ-CD2 3.88Å; F450-F452 HydrophobicContact CZ-CD2 3.88Å; F450-F481 HydrophobicContact CE2-CB 4.17Å; F450-F481 AromaticContact CE2-CD1 3.91Å; F450-F481 HydrophobicContact CE2-CD1 3.91Å; F450-F481 HydrophobicContact CE2-CE1 4.48Å; F450-F481 HydrophobicContact CE2-CG 4.12Å; F450-F481 HydrophobicContact CZ-CB 4.08Å; F450-F481 AromaticContact CZ-CD1 3.57Å; F450-F481 HydrophobicContact CZ-CD1 3.57Å; F450-F481 HydrophobicContact CZ-CD2 4.02Å; F450-F481 AromaticContact CZ-CE1 3.85Å; F450-F481 HydrophobicContact CZ-CE1 3.85Å; F450-F481 HydrophobicContact CZ-CE2 4.28Å; F450-F481 AromaticContact CZ-CG 3.64Å; F450-F481 HydrophobicContact CZ-CG 3.64Å; F450-F481 HydrophobicContact CZ-CZ 4.2Å
451	P	85.9	Confident	76.1	Confident	14 Å²	14	64.2 Å²	64.2	9%	0.091	36%	0.361	C	S	.	.			trans	-87.6	-8.5	-161.1	32.8	-37	0	0	0	115.6	N464 R465 L467 L479	P451-N464 WeakPolarHBondContact O-CA 3.02Å; P451-N464 VanDerWaalsContact O-CB 3.3Å; P451-N464 WeakPolarHBondContact O-CB 2.93Å; P451-N464 PolarHBondContact O-N 2.68Å; P451-R465 PolarHBondContact O-N 2.86Å; P451-L467 HydrophobicContact CB-CD2 3.65Å; P451-L467 HydrophobicContact CG-CD2 3.95Å; P451-L479 HydrophobicContact CG-CD1 3.63Å
452	F	90	Very high	76.8	Confident	5 Å²	5	62.7 Å²	62.7	2%	0.022	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	150.6	179.6	-51.5	-65.9	0	0	0	112	L420 F450 I461 T462 V463 L467 L479 F481 V502	L420-F452 HydrophobicContact CD2-CD1 3.8Å; L420-F452 HydrophobicContact CD2-CE1 3.7Å; L420-F452 HydrophobicContact CD2-CE2 4.46Å; L420-F452 HydrophobicContact CD2-CG 4.25Å; L420-F452 HydrophobicContact CD2-CZ 4.06Å; F450-F452 VanDerWaalsContact CD1-O 3.25Å; F450-F452 WeakPolarHBondContact CD1-O 3.24Å; F450-F452 HydrophobicContact CE1-CB 3.79Å; F450-F452 HydrophobicContact CE1-CD2 4.25Å; F450-F452 WeakPolarHBondContact CE1-O 3.39Å; F450-F452 HydrophobicContact CE2-CD2 4.46Å; F450-F452 HydrophobicContact CZ-CB 4.24Å; F450-F452 AromaticContact CZ-CD2 3.88Å; F450-F452 HydrophobicContact CZ-CD2 3.88Å; F452-I461 HydrophobicContact CB-CG2 3.98Å; F452-I461 HydrophobicContact CG-CG2 4.5Å; F452-T462 WeakPolarHBondContact CA-O 3.13Å; F452-V463 HydrophobicContact CD1-CG2 4.41Å; F452-V463 HydrophobicContact CE1-CG2 4.22Å; F452-L467 HydrophobicContact CE1-CD1 4.43Å; F452-L467 HydrophobicContact CE1-CD2 3.99Å; F452-L467 HydrophobicContact CZ-CD2 4.01Å; F452-L479 HydrophobicContact CE2-CB 4.34Å; F452-L479 HydrophobicContact CE2-CD1 3.88Å; F452-L479 HydrophobicContact CZ-CD1 4.46Å; F452-F481 AromaticContact CD2-CE1 3.63Å; F452-F481 HydrophobicContact CD2-CE1 3.63Å; F452-F481 AromaticContact CD2-CZ 3.98Å; F452-F481 HydrophobicContact CD2-CZ 3.98Å; F452-F481 HydrophobicContact CE2-CE1 4Å; F452-V502 HydrophobicContact CE2-CB 4.14Å; F452-V502 HydrophobicContact CE2-CG1 4.14Å; F452-V502 HydrophobicContact CE2-CG2 4.14Å; F452-V502 HydrophobicContact CZ-CB 4.27Å; F452-V502 HydrophobicContact CZ-CG1 3.75Å; F452-V502 HydrophobicContact CZ-CG2 4.47Å
453	V	90.4	Very high	78.2	Confident	56 Å²	56	54.2 Å²	54.2	34%	0.339	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.2	170.6	66.9	0	0	0	0	109.3	I461 T462 N464	V453-I461 CarbonylContact O-C 3.55Å; V453-I461 WeakPolarHBondContact O-CA 3.27Å; V453-T462 VanDerWaalsContact CG1-OG1 3.22Å; V453-T462 WeakPolarHBondContact CG1-OG1 3.28Å; V453-T462 PolarHBondContact N-O 2.79Å; V453-T462 PolarHBondContact O-N 2.86Å; V453-N464 HydrophobicContact CB-CB 3.92Å; V453-N464 HydrophobicContact CG1-CB 3.88Å
454	I	91.4	Very high	80	Confident	21 Å²	21	55.4 Å²	55.4	11%	0.108	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.2	174.5	-163.3	168.5	0	0	0	110.6	I423 L440 S460 I461 V483	I423-I454 HydrophobicContact CD1-CD1 4.46Å; L440-I454 HydrophobicContact CB-CG2 4.41Å; L440-I454 HydrophobicContact CD1-CB 4.07Å; L440-I454 HydrophobicContact CD1-CG2 3.92Å; L440-I454 HydrophobicContact CG-CB 4.11Å; L440-I454 HydrophobicContact CG-CG2 3.73Å; I454-S460 WeakPolarHBondContact CA-O 3.35Å; I454-I461 HydrophobicContact CB-CG1 4.37Å; I454-I461 HydrophobicContact CD1-CD1 4.45Å; I454-I461 HydrophobicContact CD1-CG1 3.81Å; I454-I461 HydrophobicContact CG1-CG1 3.91Å; I454-V483 HydrophobicContact CD1-CB 4.45Å; I454-V483 HydrophobicContact CD1-CG1 3.56Å; I454-V483 HydrophobicContact CD1-CG2 4.03Å
455	D	91.8	Very high	81.6	Confident	72 Å²	72	52 Å²	52	39%	0.385	30%	0.3	S	S	.	.			trans	-75.3	120.6	167.6	176.7	-92.3	0	0	0	110	Q457 T458 G459 S460	D455-Q457 VanDerWaalsContact C-N 3.28Å; D455-Q457 PolarHBondContact O-N 3.03Å; D455-Q457 PolarHBondContact OD1-N 2.72Å; D455-T458 VanDerWaalsContact CG-OG1 3.31Å; D455-T458 WeakPolarHBondContact OD1-CA 3.37Å; D455-T458 VanDerWaalsContact OD1-CB 3.26Å; D455-T458 WeakPolarHBondContact OD1-CB 3.28Å; D455-T458 WeakPolarHBondContact OD1-CG2 3.45Å; D455-T458 PolarHBondContact OD1-N 3.21Å; D455-T458 PolarHBondContact OD1-OG1 3.47Å; D455-G459 WeakPolarHBondContact O-CA 3.41Å; D455-G459 PolarHBondContact O-N 3.05Å; D455-S460 PolarHBondContact N-O 3.32Å
456	S	89.9	Confident	83.4	Confident	44 Å²	44	53.6 Å²	53.6	31%	0.308	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-11.5	-167.8	67.6	0	0	0	0	115.1	H437 Y438	H437-S456 WeakPolarHBondContact CA-O 3.23Å; H437-S456 WeakPolarHBondContact NE2-CB 3.42Å; Y438-S456 PolarHBondContact N-O 2.84Å; Y438-S456 WeakPolarHBondContact O-CA 3.46Å; Y438-S456 VanDerWaalsContact O-CB 3.28Å; Y438-S456 WeakPolarHBondContact O-CB 3.49Å
457	Q	88.8	Confident	85.1	Confident	161 Å²	161	50.6 Å²	50.6	75%	0.752	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-31.4	179.3	-60.9	-175.3	11.8	0	0	112.4	D455	D455-Q457 VanDerWaalsContact C-N 3.28Å; D455-Q457 PolarHBondContact O-N 3.03Å; D455-Q457 PolarHBondContact OD1-N 2.72Å
458	T	90.8	Very high	86.6	Confident	53 Å²	53	49.8 Å²	49.8	33%	0.325	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-9.6	-173.2	69.6	0	0	0	0	114.3	R422 D455 S460	R422-T458 WeakPolarHBondContact CD-O 3.45Å; R422-T458 VanDerWaalsContact CG-O 3.24Å; R422-T458 WeakPolarHBondContact CG-O 3.34Å; R422-T458 PolarHBondContact NE-O 3.42Å; R422-T458 VanDerWaalsContact NE-O 3.16Å; R422-T458 PolarHBondContact NH2-OG1 3.14Å; D455-T458 VanDerWaalsContact CG-OG1 3.31Å; D455-T458 WeakPolarHBondContact OD1-CA 3.37Å; D455-T458 VanDerWaalsContact OD1-CB 3.26Å; D455-T458 WeakPolarHBondContact OD1-CB 3.28Å; D455-T458 WeakPolarHBondContact OD1-CG2 3.45Å; D455-T458 PolarHBondContact OD1-N 3.21Å; D455-T458 PolarHBondContact OD1-OG1 3.47Å; T458-S460 PolarHBondContact O-N 3.14Å
459	G	89.7	Confident	88	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.			trans	70.8	10.7	179.5	0	0	0	0	0	114.3	R422 I423 D455 I461	R422-G459 WeakPolarHBondContact CA-O 3.24Å; I423-G459 PolarHBondContact N-O 3.38Å; D455-G459 WeakPolarHBondContact O-CA 3.41Å; D455-G459 PolarHBondContact O-N 3.05Å; G459-I461 PolarHBondContact O-N 3.27Å
460	S	93.9	Very high	88.9	Confident	14 Å²	14	43.8 Å²	43.8	10%	0.098	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	121.5	176.9	-87.9	0	0	0	0	111.3	A421 R422 I454 D455 T458	A421-S460 CarbonylContact O-C 3.47Å; A421-S460 WeakPolarHBondContact O-CA 3.5Å; R422-S460 PolarHBondContact NE-OG 2.82Å; R422-S460 PolarHBondContact NH2-OG 3.32Å; I454-S460 WeakPolarHBondContact CA-O 3.35Å; D455-S460 PolarHBondContact N-O 3.32Å; T458-S460 PolarHBondContact O-N 3.14Å
461	I	92.9	Very high	88.9	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126.4	174.8	-54.6	172.7	0	0	0	108.8	L420 A421 I423 F452 V453 I454 G459 F481 V483 V500	L420-I461 HydrophobicContact CB-CG2 4.45Å; L420-I461 HydrophobicContact CD2-CG2 4.04Å; L420-I461 PolarHBondContact N-O 2.94Å; A421-I461 PolarHBondContact N-O 3.37Å; A421-I461 PolarHBondContact O-N 2.87Å; I423-I461 HydrophobicContact CD1-CD1 4.27Å; I423-I461 HydrophobicContact CG1-CD1 4.25Å; F452-I461 HydrophobicContact CB-CG2 3.98Å; F452-I461 HydrophobicContact CG-CG2 4.5Å; V453-I461 CarbonylContact O-C 3.55Å; V453-I461 WeakPolarHBondContact O-CA 3.27Å; I454-I461 HydrophobicContact CB-CG1 4.37Å; I454-I461 HydrophobicContact CD1-CD1 4.45Å; I454-I461 HydrophobicContact CD1-CG1 3.81Å; I454-I461 HydrophobicContact CG1-CG1 3.91Å; G459-I461 PolarHBondContact O-N 3.27Å; I461-F481 HydrophobicContact CD1-CE2 4.32Å; I461-V483 HydrophobicContact CD1-CG2 4.33Å; I461-V500 HydrophobicContact CD1-CG1 4.45Å; I461-V500 HydrophobicContact CD1-CG2 4.01Å
462	T	93.3	Very high	88.3	Confident	37 Å²	37	52.6 Å²	52.6	23%	0.227	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	155.4	178.7	53.6	0	0	0	0	112.4	T418 L419 F452 V453 N464	T418-T462 CarbonylContact O-C 3.11Å; T418-T462 VanDerWaalsContact O-CA 3.23Å; T418-T462 WeakPolarHBondContact O-CA 3.36Å; L419-T462 HydrophobicContact CD1-CG2 4.06Å; F452-T462 WeakPolarHBondContact CA-O 3.13Å; V453-T462 VanDerWaalsContact CG1-OG1 3.22Å; V453-T462 WeakPolarHBondContact CG1-OG1 3.28Å; V453-T462 PolarHBondContact N-O 2.79Å; V453-T462 PolarHBondContact O-N 2.86Å; T462-N464 PolarHBondContact O-N 3.5Å
463	V	92.3	Very high	87.2	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	117.7	168.7	-179.6	0	0	0	0	109	I410 G417 T418 F452 R465 L467	I410-V463 HydrophobicContact CD1-CG2 3.52Å; G417-V463 PolarHBondContact N-O 2.82Å; T418-V463 PolarHBondContact O-N 2.82Å; F452-V463 HydrophobicContact CD1-CG2 4.41Å; F452-V463 HydrophobicContact CE1-CG2 4.22Å; V463-R465 WeakPolarHBondContact CG1-O 3.42Å; V463-L467 HydrophobicContact CG1-CG 4.46Å
464	N	88.8	Confident	85.8	Confident	77 Å²	77	58.3 Å²	58.3	41%	0.412	30%	0.298	S	S	.	.			trans	-97.6	-23.2	-177.7	-170.5	36.8	0	0	0	112.6	P451 V453 T462	P451-N464 WeakPolarHBondContact O-CA 3.02Å; P451-N464 VanDerWaalsContact O-CB 3.3Å; P451-N464 WeakPolarHBondContact O-CB 2.93Å; P451-N464 PolarHBondContact O-N 2.68Å; V453-N464 HydrophobicContact CB-CB 3.92Å; V453-N464 HydrophobicContact CG1-CB 3.88Å; T462-N464 PolarHBondContact O-N 3.5Å
465	R	85.2	Confident	84.2	Confident	109 Å²	109	62.2 Å²	62.2	41%	0.411	33%	0.327	S	S	.	.	S	Bend	trans	-144.5	158.2	-179.8	-61.9	-171.8	-178.6	-167.3	8.5	109.4	N449 P451 V463 L467	N449-R465 PolarHBondContact OD1-NH1 2.77Å; P451-R465 PolarHBondContact O-N 2.86Å; V463-R465 WeakPolarHBondContact CG1-O 3.42Å; R465-L467 PolarHBondContact O-N 2.93Å
466	P	87.3	Confident	82.5	Confident	104 Å²	104	63.5 Å²	63.5	68%	0.675	33%	0.334	S	S	*	.			trans	-50.2	142.2	170.3	-24.8	35.1	0	0	0	110.8	V416	V416-P466 HydrophobicContact CG2-CG 4.21Å
467	L	88.8	Confident	81.5	Confident	16 Å²	16	62.7 Å²	62.7	8%	0.084	33%	0.325	C	S	.	.			trans	-86.8	161	170.2	-58.2	179.6	0	0	0	108.8	I410 E412 P451 F452 V463 R465 I504	I410-L467 HydrophobicContact CD1-CD1 4.25Å; I410-L467 HydrophobicContact CG1-CD1 4.23Å; I410-L467 HydrophobicContact CG2-CD1 3.68Å; E412-L467 HydrophobicContact CB-CB 3.97Å; P451-L467 HydrophobicContact CB-CD2 3.65Å; P451-L467 HydrophobicContact CG-CD2 3.95Å; F452-L467 HydrophobicContact CE1-CD1 4.43Å; F452-L467 HydrophobicContact CE1-CD2 3.99Å; F452-L467 HydrophobicContact CZ-CD2 4.01Å; V463-L467 HydrophobicContact CG1-CG 4.46Å; R465-L467 PolarHBondContact O-N 2.93Å; L467-I504 HydrophobicContact CB-CD1 4.29Å; L467-I504 HydrophobicContact CD1-CD1 4.36Å; L467-I504 HydrophobicContact CD1-CG2 4.46Å; L467-I504 HydrophobicContact CD2-CD1 4.15Å
468	D	87.2	Confident	81	Confident	55 Å²	55	58.6 Å²	58.6	29%	0.294	31%	0.305	S	S	.	.			trans	-159.4	108.7	-177.8	179.7	-58.3	0	0	0	104.7	R471	D468-R471 VanDerWaalsContact CG-NE 3.26Å; D468-R471 WeakPolarHBondContact OD1-CB 3.24Å; D468-R471 VanDerWaalsContact OD1-CG 3.26Å; D468-R471 WeakPolarHBondContact OD1-CG 3.32Å; D468-R471 PolarHBondContact OD1-N 3.39Å; D468-R471 IonicContact OD1-NE 2.75Å; D468-R471 PolarHBondContact OD1-NE 2.86Å; D468-R471 IonicContact OD2-CZ 3.55Å; D468-R471 IonicContact OD2-NE 2.75Å; D468-R471 PolarHBondContact OD2-NE 2.8Å; D468-R471 IonicContact OD2-NH2 2.75Å; D468-R471 PolarHBondContact OD2-NH2 3.01Å
469	A	84.4	Confident	80.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	S	Bend	trans	-88.2	-20.7	-170.4	0	0	0	0	0	112	E412 L472 K477 I504	E412-A469 HydrophobicContact CB-CB 4.43Å; E412-A469 VanDerWaalsContact CD-CB 3.47Å; E412-A469 VanDerWaalsContact OE1-CB 3.26Å; E412-A469 WeakPolarHBondContact OE1-CB 3.42Å; E412-A469 WeakPolarHBondContact OE2-CA 3.41Å; E412-A469 WeakPolarHBondContact OE2-CB 3.45Å; E412-A469 PolarHBondContact OE2-N 2.88Å; A469-L472 WeakPolarHBondContact O-CB 3.34Å; A469-L472 PolarHBondContact O-N 3.32Å; A469-K477 HydrophobicContact CB-CD 4.09Å; A469-K477 VanDerWaalsContact CB-NZ 3.3Å; A469-K477 WeakPolarHBondContact O-CE 3.35Å; A469-K477 PolarHBondContact O-NZ 3.4Å; A469-I504 HydrophobicContact CB-CB 4.25Å; A469-I504 HydrophobicContact CB-CG2 3.75Å
470	D	84.4	Confident	80.5	Confident	44 Å²	44	64.4 Å²	64.4	24%	0.235	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-19.3	-175.9	-59.9	-37.7	0	0	0	113.3	L472 K477 A548 D549	D470-L472 PolarHBondContact O-N 2.88Å; D470-K477 IonicContact OD1-NZ 3.79Å; D470-K477 PolarHBondContact OD1-NZ 2.9Å; D470-A548 HydrophobicContact CB-CB 4.13Å; D470-A548 VanDerWaalsContact CG-C 3.45Å; D470-A548 VanDerWaalsContact CG-O 3.25Å; D470-D549 PolarHBondContact OD2-N 3.01Å
471	R	79.5	Confident	80.1	Confident	209 Å²	209	64.4 Å²	64.4	79%	0.789	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-8.8	158.5	-73.7	-177.8	-117	-141.6	-5.3	113.5	D468	D468-R471 VanDerWaalsContact CG-NE 3.26Å; D468-R471 WeakPolarHBondContact OD1-CB 3.24Å; D468-R471 VanDerWaalsContact OD1-CG 3.26Å; D468-R471 WeakPolarHBondContact OD1-CG 3.32Å; D468-R471 PolarHBondContact OD1-N 3.39Å; D468-R471 IonicContact OD1-NE 2.75Å; D468-R471 PolarHBondContact OD1-NE 2.86Å; D468-R471 IonicContact OD2-CZ 3.55Å; D468-R471 IonicContact OD2-NE 2.75Å; D468-R471 PolarHBondContact OD2-NE 2.8Å; D468-R471 IonicContact OD2-NH2 2.75Å; D468-R471 PolarHBondContact OD2-NH2 3.01Å
472	L	73.6	Confident	79.9	Confident	26 Å²	26	67.5 Å²	67.5	14%	0.136	33%	0.334	C	S	.	.	S	Bend	trans	-86.7	136.3	168.9	-56	-174.9	0	0	0	110.3	A469 D470 Q474 L479 I504	A469-L472 WeakPolarHBondContact O-CB 3.34Å; A469-L472 PolarHBondContact O-N 3.32Å; D470-L472 PolarHBondContact O-N 2.88Å; L472-Q474 PolarHBondContact O-N 2.82Å; L472-L479 HydrophobicContact CD1-CD2 4.15Å; L472-L479 HydrophobicContact CD1-CG 4.09Å; L472-L479 HydrophobicContact CD2-CD2 3.92Å; L472-I504 HydrophobicContact CD1-CD1 3.77Å; L472-I504 HydrophobicContact CD1-CG1 4.22Å
473	P	67.7	Low	79.7	Confident	86 Å²	86	65.8 Å²	65.8	56%	0.558	32%	0.323	S	S	*	.			trans	-55.5	133.4	173.7	-24	33.7	0	0	0	111	S475 N476	P473-S475 PolarHBondContact O-N 2.75Å; P473-N476 CarbonylContact O-C 3.57Å; P473-N476 VanDerWaalsContact O-C 3.27Å; P473-N476 WeakPolarHBondContact O-CA 3.03Å; P473-N476 PolarHBondContact O-N 2.72Å
474	Q	59.1	Low	79.7	Confident	95 Å²	95	68 Å²	68	44%	0.444	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-56.1	-30.7	-176.3	-70.9	-169.3	-26.9	0	0	113.7	L472 N476 S550 N603	L472-Q474 PolarHBondContact O-N 2.82Å; Q474-N476 PolarHBondContact O-N 3.15Å; Q474-N476 VanDerWaalsContact O-N 3.1Å; Q474-S550 PolarHBondContact NE2-OG 3.13Å; Q474-N603 PolarHBondContact NE2-ND2 2.87Å; Q474-N603 VanDerWaalsContact NE2-ND2 3.14Å
475	S	57.8	Low	79.9	Confident	104 Å²	104	64.3 Å²	64.3	73%	0.727	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-64.7	-8.4	173.3	57.9	0	0	0	0	114.5	P473	P473-S475 PolarHBondContact O-N 2.75Å
476	N	56.7	Low	80.2	Confident	99 Å²	99	60.1 Å²	60.1	53%	0.529	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-158.2	57.6	-171.1	-140.3	12.7	0	0	0	113.4	P473 Q474 H478	P473-N476 CarbonylContact O-C 3.57Å; P473-N476 VanDerWaalsContact O-C 3.27Å; P473-N476 WeakPolarHBondContact O-CA 3.03Å; P473-N476 PolarHBondContact O-N 2.72Å; Q474-N476 PolarHBondContact O-N 3.15Å; Q474-N476 VanDerWaalsContact O-N 3.1Å; N476-H478 PolarHBondContact O-N 2.89Å
477	K	69.7	Low	80.4	Confident	26 Å²	26	55.2 Å²	55.2	11%	0.113	27%	0.271	C	S	.	.			trans	-66.9	33.7	163.8	-68.9	-156.9	170	-154.2	0	113.3	A469 D470 R503 I504 D506 S550	A469-K477 HydrophobicContact CB-CD 4.09Å; A469-K477 VanDerWaalsContact CB-NZ 3.3Å; A469-K477 WeakPolarHBondContact O-CE 3.35Å; A469-K477 PolarHBondContact O-NZ 3.4Å; D470-K477 IonicContact OD1-NZ 3.79Å; D470-K477 PolarHBondContact OD1-NZ 2.9Å; K477-R503 WeakPolarHBondContact O-CA 3.34Å; K477-I504 PolarHBondContact O-N 3.37Å; K477-D506 IonicContact NZ-OD1 2.78Å; K477-D506 PolarHBondContact NZ-OD1 2.95Å; K477-S550 VanDerWaalsContact CE-OG 3.24Å; K477-S550 WeakPolarHBondContact CE-OG 3.27Å; K477-S550 PolarHBondContact NZ-OG 3.35Å
478	H	78.4	Confident	80.2	Confident	75 Å²	75	58.3 Å²	58.3	35%	0.347	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	106.3	-176.4	-83.9	-98.3	0	0	0	110.2	N476 R480 D501 V502	N476-H478 PolarHBondContact O-N 2.89Å; H478-R480 PolarHBondContact O-N 3.17Å; H478-D501 IonicContact CE1-OD1 2.84Å; H478-D501 IonicContact CG-OD1 2.68Å; H478-D501 IonicContact ND1-OD1 3.61Å; H478-D501 PolarHBondContact ND1-OD1 3.27Å; H478-V502 CarbonylContact C-O 3.56Å; H478-V502 WeakPolarHBondContact CA-O 3.38Å
479	L	83.2	Confident	80	Confident	15 Å²	15	55.9 Å²	55.9	8%	0.079	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	93.3	171.2	-68	-175.7	0	0	0	110	I447 P451 F452 L472 F481 V502 I504	I447-L479 HydrophobicContact CD1-CD2 4.08Å; P451-L479 HydrophobicContact CG-CD1 3.63Å; F452-L479 HydrophobicContact CE2-CB 4.34Å; F452-L479 HydrophobicContact CE2-CD1 3.88Å; F452-L479 HydrophobicContact CZ-CD1 4.46Å; L472-L479 HydrophobicContact CD1-CD2 4.15Å; L472-L479 HydrophobicContact CD1-CG 4.09Å; L472-L479 HydrophobicContact CD2-CD2 3.92Å; L479-F481 WeakPolarHBondContact O-CD1 3.38Å; L479-V502 HydrophobicContact CB-CB 4.5Å; L479-V502 PolarHBondContact N-O 3.27Å; L479-V502 PolarHBondContact O-N 3.29Å; L479-I504 HydrophobicContact CD1-CD1 3.91Å; L479-I504 HydrophobicContact CG-CD1 4.35Å
480	R	85.3	Confident	79.6	Confident	160 Å²	160	64.7 Å²	64.7	60%	0.604	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	126.9	172.8	-173.6	-179.5	-71.3	173.4	0.8	111.5	H478 V499 V500 D501	H478-R480 PolarHBondContact O-N 3.17Å; R480-V499 HydrophobicContact CG-CG1 3.65Å; R480-V500 CarbonylContact C-O 3.57Å; R480-V500 WeakPolarHBondContact CA-O 3.48Å; R480-D501 IonicContact CZ-OD2 3.81Å; R480-D501 IonicContact NE-OD2 3.77Å; R480-D501 PolarHBondContact NE-OD2 3.34Å; R480-D501 IonicContact NH2-OD2 2.67Å; R480-D501 PolarHBondContact NH2-OD2 2.99Å
481	F	86	Confident	79	Confident	14 Å²	14	69.1 Å²	69.1	6%	0.061	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	175.2	177.5	56.2	-88.6	0	0	0	111.7	L440 F450 F452 I461 L479 V483 V499 V500 V502	L440-F481 HydrophobicContact CD2-CD2 3.42Å; L440-F481 VanDerWaalsContact CD2-CD2 3.42Å; L440-F481 HydrophobicContact CD2-CE2 3.44Å; L440-F481 VanDerWaalsContact CD2-CE2 3.44Å; L440-F481 HydrophobicContact CD2-CG 4.47Å; L440-F481 HydrophobicContact CD2-CZ 4.48Å; F450-F481 HydrophobicContact CE2-CB 4.17Å; F450-F481 AromaticContact CE2-CD1 3.91Å; F450-F481 HydrophobicContact CE2-CD1 3.91Å; F450-F481 HydrophobicContact CE2-CE1 4.48Å; F450-F481 HydrophobicContact CE2-CG 4.12Å; F450-F481 HydrophobicContact CZ-CB 4.08Å; F450-F481 AromaticContact CZ-CD1 3.57Å; F450-F481 HydrophobicContact CZ-CD1 3.57Å; F450-F481 HydrophobicContact CZ-CD2 4.02Å; F450-F481 AromaticContact CZ-CE1 3.85Å; F450-F481 HydrophobicContact CZ-CE1 3.85Å; F450-F481 HydrophobicContact CZ-CE2 4.28Å; F450-F481 AromaticContact CZ-CG 3.64Å; F450-F481 HydrophobicContact CZ-CG 3.64Å; F450-F481 HydrophobicContact CZ-CZ 4.2Å; F452-F481 AromaticContact CD2-CE1 3.63Å; F452-F481 HydrophobicContact CD2-CE1 3.63Å; F452-F481 AromaticContact CD2-CZ 3.98Å; F452-F481 HydrophobicContact CD2-CZ 3.98Å; F452-F481 HydrophobicContact CE2-CE1 4Å; I461-F481 HydrophobicContact CD1-CE2 4.32Å; L479-F481 WeakPolarHBondContact O-CD1 3.38Å; F481-V483 HydrophobicContact CD2-CG2 4.3Å; F481-V483 HydrophobicContact CE2-CG2 4.12Å; F481-V499 CarbonylContact O-C 3.59Å; F481-V499 WeakPolarHBondContact O-CA 3.1Å; F481-V500 HydrophobicContact CD1-CB 4.48Å; F481-V500 HydrophobicContact CD2-CB 3.97Å; F481-V500 HydrophobicContact CD2-CG2 4.29Å; F481-V500 HydrophobicContact CE1-CB 4.14Å; F481-V500 HydrophobicContact CE1-CG1 4.13Å; F481-V500 HydrophobicContact CE2-CB 3.57Å; F481-V500 HydrophobicContact CE2-CG1 4.03Å; F481-V500 HydrophobicContact CE2-CG2 3.81Å; F481-V500 HydrophobicContact CG-CB 4.43Å; F481-V500 HydrophobicContact CZ-CB 3.68Å; F481-V500 HydrophobicContact CZ-CG1 3.64Å; F481-V500 HydrophobicContact CZ-CG2 4.3Å; F481-V500 PolarHBondContact N-O 3.3Å; F481-V500 PolarHBondContact O-N 2.84Å; F481-V502 HydrophobicContact CE1-CG2 3.52Å; F481-V502 HydrophobicContact CZ-CG2 4Å
482	K	88.6	Confident	78.9	Confident	66 Å²	66	64.5 Å²	64.5	29%	0.287	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	141.2	176.9	-68.9	166.6	-172.9	164.5	0	110	M441 D443 Y497 T498 V499	M441-K482 HydrophobicContact CB-CB 3.97Å; M441-K482 HydrophobicContact CG-CB 4.24Å; M441-K482 PolarHBondContact N-O 2.8Å; M441-K482 HydrophobicContact SD-CB 3.93Å; M441-K482 HydrophobicContact SD-CD 4.34Å; D443-K482 WeakPolarHBondContact OD2-CE 3.11Å; D443-K482 IonicContact OD2-NZ 2.67Å; D443-K482 PolarHBondContact OD2-NZ 2.89Å; K482-Y497 HydrophobicContact CD-CD2 4.47Å; K482-Y497 HydrophobicContact CG-CD2 4.32Å; K482-T498 CarbonylContact C-O 3.55Å; K482-T498 WeakPolarHBondContact CA-O 3.4Å; K482-V499 HydrophobicContact CG-CG2 4.35Å
483	V	90.6	Very high	79.4	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.5	165.5	177.6	0	0	0	0	108	I423 H439 L440 I454 I461 F481 Y497 T498 V500	I423-V483 HydrophobicContact CD1-CB 3.58Å; I423-V483 HydrophobicContact CD1-CG1 3.71Å; I423-V483 HydrophobicContact CD1-CG2 3.78Å; H439-V483 CarbonylContact O-C 3.59Å; H439-V483 WeakPolarHBondContact O-CA 3.25Å; L440-V483 HydrophobicContact CD2-CG2 3.84Å; L440-V483 HydrophobicContact CG-CG2 4.47Å; I454-V483 HydrophobicContact CD1-CB 4.45Å; I454-V483 HydrophobicContact CD1-CG1 3.56Å; I454-V483 HydrophobicContact CD1-CG2 4.03Å; I461-V483 HydrophobicContact CD1-CG2 4.33Å; F481-V483 HydrophobicContact CD2-CG2 4.3Å; F481-V483 HydrophobicContact CE2-CG2 4.12Å; V483-Y497 CarbonylContact O-C 3.58Å; V483-Y497 WeakPolarHBondContact O-CA 3.43Å; V483-Y497 WeakPolarHBondContact O-CB 3.48Å; V483-T498 PolarHBondContact N-O 2.7Å; V483-T498 PolarHBondContact O-N 3.18Å; V483-V500 HydrophobicContact CG2-CG2 4.08Å
484	L	91.6	Very high	80.4	Confident	47 Å²	47	64.8 Å²	64.8	25%	0.246	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	138.4	167.5	-166.2	74.9	0	0	0	108.7	H439 M441 S496	H439-L484 PolarHBondContact N-O 2.71Å; H439-L484 PolarHBondContact O-N 3.07Å; M441-L484 HydrophobicContact CE-CD1 4.44Å; M441-L484 HydrophobicContact CG-CB 3.68Å; M441-L484 HydrophobicContact SD-CB 4Å; M441-L484 HydrophobicContact SD-CD1 4Å; L484-S496 WeakPolarHBondContact CA-O 3.43Å
485	T	93.3	Very high	81.8	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	116.6	167.9	-53.5	0	0	0	0	107.1	P400 V402 L436 H437 Y438 S495 S496	P400-T485 HydrophobicContact CB-CG2 4.02Å; V402-T485 HydrophobicContact CG1-CG2 3.96Å; L436-T485 HydrophobicContact CB-CG2 4.1Å; L436-T485 HydrophobicContact CD1-CG2 4Å; L436-T485 HydrophobicContact CD2-CG2 4.02Å; L436-T485 HydrophobicContact CG-CG2 4.27Å; H437-T485 WeakPolarHBondContact O-CA 3.41Å; Y438-T485 HydrophobicContact CD1-CG2 3.76Å; Y438-T485 VanDerWaalsContact CD1-OG1 3.27Å; Y438-T485 WeakPolarHBondContact CD1-OG1 3.12Å; Y438-T485 HydrophobicContact CE1-CG2 3.53Å; Y438-T485 HydrophobicContact CG-CG2 4.47Å; T485-S495 CarbonylContact O-C 3.52Å; T485-S495 WeakPolarHBondContact O-CA 3.24Å; T485-S495 WeakPolarHBondContact O-CB 3.25Å; T485-S496 PolarHBondContact N-O 3.06Å; T485-S496 PolarHBondContact O-N 3.33Å
486	S	91.4	Very high	83.5	Confident	21 Å²	21	59.2 Å²	59.2	15%	0.147	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	159.1	176	70.6	0	0	0	0	110.8	L436 H437 H494	L436-S486 CarbonylContact C-O 3.58Å; L436-S486 WeakPolarHBondContact CA-O 3.31Å; H437-S486 PolarHBondContact N-O 3.13Å; H437-S486 PolarHBondContact O-N 2.75Å; S486-H494 VanDerWaalsContact CA-O 3.29Å; S486-H494 WeakPolarHBondContact CA-O 3.25Å
487	D	90.7	Very high	85.1	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.011	30%	0.302	C	S	.	.			trans	-75.1	-170.3	160.5	57.4	43	0	0	0	111.6	N396 P400 N433 K435 G489 S493 H494	N396-D487 PolarHBondContact ND2-OD2 2.61Å; N396-D487 PolarHBondContact OD1-OD2 3.5Å; P400-D487 HydrophobicContact CG-CB 4.42Å; N433-D487 WeakPolarHBondContact O-CB 3.5Å; K435-D487 CarbonylContact O-C 3.54Å; K435-D487 VanDerWaalsContact O-CA 3.26Å; K435-D487 WeakPolarHBondContact O-CA 3.39Å; D487-G489 WeakPolarHBondContact OD1-CA 3.18Å; D487-G489 PolarHBondContact OD1-N 3.34Å; D487-S493 PolarHBondContact O-OG 2.85Å; D487-S493 WeakPolarHBondContact OD1-CA 3.22Å; D487-S493 WeakPolarHBondContact OD1-CB 3.26Å; D487-S493 PolarHBondContact OD1-OG 3.4Å; D487-H494 PolarHBondContact N-O 2.97Å; D487-H494 VanDerWaalsContact N-O 3.08Å; D487-H494 PolarHBondContact OD1-N 2.93Å; D487-H494 WeakPolarHBondContact OD2-CA 3.48Å; D487-H494 VanDerWaalsContact OD2-CB 3.32Å; D487-H494 WeakPolarHBondContact OD2-CB 3.32Å; D487-H494 PolarHBondContact OD2-N 2.95Å
488	F	86	Confident	86.2	Confident	80 Å²	80	59.5 Å²	59.5	35%	0.351	30%	0.296	S	S	.	.			trans	-109.6	21.8	163	-71.5	-86.3	0	0	0	113	D432 K435 H437	D432-F488 HydrophobicContact CB-CB 4.02Å; D432-F488 CarbonylContact O-C 3.37Å; D432-F488 WeakPolarHBondContact O-CA 3.47Å; D432-F488 WeakPolarHBondContact O-CB 3.44Å; D432-F488 PolarHBondContact O-N 3.06Å; D432-F488 VanDerWaalsContact O-N 3.11Å; K435-F488 HydrophobicContact CB-CD2 4.07Å; K435-F488 HydrophobicContact CD-CD2 3.7Å; K435-F488 HydrophobicContact CD-CE2 4.03Å; K435-F488 HydrophobicContact CG-CD2 3.67Å; K435-F488 HydrophobicContact CG-CE2 3.91Å; K435-F488 VanDerWaalsContact O-CD2 3.27Å; K435-F488 WeakPolarHBondContact O-CD2 3.38Å; K435-F488 PolarHBondContact O-N 2.89Å; H437-F488 HydrophobicContact CB-CE1 4.33Å; H437-F488 HydrophobicContact CB-CE2 3.8Å; H437-F488 HydrophobicContact CB-CZ 3.69Å; H437-F488 AromaticContact CD2-CZ 3.87Å; H437-F488 AromaticContact CG-CZ 4Å
489	G	81.4	Confident	86.8	Confident	5 Å²	5	57.3 Å²	57.3	5%	0.052	29%	0.288	C	S	.	.			trans	-57.4	145.1	-177.7	0	0	0	0	0	114.3	N396 D487 I492	N396-G489 WeakPolarHBondContact OD1-CA 3.39Å; D487-G489 WeakPolarHBondContact OD1-CA 3.18Å; D487-G489 PolarHBondContact OD1-N 3.34Å; G489-I492 CarbonylContact C-O 3.56Å; G489-I492 CarbonylContact O-C 3.6Å
490	K	76.4	Confident	87.1	Confident	184 Å²	184	56.6 Å²	56.6	80%	0.8	28%	0.284	S	S	*	.	S	Bend	trans	-142.8	139.1	-179.8	-68	178.3	-173.6	166.4	0	111.6	I492	K490-I492 PolarHBondContact N-O 2.62Å
491	P	71.7	Confident	87.3	Confident	138 Å²	138	49.4 Å²	49.4	90%	0.896	26%	0.258	S	S	*	.	S	Bend	cis	-81.2	-9	3.9	33.6	-36.7	0	0	0	114.4
492	I	77.1	Confident	87.5	Confident	111 Å²	111	48.7 Å²	48.7	57%	0.569	26%	0.255	S	S	*	.			trans	-106.5	130.6	175.1	-60.3	172.5	0	0	0	107.3	G489 K490	G489-I492 CarbonylContact C-O 3.56Å; G489-I492 CarbonylContact O-C 3.6Å; K490-I492 PolarHBondContact N-O 2.62Å
493	S	85.8	Confident	87.5	Confident	58 Å²	58	51 Å²	51	41%	0.406	26%	0.262	S	S	.	.			trans	-107.6	133.1	167.4	170.5	0	0	0	0	108.2	D487	D487-S493 PolarHBondContact O-OG 2.85Å; D487-S493 WeakPolarHBondContact OD1-CA 3.22Å; D487-S493 WeakPolarHBondContact OD1-CB 3.26Å; D487-S493 PolarHBondContact OD1-OG 3.4Å
494	H	87.6	Confident	87.4	Confident	60 Å²	60	51.2 Å²	51.2	28%	0.278	26%	0.263	S	S	.	.			trans	-93.1	152.3	172.5	-68.1	-50.3	0	0	0	110.9	N396 N398 I399 S486 D487	N396-H494 PolarHBondContact ND2-CD2 3.28Å; N398-H494 PolarHBondContact O-CD2 2.82Å; I399-H494 HydrophobicContact CB-CB 4Å; I399-H494 HydrophobicContact CG2-CB 3.71Å; S486-H494 VanDerWaalsContact CA-O 3.29Å; S486-H494 WeakPolarHBondContact CA-O 3.25Å; D487-H494 PolarHBondContact N-O 2.97Å; D487-H494 VanDerWaalsContact N-O 3.08Å; D487-H494 PolarHBondContact OD1-N 2.93Å; D487-H494 WeakPolarHBondContact OD2-CA 3.48Å; D487-H494 VanDerWaalsContact OD2-CB 3.32Å; D487-H494 WeakPolarHBondContact OD2-CB 3.32Å; D487-H494 PolarHBondContact OD2-N 2.95Å
495	S	89.7	Confident	87.2	Confident	61 Å²	61	51.4 Å²	51.4	43%	0.427	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	148.1	-178.8	59.6	0	0	0	0	112.5	T485	T485-S495 CarbonylContact O-C 3.52Å; T485-S495 WeakPolarHBondContact O-CA 3.24Å; T485-S495 WeakPolarHBondContact O-CB 3.25Å
496	S	92.3	Very high	86.9	Confident	21 Å²	21	53.4 Å²	53.4	15%	0.147	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	177.1	173	67.9	0	0	0	0	110	P400 V402 L484 T485	P400-S496 WeakPolarHBondContact O-CB 3.31Å; P400-S496 PolarHBondContact O-OG 2.81Å; V402-S496 VanDerWaalsContact CG2-OG 3.28Å; V402-S496 WeakPolarHBondContact CG2-OG 3.36Å; L484-S496 WeakPolarHBondContact CA-O 3.43Å; T485-S496 PolarHBondContact N-O 3.06Å; T485-S496 PolarHBondContact O-N 3.33Å
497	Y	91.2	Very high	86.7	Confident	131 Å²	131	54.2 Å²	54.2	51%	0.514	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	146.3	177.6	67.3	-90.6	0	0	0	113.6	K482 V483 V499	K482-Y497 HydrophobicContact CD-CD2 4.47Å; K482-Y497 HydrophobicContact CG-CD2 4.32Å; V483-Y497 CarbonylContact O-C 3.58Å; V483-Y497 WeakPolarHBondContact O-CA 3.43Å; V483-Y497 WeakPolarHBondContact O-CB 3.48Å; Y497-V499 HydrophobicContact CD2-CG2 4.14Å; Y497-V499 HydrophobicContact CE2-CG2 3.94Å
498	T	91.7	Very high	86.6	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.6	165.3	-63.8	0	0	0	0	108.9	V402 P403 L406 I423 K482 V483 V500	V402-T498 WeakPolarHBondContact CG2-OG1 3.45Å; P403-T498 HydrophobicContact CG-CG2 4.36Å; P403-T498 WeakPolarHBondContact O-CA 3.38Å; P403-T498 VanDerWaalsContact O-CB 3.25Å; P403-T498 WeakPolarHBondContact O-CB 3.22Å; P403-T498 VanDerWaalsContact O-CG2 3.3Å; P403-T498 WeakPolarHBondContact O-CG2 3.41Å; P403-T498 PolarHBondContact O-OG1 3.26Å; L406-T498 HydrophobicContact CB-CG2 4.05Å; I423-T498 HydrophobicContact CD1-CG2 4.2Å; K482-T498 CarbonylContact C-O 3.55Å; K482-T498 WeakPolarHBondContact CA-O 3.4Å; V483-T498 PolarHBondContact N-O 2.7Å; V483-T498 PolarHBondContact O-N 3.18Å; T498-V500 HydrophobicContact CG2-CG2 4.06Å
499	V	90.9	Very high	86.7	Confident	29 Å²	29	54.6 Å²	54.6	18%	0.176	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	116.1	164.1	-178.3	0	0	0	0	108.2	R404 T405 L406 R480 F481 K482 Y497	R404-V499 PolarHBondContact O-N 3.07Å; T405-V499 CarbonylContact C-O 3.57Å; T405-V499 WeakPolarHBondContact CA-O 3.25Å; T405-V499 HydrophobicContact CG2-CB 4.3Å; T405-V499 HydrophobicContact CG2-CG1 4.5Å; L406-V499 PolarHBondContact N-O 2.99Å; R480-V499 HydrophobicContact CG-CG1 3.65Å; F481-V499 CarbonylContact O-C 3.59Å; F481-V499 WeakPolarHBondContact O-CA 3.1Å; K482-V499 HydrophobicContact CG-CG2 4.35Å; Y497-V499 HydrophobicContact CD2-CG2 4.14Å; Y497-V499 HydrophobicContact CE2-CG2 3.94Å
500	V	90.7	Very high	87	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.6	172.7	-169.4	0	0	0	0	107.7	L406 L408 I423 I461 R480 F481 V483 T498 V502	L406-V500 WeakPolarHBondContact O-CA 3.3Å; L408-V500 HydrophobicContact CD1-CG1 3.83Å; I423-V500 HydrophobicContact CD1-CG2 4.35Å; I461-V500 HydrophobicContact CD1-CG1 4.45Å; I461-V500 HydrophobicContact CD1-CG2 4.01Å; R480-V500 CarbonylContact C-O 3.57Å; R480-V500 WeakPolarHBondContact CA-O 3.48Å; F481-V500 HydrophobicContact CD1-CB 4.48Å; F481-V500 HydrophobicContact CD2-CB 3.97Å; F481-V500 HydrophobicContact CD2-CG2 4.29Å; F481-V500 HydrophobicContact CE1-CB 4.14Å; F481-V500 HydrophobicContact CE1-CG1 4.13Å; F481-V500 HydrophobicContact CE2-CB 3.57Å; F481-V500 HydrophobicContact CE2-CG1 4.03Å; F481-V500 HydrophobicContact CE2-CG2 3.81Å; F481-V500 HydrophobicContact CG-CB 4.43Å; F481-V500 HydrophobicContact CZ-CB 3.68Å; F481-V500 HydrophobicContact CZ-CG1 3.64Å; F481-V500 HydrophobicContact CZ-CG2 4.3Å; F481-V500 PolarHBondContact N-O 3.3Å; F481-V500 PolarHBondContact O-N 2.84Å; V483-V500 HydrophobicContact CG2-CG2 4.08Å; T498-V500 HydrophobicContact CG2-CG2 4.06Å; V500-V502 HydrophobicContact CG1-CG2 3.76Å
501	D	88.9	Confident	87.7	Confident	9 Å²	9	52.4 Å²	52.4	5%	0.048	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	105.2	-179.2	-165.2	-45.6	0	0	0	108.3	L406 N407 L408 H478 R480	L406-D501 PolarHBondContact O-N 3.11Å; N407-D501 CarbonylContact C-O 3.59Å; N407-D501 WeakPolarHBondContact CA-O 3.33Å; L408-D501 PolarHBondContact N-O 3.48Å; H478-D501 IonicContact CE1-OD1 2.84Å; H478-D501 IonicContact CG-OD1 2.68Å; H478-D501 IonicContact ND1-OD1 3.61Å; H478-D501 PolarHBondContact ND1-OD1 3.27Å; R480-D501 IonicContact CZ-OD2 3.81Å; R480-D501 IonicContact NE-OD2 3.77Å; R480-D501 PolarHBondContact NE-OD2 3.34Å; R480-D501 IonicContact NH2-OD2 2.67Å; R480-D501 PolarHBondContact NH2-OD2 2.99Å
502	V	90.1	Very high	88.7	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	107.8	-172.1	-170.9	0	0	0	0	109.7	L408 I410 L420 F452 H478 L479 F481 V500	L408-V502 CarbonylContact O-C 3.56Å; L408-V502 WeakPolarHBondContact O-CA 3.09Å; I410-V502 HydrophobicContact CG2-CG1 3.64Å; L420-V502 HydrophobicContact CD1-CG1 4.13Å; L420-V502 HydrophobicContact CD2-CG1 4.02Å; L420-V502 HydrophobicContact CD2-CG2 3.76Å; F452-V502 HydrophobicContact CE2-CB 4.14Å; F452-V502 HydrophobicContact CE2-CG1 4.14Å; F452-V502 HydrophobicContact CE2-CG2 4.14Å; F452-V502 HydrophobicContact CZ-CB 4.27Å; F452-V502 HydrophobicContact CZ-CG1 3.75Å; F452-V502 HydrophobicContact CZ-CG2 4.47Å; H478-V502 CarbonylContact C-O 3.56Å; H478-V502 WeakPolarHBondContact CA-O 3.38Å; L479-V502 HydrophobicContact CB-CB 4.5Å; L479-V502 PolarHBondContact N-O 3.27Å; L479-V502 PolarHBondContact O-N 3.29Å; F481-V502 HydrophobicContact CE1-CG2 3.52Å; F481-V502 HydrophobicContact CZ-CG2 4Å; V500-V502 HydrophobicContact CG1-CG2 3.76Å
503	R	88.3	Confident	89.4	Confident	115 Å²	115	45.2 Å²	45.2	43%	0.434	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	128.1	167.6	-170.8	-179.4	179.5	-163.4	-3.2	109.1	L408 D409 I410 K477	L408-R503 PolarHBondContact O-N 2.82Å; D409-R503 VanDerWaalsContact OD1-CB 3.3Å; D409-R503 WeakPolarHBondContact OD1-CB 3.27Å; D409-R503 WeakPolarHBondContact OD1-CD 3.28Å; I410-R503 PolarHBondContact N-O 3.38Å; K477-R503 WeakPolarHBondContact O-CA 3.34Å
504	I	89.2	Confident	89.7	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.8	165.6	-49.7	-170.4	0	0	0	107.4	I410 E412 L467 A469 L472 K477 L479	I410-I504 CarbonylContact O-C 3.56Å; I410-I504 WeakPolarHBondContact O-CA 3.17Å; E412-I504 HydrophobicContact CB-CG2 3.7Å; L467-I504 HydrophobicContact CB-CD1 4.29Å; L467-I504 HydrophobicContact CD1-CD1 4.36Å; L467-I504 HydrophobicContact CD1-CG2 4.46Å; L467-I504 HydrophobicContact CD2-CD1 4.15Å; A469-I504 HydrophobicContact CB-CB 4.25Å; A469-I504 HydrophobicContact CB-CG2 3.75Å; L472-I504 HydrophobicContact CD1-CD1 3.77Å; L472-I504 HydrophobicContact CD1-CG1 4.22Å; K477-I504 PolarHBondContact O-N 3.37Å; L479-I504 HydrophobicContact CD1-CD1 3.91Å; L479-I504 HydrophobicContact CG-CD1 4.35Å
505	N	87.1	Confident	89.7	Confident	51 Å²	51	47.1 Å²	47.1	27%	0.273	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	134.2	176	-71.8	-37.2	0	0	0	109.9	I410 E412	I410-N505 PolarHBondContact O-N 3.36Å; E412-N505 PolarHBondContact N-O 3.45Å
506	D	86.1	Confident	89.4	Confident	41 Å²	41	46.3 Å²	46.3	22%	0.219	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-64.7	127.4	-177.5	-153.9	91.2	0	0	0	112.8	E412 K477 S550 N553	E412-D506 VanDerWaalsContact OE1-CA 3.29Å; E412-D506 WeakPolarHBondContact OE1-CA 3.18Å; K477-D506 IonicContact NZ-OD1 2.78Å; K477-D506 PolarHBondContact NZ-OD1 2.95Å; D506-S550 VanDerWaalsContact CG-N 3.28Å; D506-S550 WeakPolarHBondContact OD1-CA 3.21Å; D506-S550 WeakPolarHBondContact OD1-CB 3.43Å; D506-S550 PolarHBondContact OD1-N 2.67Å; D506-S550 PolarHBondContact OD2-N 2.91Å; D506-S550 VanDerWaalsContact OD2-O 3.11Å; D506-N553 WeakPolarHBondContact OD2-CB 3.5Å; D506-N553 PolarHBondContact OD2-ND2 2.95Å
507	V	87.6	Confident	88.7	Confident	38 Å²	38	49.1 Å²	49.1	23%	0.23	24%	0.238	C	C	.	.			trans	-106.2	155.2	166	176.5	0	0	0	0	108.7	S411 E412 D413 D509	S411-V507 WeakPolarHBondContact OG-CG2 3.43Å; E412-V507 HydrophobicContact CG-CB 3.89Å; E412-V507 HydrophobicContact CG-CG2 3.88Å; E412-V507 PolarHBondContact OE1-N 3.35Å; D413-V507 HydrophobicContact CB-CG2 4.31Å; V507-D509 VanDerWaalsContact C-N 3.31Å; V507-D509 WeakPolarHBondContact CB-OD1 3.14Å; V507-D509 HydrophobicContact CG1-CB 4.14Å; V507-D509 PolarHBondContact O-N 3.3Å
508	N	88.8	Confident	87.7	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.043	22%	0.219	C	C	.	.	S	Bend	trans	-88.2	72.7	177.2	-161.7	135.5	0	0	0	108.7	D549 N553 D631 P633 R640	N508-D549 VanDerWaalsContact C-OD2 3.31Å; N508-D549 WeakPolarHBondContact CA-OD2 3.25Å; N508-D549 PolarHBondContact ND2-OD2 2.75Å; N508-N553 HydrophobicContact CB-CB 3.93Å; N508-N553 PolarHBondContact N-ND2 3.34Å; N508-N553 WeakPolarHBondContact OD1-CA 3.3Å; N508-D631 PolarHBondContact ND2-OD2 2.81Å; N508-D631 PolarHBondContact OD1-OD2 2.88Å; N508-P633 WeakPolarHBondContact OD1-CB 3.32Å; N508-P633 WeakPolarHBondContact OD1-CD 3.38Å; N508-P633 WeakPolarHBondContact OD1-CG 3.48Å; N508-R640 WeakPolarHBondContact ND2-CD 3.16Å; N508-R640 VanDerWaalsContact O-CZ 3.28Å; N508-R640 PolarHBondContact O-NE 3.02Å; N508-R640 PolarHBondContact O-NH2 2.82Å
509	D	87.8	Confident	86.2	Confident	82 Å²	82	47.6 Å²	47.6	44%	0.439	24%	0.238	S	C	.	.			trans	-118.7	-2.4	-173.6	82.8	-85.8	0	0	0	120.3	V507 D549 R640	V507-D509 VanDerWaalsContact C-N 3.31Å; V507-D509 WeakPolarHBondContact CB-OD1 3.14Å; V507-D509 HydrophobicContact CG1-CB 4.14Å; V507-D509 PolarHBondContact O-N 3.3Å; D509-D549 PolarHBondContact N-OD1 3.49Å; D509-D549 PolarHBondContact N-OD2 2.68Å; D509-R640 VanDerWaalsContact CA-CZ 3.49Å; D509-R640 VanDerWaalsContact CA-NH2 3.34Å; D509-R640 PolarHBondContact O-NH1 2.75Å; D509-R640 PolarHBondContact O-NH2 3.45Å
510	E	89	Confident	84.6	Confident	92 Å²	92	51.1 Å²	51.1	43%	0.43	25%	0.252	S	S	.	.	S	Bend	trans	-90.7	-169.1	161.3	-86.8	-70.1	176.1	0	0	113.2	A548 D549 R640	E510-A548 HydrophobicContact CB-CB 3.89Å; E510-A548 HydrophobicContact CG-CB 3.86Å; E510-D549 WeakPolarHBondContact CB-OD1 3.2Å; E510-D549 PolarHBondContact N-OD1 2.77Å; E510-R640 WeakPolarHBondContact O-CD 3.48Å; E510-R640 PolarHBondContact O-NE 3.49Å; E510-R640 PolarHBondContact O-NH1 3.45Å
511	T	90.6	Very high	82.7	Confident	52 Å²	52	55.2 Å²	55.2	32%	0.319	28%	0.281	S	S	.	.			trans	-145.7	147.2	179.6	48.8	0	0	0	0	112.9	Q513 R640	T511-Q513 PolarHBondContact O-N 2.81Å; T511-Q513 PolarHBondContact O-NE2 3.02Å; T511-Q513 PolarHBondContact OG1-NE2 2.82Å; T511-Q513 VanDerWaalsContact OG1-NE2 3.13Å; T511-R640 HydrophobicContact CG2-CB 4.29Å
512	P	92.9	Very high	80.8	Confident	3 Å²	3	65.2 Å²	65.2	2%	0.019	32%	0.318	C	S	.	.			trans	-55.4	110.2	180	-25.1	29.1	0	0	0	113.2	D547 L556 C629 G642	P512-D547 WeakPolarHBondContact CA-OD2 3.15Å; P512-D547 WeakPolarHBondContact CD-OD2 2.99Å; P512-D547 WeakPolarHBondContact CG-OD2 3.16Å; P512-D547 VanDerWaalsContact N-OD2 3.12Å; P512-L556 HydrophobicContact CB-CD2 3.67Å; P512-L556 HydrophobicContact CG-CD2 3.94Å; P512-C629 HydrophobicContact CB-CB 4Å; P512-G642 WeakPolarHBondContact O-CA 3.17Å
513	Q	91.7	Very high	78.7	Confident	95 Å²	95	67.6 Å²	67.6	44%	0.444	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	127.5	175.6	-61.2	-55	-53.5	0	0	109.9	T511 A545 T546	T511-Q513 PolarHBondContact O-N 2.81Å; T511-Q513 PolarHBondContact O-NE2 3.02Å; T511-Q513 PolarHBondContact OG1-NE2 2.82Å; T511-Q513 VanDerWaalsContact OG1-NE2 3.13Å; Q513-A545 CarbonylContact O-C 3.36Å; Q513-A545 WeakPolarHBondContact O-CA 3.38Å; Q513-T546 PolarHBondContact N-O 2.75Å; Q513-T546 PolarHBondContact O-N 2.75Å
514	I	91	Very high	76.6	Confident	21 Å²	21	69.8 Å²	69.8	11%	0.108	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114.5	-176.7	-44.2	173.3	0	0	0	109.9	V543 A545 I627 C629 T644	I514-V543 HydrophobicContact CG2-CG1 3.55Å; I514-A545 HydrophobicContact CG1-CB 4.45Å; I514-I627 HydrophobicContact CD1-CG2 4.32Å; I514-I627 HydrophobicContact CG2-CG2 4.36Å; I514-C629 HydrophobicContact CD1-CB 3.88Å; I514-C629 VanDerWaalsContact CD1-SG 3.56Å; I514-C629 HydrophobicContact CG1-CB 4.26Å; I514-T644 HydrophobicContact CB-CG2 3.78Å; I514-T644 HydrophobicContact CD1-CG2 4.4Å; I514-T644 HydrophobicContact CG2-CG2 3.51Å
515	K	87.6	Confident	74.7	Confident	137 Å²	137	72.6 Å²	72.6	60%	0.596	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.2	179.1	-66.7	173.3	-176	167.5	0	109.8	V543 T544	K515-V543 WeakPolarHBondContact O-CA 3.28Å; K515-T544 PolarHBondContact N-O 2.85Å; K515-T544 PolarHBondContact O-N 2.96Å
516	V	84.3	Confident	73.4	Confident	44 Å²	44	73.9 Å²	73.9	27%	0.267	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.5	173.6	-173.8	0	0	0	0	108.2	A541 V543 T644 F646	V516-A541 HydrophobicContact CG1-CB 4Å; V516-V543 HydrophobicContact CB-CG2 4.47Å; V516-V543 HydrophobicContact CG1-CG2 4.18Å; V516-V543 HydrophobicContact CG2-CG2 4.16Å; V516-T644 HydrophobicContact CG2-CG2 3.82Å; V516-F646 HydrophobicContact CG1-CD1 4.2Å; V516-F646 HydrophobicContact CG1-CD2 4.34Å; V516-F646 HydrophobicContact CG1-CE1 4.24Å; V516-F646 HydrophobicContact CG1-CE2 4.38Å; V516-F646 HydrophobicContact CG1-CG 4.24Å; V516-F646 HydrophobicContact CG1-CZ 4.33Å; V516-F646 HydrophobicContact CG2-CD1 3.81Å; V516-F646 HydrophobicContact CG2-CE1 4.07Å; V516-F646 HydrophobicContact CG2-CG 4.46Å
517	I	78.1	Confident	72.7	Confident	80 Å²	80	76.5 Å²	76.5	41%	0.41	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	107.6	177.7	-57.4	173.6	0	0	0	107.2	F542	I517-F542 HydrophobicContact CB-CB 4.17Å; I517-F542 PolarHBondContact N-O 2.82Å; I517-F542 PolarHBondContact O-N 3.08Å
518	D	68.8	Low	72.6	Confident	25 Å²	25	74.9 Å²	74.9	13%	0.134	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	141	167	175.3	26.3	0	0	0	109.9	E520 S521 P528	D518-E520 PolarHBondContact OD1-N 3.34Å; D518-E520 VanDerWaalsContact OD1-N 3.13Å; D518-S521 WeakPolarHBondContact OD2-CA 3.28Å; D518-S521 PolarHBondContact OD2-N 3.24Å; D518-P528 HydrophobicContact CB-CG 4.14Å
519	L	60.8	Low	72.4	Confident	73 Å²	73	76.2 Å²	76.2	38%	0.382	39%	0.391	S	S	.	.	S	Bend	trans	-79.6	-28.3	179.8	-93.8	162.6	0	0	0	113.4	L539 F542 F587	L519-L539 HydrophobicContact CD1-CD2 3.66Å; L519-L539 HydrophobicContact CD1-CG 3.73Å; L519-F542 HydrophobicContact CD1-CD2 4.34Å; L519-F542 HydrophobicContact CD1-CE2 4.14Å; L519-F542 HydrophobicContact CD2-CD2 4.27Å; L519-F542 HydrophobicContact CD2-CE2 3.99Å; L519-F542 HydrophobicContact CG-CD2 4.16Å; L519-F542 HydrophobicContact CG-CE2 4.2Å; L519-F587 HydrophobicContact CD2-CE1 4.3Å
520	E	57	Low	72.5	Confident	104 Å²	104	72.8 Å²	72.8	49%	0.486	37%	0.373	S	S	.	.			trans	-98.4	-48.1	-172.4	-63.6	-123.3	132	0	0	112.2	D518 R522	D518-E520 PolarHBondContact OD1-N 3.34Å; D518-E520 VanDerWaalsContact OD1-N 3.13Å; E520-R522 WeakPolarHBondContact O-CG 3.38Å; E520-R522 PolarHBondContact O-N 3Å
521	S	51.3	Low	72.4	Confident	86 Å²	86	71.2 Å²	71.2	60%	0.601	37%	0.366	S	S	*	.			trans	53.8	20.2	176.6	68.4	0	0	0	0	115.9	D518	D518-S521 WeakPolarHBondContact OD2-CA 3.28Å; D518-S521 PolarHBondContact OD2-N 3.24Å
522	R	49.6	Very low	72.3	Confident	219 Å²	219	68.7 Å²	68.7	83%	0.826	35%	0.351	S	S	*	.			trans	-93.4	-15.5	179.6	-70	169.8	-164.4	-169.6	7.7	113.5	E520	E520-R522 WeakPolarHBondContact O-CG 3.38Å; E520-R522 PolarHBondContact O-N 3Å
523	S	45.6	Very low	72	Confident	50 Å²	50	72.2 Å²	72.2	35%	0.35	37%	0.369	S	S	.	.	S	Bend	trans	-88.5	144.8	174	38.7	0	0	0	0	110.5	P525 P526	S523-P525 CarbonylContact C-O 3.57Å; S523-P525 CarbonylContact O-C 3.43Å; S523-P526 WeakPolarHBondContact O-CA 3.06Å
524	N	44.6	Very low	71.8	Confident	160 Å²	160	73.1 Å²	73.1	86%	0.856	37%	0.369	S	S	*	.	S	Bend	trans	-124.7	115.4	169.7	-172.8	18.1	0	0	0	108.7
525	P	48.4	Very low	71.7	Confident	64 Å²	64	78.2 Å²	78.2	42%	0.416	39%	0.392	S	S	.	.	S	Bend	cis	-66.7	155.7	-3.3	-18.4	33.5	0	0	0	113	S523 Y527	S523-P525 CarbonylContact C-O 3.57Å; S523-P525 CarbonylContact O-C 3.43Å; P525-Y527 HydrophobicContact CB-CE1 4.09Å; P525-Y527 HydrophobicContact CB-CE2 3.91Å; P525-Y527 HydrophobicContact CG-CE2 4.1Å; P525-Y527 PolarHBondContact O-N 3.44Å
526	P	60.1	Low	71.8	Confident	77 Å²	77	74.6 Å²	74.6	50%	0.5	38%	0.383	S	S	.	.			trans	-75.1	113.4	179.1	29.6	-33.5	0	0	0	110.4	S523	S523-P526 WeakPolarHBondContact O-CA 3.06Å
527	Y	72.2	Confident	72.1	Confident	96 Å²	96	74.1 Å²	74.1	38%	0.376	39%	0.387	S	S	.	.			trans	-128	125	175.4	-56.3	-54.2	0	0	0	108.7	P525 T529 Y647	P525-Y527 HydrophobicContact CB-CE1 4.09Å; P525-Y527 HydrophobicContact CB-CE2 3.91Å; P525-Y527 HydrophobicContact CG-CE2 4.1Å; P525-Y527 PolarHBondContact O-N 3.44Å; Y527-T529 PolarHBondContact O-N 3.19Å; Y527-Y647 HydrophobicContact CD1-CD2 4.19Å; Y527-Y647 AromaticContact CE1-CD2 3.77Å; Y527-Y647 HydrophobicContact CE1-CD2 3.77Å
528	P	84.1	Confident	72.6	Confident	4 Å²	4	73.9 Å²	73.9	3%	0.026	38%	0.384	C	S	.	.			trans	-53	138.4	175.6	-29.5	36	0	0	0	113.1	D518 V540 A541 F646 V648 R649	D518-P528 HydrophobicContact CB-CG 4.14Å; P528-V540 HydrophobicContact CB-CG1 3.67Å; P528-A541 HydrophobicContact CB-CB 4.4Å; P528-A541 HydrophobicContact CG-CB 3.95Å; P528-F646 HydrophobicContact CG-CD2 4.1Å; P528-F646 HydrophobicContact CG-CE2 4.19Å; P528-V648 WeakPolarHBondContact O-CA 3.4Å; P528-R649 PolarHBondContact O-N 2.84Å
529	T	85	Confident	73.6	Confident	37 Å²	37	76 Å²	76	23%	0.227	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	146.2	179.1	45.9	0	0	0	0	111.9	Y527 R649 L651	Y527-T529 PolarHBondContact O-N 3.19Å; T529-R649 WeakPolarHBondContact CA-O 3.14Å; T529-R649 HydrophobicContact CG2-CB 4.25Å; T529-L651 HydrophobicContact CG2-CD1 4.14Å; T529-L651 HydrophobicContact CG2-CD2 4.03Å; T529-L651 HydrophobicContact CG2-CG 4.14Å
530	V	89.2	Confident	75	Confident	9 Å²	9	72.6 Å²	72.6	6%	0.055	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	136	173.2	66.5	0	0	0	0	110.1	Q538 V540 T611 L615 V648 R649 I650 L651	V530-Q538 HydrophobicContact CG2-CB 4.05Å; V530-V540 HydrophobicContact CB-CG2 4.32Å; V530-V540 HydrophobicContact CG2-CG2 4.3Å; V530-T611 HydrophobicContact CG2-CG2 4.07Å; V530-L615 HydrophobicContact CG1-CD1 3.47Å; V530-L615 VanDerWaalsContact CG1-CD1 3.47Å; V530-L615 HydrophobicContact CG2-CD1 4.27Å; V530-V648 HydrophobicContact CB-CG1 4.42Å; V530-V648 HydrophobicContact CG1-CG1 3.66Å; V530-R649 PolarHBondContact N-O 2.8Å; V530-I650 HydrophobicContact CG1-CG1 4.13Å; V530-I650 CarbonylContact O-C 3.54Å; V530-I650 WeakPolarHBondContact O-CA 3.22Å; V530-L651 PolarHBondContact O-N 2.8Å
531	M	86.6	Confident	76.5	Confident	59 Å²	59	67.7 Å²	67.7	29%	0.291	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	140.9	171.7	-58.4	-57.5	-54.2	0	0	109.9	R534 L651 D652 E653	M531-R534 HydrophobicContact CB-CG 3.76Å; M531-L651 HydrophobicContact CE-CB 4.02Å; M531-L651 HydrophobicContact SD-CB 3.51Å; M531-L651 VanDerWaalsContact SD-CB 3.51Å; M531-L651 HydrophobicContact SD-CD1 3.71Å; M531-L651 HydrophobicContact SD-CG 4.27Å; M531-D652 WeakPolarHBondContact CE-O 3.48Å; M531-E653 HydrophobicContact CE-CG 3.83Å; M531-E653 WeakPolarHBondContact CE-OE1 3.37Å
532	E	90	Very high	78.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	176.7	169.5	74.7	-171.6	122.2	0	0	113.2	R534 L615 R617 I650 L651 D652 E653	E532-R534 WeakPolarHBondContact O-CG 3.24Å; E532-R534 PolarHBondContact O-N 3.09Å; E532-L615 WeakPolarHBondContact CB-O 3.5Å; E532-R617 VanDerWaalsContact CD-CB 3.43Å; E532-R617 WeakPolarHBondContact OE1-CB 3.23Å; E532-R617 IonicContact OE1-NE 2.72Å; E532-R617 WeakPolarHBondContact OE2-CB 3.24Å; E532-R617 PolarHBondContact OE2-N 2.88Å; E532-I650 HydrophobicContact CB-CG2 3.75Å; E532-L651 PolarHBondContact N-O 2.77Å; E532-L651 VanDerWaalsContact N-O 3.1Å; E532-D652 VanDerWaalsContact OE1-CA 3.23Å; E532-D652 WeakPolarHBondContact OE1-CA 3.32Å; E532-E653 HydrophobicContact CG-CB 4.04Å; E532-E653 HydrophobicContact CG-CG 3.94Å; E532-E653 PolarHBondContact OE1-N 3.32Å
533	N	85.2	Confident	80.2	Confident	76 Å²	76	56.1 Å²	56.1	41%	0.406	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	8.8	178.3	-84.1	-60.6	0	0	0	115.7	L615 D655	N533-L615 PolarHBondContact N-O 3.32Å; N533-D655 PolarHBondContact ND2-OD2 2.89Å
534	R	87.5	Confident	82.3	Confident	115 Å²	115	55.2 Å²	55.2	43%	0.434	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-87.6	139.1	177.3	-57	-42.2	-176.7	114.8	-11.5	110.8	M531 E532 Q538 E653	M531-R534 HydrophobicContact CB-CG 3.76Å; E532-R534 WeakPolarHBondContact O-CG 3.24Å; E532-R534 PolarHBondContact O-N 3.09Å; R534-Q538 HydrophobicContact CB-CG 3.59Å; R534-Q538 HydrophobicContact CG-CG 4.45Å; R534-E653 IonicContact CZ-OE1 2.73Å; R534-E653 IonicContact NE-OE1 2.76Å; R534-E653 PolarHBondContact NE-OE1 2.94Å; R534-E653 IonicContact NH2-OE1 3.16Å; R534-E653 PolarHBondContact NH2-OE1 3.47Å
535	Q	88.8	Confident	84.6	Confident	127 Å²	127	47.6 Å²	47.6	59%	0.593	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-53.3	144.6	177.7	-69.6	-64	-65.9	0	0	111.9	Q538 E614	Q535-Q538 PolarHBondContact O-NE2 2.95Å; Q535-E614 PolarHBondContact NE2-OE1 3.15Å
536	P	90.7	Very high	86.6	Confident	62 Å²	62	46.4 Å²	46.4	40%	0.403	24%	0.243	S	C	.	.	S	Bend	trans	-53.8	143.5	-179.4	-26.8	34.7	0	0	0	113.7	E614	P536-E614 HydrophobicContact CG-CG 4.41Å
537	G	90	Very high	88.1	Confident	34 Å²	34	43.3 Å²	43.3	35%	0.351	22%	0.222	S	C	.	.			trans	102.1	13.7	-177	0	0	0	0	0	114.7	L539 T611	G537-L539 PolarHBondContact O-N 2.88Å; G537-T611 WeakPolarHBondContact CA-O 3.25Å; G537-T611 PolarHBondContact N-O 2.93Å; G537-T611 PolarHBondContact N-OG1 3.06Å
538	Q	89.8	Confident	88.8	Confident	74 Å²	74	40.7 Å²	40.7	35%	0.346	22%	0.22	S	C	.	.			trans	-64.9	133.5	170.3	-58.3	-49	-53.9	0	0	110	V530 R534 Q535 V610 T611	V530-Q538 HydrophobicContact CG2-CB 4.05Å; R534-Q538 HydrophobicContact CB-CG 3.59Å; R534-Q538 HydrophobicContact CG-CG 4.45Å; Q535-Q538 PolarHBondContact O-NE2 2.95Å; Q538-V610 CarbonylContact O-C 3.51Å; Q538-V610 WeakPolarHBondContact O-CA 3.37Å; Q538-V610 VanDerWaalsContact O-CB 3.27Å; Q538-V610 WeakPolarHBondContact O-CB 3.34Å; Q538-T611 HydrophobicContact CB-CG2 4.19Å; Q538-T611 PolarHBondContact N-OG1 3.46Å; Q538-T611 VanDerWaalsContact N-OG1 3.08Å; Q538-T611 PolarHBondContact O-N 2.93Å
539	L	89.6	Confident	89	Confident	69 Å²	69	40.5 Å²	40.5	36%	0.361	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	124.8	176.4	179.9	60.1	0	0	0	110.3	L519 G537 F542 K608 V610	L519-L539 HydrophobicContact CD1-CD2 3.66Å; L519-L539 HydrophobicContact CD1-CG 3.73Å; G537-L539 PolarHBondContact O-N 2.88Å; L539-F542 HydrophobicContact CD2-CE2 3.98Å; L539-F542 HydrophobicContact CD2-CZ 3.89Å; L539-K608 HydrophobicContact CD1-CB 3.7Å; L539-K608 HydrophobicContact CD1-CD 4.15Å; L539-K608 HydrophobicContact CD1-CG 3.8Å; L539-V610 HydrophobicContact CD1-CG1 4.16Å
540	V	88.9	Confident	88.8	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	-53.1	-176.9	-177.8	0	0	0	0	110.9	P528 V530 F565 V609 T611 V648	P528-V540 HydrophobicContact CB-CG1 3.67Å; V530-V540 HydrophobicContact CB-CG2 4.32Å; V530-V540 HydrophobicContact CG2-CG2 4.3Å; V540-F565 HydrophobicContact CG2-CD1 4.17Å; V540-F565 HydrophobicContact CG2-CE1 4.02Å; V540-V609 HydrophobicContact CB-CG1 4.28Å; V540-V609 PolarHBondContact N-O 2.83Å; V540-T611 HydrophobicContact CG2-CG2 4.22Å; V540-V648 HydrophobicContact CG1-CB 4.38Å; V540-V648 HydrophobicContact CG1-CG1 3.74Å; V540-V648 HydrophobicContact CG1-CG2 3.67Å
541	A	89	Confident	88.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	158.4	-178.8	0	0	0	0	0	111.4	V516 P528 V609 F646	V516-A541 HydrophobicContact CG1-CB 4Å; P528-A541 HydrophobicContact CB-CB 4.4Å; P528-A541 HydrophobicContact CG-CB 3.95Å; A541-V609 HydrophobicContact CB-CB 4.4Å; A541-V609 PolarHBondContact N-O 3.4Å; A541-V609 PolarHBondContact O-N 3.29Å; A541-F646 HydrophobicContact CB-CE2 4.47Å
542	F	89.3	Confident	88.1	Confident	62 Å²	62	39.9 Å²	39.9	27%	0.272	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	144.6	163.7	-74.9	-76.8	0	0	0	109.7	I517 L519 L539 I570 K608	I517-F542 HydrophobicContact CB-CB 4.17Å; I517-F542 PolarHBondContact N-O 2.82Å; I517-F542 PolarHBondContact O-N 3.08Å; L519-F542 HydrophobicContact CD1-CD2 4.34Å; L519-F542 HydrophobicContact CD1-CE2 4.14Å; L519-F542 HydrophobicContact CD2-CD2 4.27Å; L519-F542 HydrophobicContact CD2-CE2 3.99Å; L519-F542 HydrophobicContact CG-CD2 4.16Å; L519-F542 HydrophobicContact CG-CE2 4.2Å; L539-F542 HydrophobicContact CD2-CE2 3.98Å; L539-F542 HydrophobicContact CD2-CZ 3.89Å; F542-I570 HydrophobicContact CD1-CD1 3.72Å; F542-I570 HydrophobicContact CE1-CD1 3.64Å; F542-K608 HydrophobicContact CD1-CG 4.1Å; F542-K608 HydrophobicContact CE1-CD 4.46Å; F542-K608 HydrophobicContact CE1-CG 3.73Å
543	V	89.8	Confident	87.8	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	120.9	179.5	179.3	0	0	0	0	109.7	I514 K515 V516 F607 V609 I627	I514-V543 HydrophobicContact CG2-CG1 3.55Å; K515-V543 WeakPolarHBondContact O-CA 3.28Å; V516-V543 HydrophobicContact CB-CG2 4.47Å; V516-V543 HydrophobicContact CG1-CG2 4.18Å; V516-V543 HydrophobicContact CG2-CG2 4.16Å; V543-F607 HydrophobicContact CB-CB 4.46Å; V543-F607 PolarHBondContact N-O 3.42Å; V543-F607 PolarHBondContact O-N 3.16Å; V543-V609 HydrophobicContact CG2-CG2 3.55Å; V543-I627 HydrophobicContact CB-CD1 4.31Å; V543-I627 HydrophobicContact CG1-CD1 3.96Å; V543-I627 HydrophobicContact CG2-CD1 3.73Å
544	T	90.5	Very high	87.8	Confident	30 Å²	30	37.3 Å²	37.3	18%	0.184	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119.5	175.2	-58.6	0	0	0	0	108.4	K515 T546 T604 D606	K515-T544 PolarHBondContact N-O 2.85Å; K515-T544 PolarHBondContact O-N 2.96Å; T544-T546 HydrophobicContact CG2-CG2 4.02Å; T544-T604 HydrophobicContact CG2-CG2 4.05Å; T544-D606 VanDerWaalsContact CB-OD1 3.3Å; T544-D606 WeakPolarHBondContact CB-OD1 3.14Å; T544-D606 VanDerWaalsContact CG2-OD1 3.25Å; T544-D606 WeakPolarHBondContact CG2-OD1 3.19Å; T544-D606 PolarHBondContact OG1-OD1 2.73Å
545	A	91.1	Very high	87.8	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.1	168.1	0	0	0	0	0	109.4	Q513 I514 L556 T604 L605 C629	Q513-A545 CarbonylContact O-C 3.36Å; Q513-A545 WeakPolarHBondContact O-CA 3.38Å; I514-A545 HydrophobicContact CG1-CB 4.45Å; A545-L556 HydrophobicContact CB-CD1 3.95Å; A545-L556 WeakPolarHBondContact O-CD1 3.32Å; A545-T604 CarbonylContact O-C 3.04Å; A545-T604 VanDerWaalsContact O-CA 3.3Å; A545-T604 WeakPolarHBondContact O-CA 3.36Å; A545-L605 PolarHBondContact N-O 2.94Å; A545-L605 PolarHBondContact O-N 2.99Å; A545-C629 VanDerWaalsContact CB-SG 3.59Å
546	T	91.1	Very high	87.9	Confident	40 Å²	40	27.7 Å²	27.7	25%	0.245	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	138	178.6	52.3	0	0	0	0	110.8	Q513 T544 N603 T604	Q513-T546 PolarHBondContact N-O 2.75Å; Q513-T546 PolarHBondContact O-N 2.75Å; T544-T546 HydrophobicContact CG2-CG2 4.02Å; T546-N603 CarbonylContact C-O 3.57Å; T546-N603 VanDerWaalsContact CA-O 3.31Å; T546-N603 WeakPolarHBondContact CA-O 3.4Å; T546-T604 HydrophobicContact CG2-CG2 3.94Å
547	D	91	Very high	87.9	Confident	11 Å²	11	26.9 Å²	26.9	6%	0.059	17%	0.171	C	C	.	.			trans	-119	149.4	163.7	-137.2	-44.4	0	0	0	111.2	P512 L556 N603	P512-D547 WeakPolarHBondContact CA-OD2 3.15Å; P512-D547 WeakPolarHBondContact CD-OD2 2.99Å; P512-D547 WeakPolarHBondContact CG-OD2 3.16Å; P512-D547 VanDerWaalsContact N-OD2 3.12Å; D547-L556 HydrophobicContact CB-CD2 4.04Å; D547-L556 HydrophobicContact CB-CG 4.28Å; D547-N603 PolarHBondContact N-O 2.98Å; D547-N603 PolarHBondContact O-ND2 3.01Å
548	A	87.4	Confident	88	Confident	42 Å²	42	26.5 Å²	26.5	35%	0.347	16%	0.163	S	C	.	.			trans	-92.7	-45.7	-176.3	0	0	0	0	0	111.3	D470 E510	D470-A548 HydrophobicContact CB-CB 4.13Å; D470-A548 VanDerWaalsContact CG-C 3.45Å; D470-A548 VanDerWaalsContact CG-O 3.25Å; E510-A548 HydrophobicContact CB-CB 3.89Å; E510-A548 HydrophobicContact CG-CB 3.86Å
549	D	88	Confident	88.2	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-38.2	140	167.6	-73.8	-5.8	0	0	0	110.3	D470 N508 D509 E510 N553 G554 N603	D470-D549 PolarHBondContact OD2-N 3.01Å; N508-D549 VanDerWaalsContact C-OD2 3.31Å; N508-D549 WeakPolarHBondContact CA-OD2 3.25Å; N508-D549 PolarHBondContact ND2-OD2 2.75Å; D509-D549 PolarHBondContact N-OD1 3.49Å; D509-D549 PolarHBondContact N-OD2 2.68Å; E510-D549 WeakPolarHBondContact CB-OD1 3.2Å; E510-D549 PolarHBondContact N-OD1 2.77Å; D549-N553 HydrophobicContact CB-CB 3.66Å; D549-G554 WeakPolarHBondContact O-CA 3.37Å; D549-G554 PolarHBondContact O-N 2.86Å; D549-N603 PolarHBondContact O-ND2 3.33Å
550	S	81.5	Confident	88.4	Confident	20 Å²	20	28.3 Å²	28.3	14%	0.14	16%	0.164	C	C	.	.			trans	-107.7	146	-171.9	-58.1	0	0	0	0	115.4	Q474 K477 D506	Q474-S550 PolarHBondContact NE2-OG 3.13Å; K477-S550 VanDerWaalsContact CE-OG 3.24Å; K477-S550 WeakPolarHBondContact CE-OG 3.27Å; K477-S550 PolarHBondContact NZ-OG 3.35Å; D506-S550 VanDerWaalsContact CG-N 3.28Å; D506-S550 WeakPolarHBondContact OD1-CA 3.21Å; D506-S550 WeakPolarHBondContact OD1-CB 3.43Å; D506-S550 PolarHBondContact OD1-N 2.67Å; D506-S550 PolarHBondContact OD2-N 2.91Å; D506-S550 VanDerWaalsContact OD2-O 3.11Å
551	G	78.9	Confident	88.4	Confident	23 Å²	23	33.5 Å²	33.5	24%	0.237	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	-123.9	175.6	0	0	0	0	0	111.7	A555	G551-A555 PolarHBondContact O-N 3.42Å
552	P	81.7	Confident	88.5	Confident	49 Å²	49	34.2 Å²	34.2	32%	0.318	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-34.6	178.5	-17.7	32.8	0	0	0	112.9	A555 Q632 L634	P552-A555 WeakPolarHBondContact O-CB 3.19Å; P552-A555 PolarHBondContact O-N 2.8Å; P552-A555 VanDerWaalsContact O-N 3.12Å; P552-Q632 CarbonylContact O-C 3.6Å; P552-Q632 VanDerWaalsContact O-O 3.05Å; P552-L634 HydrophobicContact CB-CB 3.83Å; P552-L634 HydrophobicContact CB-CD1 4.08Å; P552-L634 HydrophobicContact CB-CG 4.08Å; P552-L634 HydrophobicContact CG-CB 4.07Å; P552-L634 HydrophobicContact CG-CD1 3.81Å; P552-L634 HydrophobicContact CG-CG 4.31Å
553	N	84.7	Confident	88.7	Confident	21 Å²	21	36.9 Å²	36.9	11%	0.112	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-46.7	179.5	-59.3	-9.5	0	0	0	109	D506 N508 D549 A555 D631	D506-N553 WeakPolarHBondContact OD2-CB 3.5Å; D506-N553 PolarHBondContact OD2-ND2 2.95Å; N508-N553 HydrophobicContact CB-CB 3.93Å; N508-N553 PolarHBondContact N-ND2 3.34Å; N508-N553 WeakPolarHBondContact OD1-CA 3.3Å; D549-N553 HydrophobicContact CB-CB 3.66Å; N553-A555 VanDerWaalsContact C-N 3.26Å; N553-A555 PolarHBondContact O-N 3.47Å; N553-D631 WeakPolarHBondContact O-CB 3.31Å
554	G	85.6	Confident	88.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	1.9	171.8	0	0	0	0	0	117.6	D549 L556 N603	D549-G554 WeakPolarHBondContact O-CA 3.37Å; D549-G554 PolarHBondContact O-N 2.86Å; G554-L556 PolarHBondContact O-N 3.04Å; G554-L556 VanDerWaalsContact O-N 3.11Å; G554-N603 WeakPolarHBondContact O-CA 3.3Å
555	A	86.9	Confident	89.1	Confident	23 Å²	23	38.3 Å²	38.3	19%	0.19	22%	0.223	C	C	.	.			trans	-78.9	101.9	-171.1	0	0	0	0	0	111.7	G551 P552 N553 D631 Q632	G551-A555 PolarHBondContact O-N 3.42Å; P552-A555 WeakPolarHBondContact O-CB 3.19Å; P552-A555 PolarHBondContact O-N 2.8Å; P552-A555 VanDerWaalsContact O-N 3.12Å; N553-A555 VanDerWaalsContact C-N 3.26Å; N553-A555 PolarHBondContact O-N 3.47Å; A555-D631 CarbonylContact O-C 3.57Å; A555-Q632 HydrophobicContact CB-CB 4.15Å; A555-Q632 WeakPolarHBondContact O-CB 3.41Å; A555-Q632 WeakPolarHBondContact O-CG 3.31Å; A555-Q632 PolarHBondContact O-N 2.79Å; A555-Q632 VanDerWaalsContact O-N 3.1Å
556	L	89.7	Confident	89.2	Confident	17 Å²	17	42.1 Å²	42.1	9%	0.089	24%	0.239	C	C	.	.			trans	-75.8	145.2	-170.7	-70.6	169.6	0	0	0	115.2	P512 A545 D547 G554 L605 C629 T630	P512-L556 HydrophobicContact CB-CD2 3.67Å; P512-L556 HydrophobicContact CG-CD2 3.94Å; A545-L556 HydrophobicContact CB-CD1 3.95Å; A545-L556 WeakPolarHBondContact O-CD1 3.32Å; D547-L556 HydrophobicContact CB-CD2 4.04Å; D547-L556 HydrophobicContact CB-CG 4.28Å; G554-L556 PolarHBondContact O-N 3.04Å; G554-L556 VanDerWaalsContact O-N 3.11Å; L556-L605 HydrophobicContact CB-CD1 3.5Å; L556-L605 VanDerWaalsContact CB-CD1 3.5Å; L556-L605 HydrophobicContact CB-CG 3.96Å; L556-L605 HydrophobicContact CD1-CB 4.46Å; L556-L605 HydrophobicContact CD1-CG 4.31Å; L556-L605 WeakPolarHBondContact O-CD1 2.98Å; L556-C629 HydrophobicContact CD2-CB 4.35Å; L556-T630 CarbonylContact C-O 3.59Å; L556-T630 WeakPolarHBondContact CA-O 3.42Å
557	S	91	Very high	89.3	Confident	45 Å²	45	41.9 Å²	41.9	32%	0.315	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	103.5	172.8	161.2	0	0	0	0	111.2	C629 T630 Q632	S557-C629 WeakPolarHBondContact O-CA 3.41Å; S557-T630 PolarHBondContact N-O 2.92Å; S557-T630 PolarHBondContact O-N 2.88Å; S557-Q632 VanDerWaalsContact CB-NE2 3.34Å
558	C	92.7	Very high	89.3	Confident	27 Å²	27	45.1 Å²	45.1	18%	0.182	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	147.1	-173.7	-58.9	0	0	0	0	114.2	L567 F607 T628 C629	C558-L567 HydrophobicContact CB-CD1 4.38Å; C558-F607 HydrophobicContact CB-CE2 3.77Å; C558-F607 HydrophobicContact CB-CZ 3.63Å; C558-T628 WeakPolarHBondContact CA-O 3.27Å; C558-C629 HydrophobicContact CB-CB 4.1Å; C558-C629 WeakPolarHBondContact CB-SG 3.47Å; C558-C629 WeakPolarHBondContact SG-CB 3.31Å; C558-C629 CovalentContact SG-SG 2.04Å; C558-C629 PolarHBondContact SG-SG 2.95Å
559	R	93.6	Very high	89.2	Confident	143 Å²	143	47.8 Å²	47.8	54%	0.54	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	158	172.1	62.5	176.9	-178.3	-99	-15.1	111.2	I627 T628	R559-I627 WeakPolarHBondContact O-CA 3.33Å; R559-T628 VanDerWaalsContact CG-OG1 3.28Å; R559-T628 WeakPolarHBondContact CG-OG1 3.32Å; R559-T628 PolarHBondContact N-O 3.38Å; R559-T628 PolarHBondContact NE-OG1 2.9Å; R559-T628 PolarHBondContact NH2-OG1 2.64Å; R559-T628 PolarHBondContact O-N 2.65Å
560	I	93.8	Very high	88.9	Confident	37 Å²	37	50.9 Å²	50.9	19%	0.19	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.2	177.2	-172.3	167.4	0	0	0	110.2	F565 L567 V609 I625 I627	I560-F565 HydrophobicContact CD1-CB 3.79Å; I560-L567 HydrophobicContact CB-CD1 4.01Å; I560-L567 HydrophobicContact CB-CG 3.92Å; I560-L567 HydrophobicContact CD1-CD2 4.44Å; I560-L567 HydrophobicContact CD1-CG 4.45Å; I560-L567 HydrophobicContact CG2-CD1 4.39Å; I560-L567 HydrophobicContact CG2-CG 4.05Å; I560-V609 HydrophobicContact CD1-CG1 4.2Å; I560-I625 HydrophobicContact CD1-CG2 3.61Å; I560-I625 HydrophobicContact CG1-CG2 3.69Å; I560-I627 HydrophobicContact CB-CG1 4.43Å; I560-I627 HydrophobicContact CD1-CG1 4.47Å; I560-I627 HydrophobicContact CG1-CG1 4.18Å
561	N	89.9	Confident	88	Confident	112 Å²	112	54.6 Å²	54.6	60%	0.599	29%	0.294	S	S	*	.	S	Bend	trans	-111.8	43.9	-171.8	-167	15.8	0	0	0	112	E626	N561-E626 HydrophobicContact CB-CB 4.06Å; N561-E626 PolarHBondContact N-O 3.39Å; N561-E626 PolarHBondContact ND2-OE1 3.08Å
562	N	91.3	Very high	86.7	Confident	16 Å²	16	62.1 Å²	62.1	9%	0.086	33%	0.328	C	S	.	.			trans	-146.1	125.7	169.7	-175	-44.3	0	0	0	108.8	K564 F565 E623 I624 I625	N562-K564 VanDerWaalsContact C-N 3.3Å; N562-K564 PolarHBondContact O-N 3.17Å; N562-K564 WeakPolarHBondContact OD1-CB 3.42Å; N562-K564 PolarHBondContact OD1-N 3.16Å; N562-F565 HydrophobicContact CB-CD2 4.15Å; N562-F565 PolarHBondContact O-N 3.16Å; N562-F565 VanDerWaalsContact O-O 3.11Å; N562-E623 PolarHBondContact ND2-OE2 3.46Å; N562-I624 PolarHBondContact ND2-O 3.05Å; N562-I625 HydrophobicContact CB-CG1 4.36Å
563	P	92.7	Very high	84.6	Confident	117 Å²	117	64.2 Å²	64.2	76%	0.76	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-17.3	-174.8	30.2	-36.5	0	0	0	114.6	F565 S612	P563-F565 VanDerWaalsContact C-N 3.28Å; P563-S612 PolarHBondContact O-OG 3.09Å
564	K	93.4	Very high	82	Confident	54 Å²	54	69.4 Å²	69.4	24%	0.235	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5	177.8	-61.5	-177.1	179	179.9	0	113.7	N562 S612 L615 E623	N562-K564 VanDerWaalsContact C-N 3.3Å; N562-K564 PolarHBondContact O-N 3.17Å; N562-K564 WeakPolarHBondContact OD1-CB 3.42Å; N562-K564 PolarHBondContact OD1-N 3.16Å; K564-S612 VanDerWaalsContact CA-OG 3.31Å; K564-S612 WeakPolarHBondContact CA-OG 3.29Å; K564-S612 PolarHBondContact O-N 3.24Å; K564-S612 PolarHBondContact O-OG 3.39Å; K564-S612 VanDerWaalsContact O-OG 3.06Å; K564-L615 HydrophobicContact CB-CD2 4Å; K564-L615 HydrophobicContact CD-CD2 3.78Å; K564-L615 HydrophobicContact CG-CD2 4.37Å; K564-E623 HydrophobicContact CD-CG 4.24Å; K564-E623 WeakPolarHBondContact CE-OE1 3.35Å; K564-E623 IonicContact NZ-OE1 2.71Å; K564-E623 PolarHBondContact NZ-OE1 2.8Å
565	F	95	Very high	79.3	Confident	7 Å²	7	74.2 Å²	74.2	3%	0.031	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	159.9	179.1	-54.9	-90.7	0	0	0	111.5	V540 I560 N562 P563 V609 V610 T611 S612 L615 E623 I625 V648	V540-F565 HydrophobicContact CG2-CD1 4.17Å; V540-F565 HydrophobicContact CG2-CE1 4.02Å; I560-F565 HydrophobicContact CD1-CB 3.79Å; N562-F565 HydrophobicContact CB-CD2 4.15Å; N562-F565 PolarHBondContact O-N 3.16Å; N562-F565 VanDerWaalsContact O-O 3.11Å; P563-F565 VanDerWaalsContact C-N 3.28Å; F565-V609 HydrophobicContact CB-CG1 4.31Å; F565-V609 HydrophobicContact CD1-CG1 4.36Å; F565-V610 CarbonylContact C-O 3.56Å; F565-V610 VanDerWaalsContact CA-O 3.3Å; F565-V610 WeakPolarHBondContact CA-O 3.28Å; F565-T611 HydrophobicContact CD1-CG2 4.22Å; F565-T611 HydrophobicContact CE1-CG2 3.98Å; F565-S612 PolarHBondContact N-OG 2.9Å; F565-S612 VanDerWaalsContact N-OG 3.14Å; F565-L615 HydrophobicContact CE1-CD1 4.37Å; F565-L615 HydrophobicContact CZ-CD1 4.27Å; F565-L615 HydrophobicContact CZ-CD2 4.43Å; F565-E623 HydrophobicContact CE2-CB 3.62Å; F565-E623 HydrophobicContact CE2-CG 3.81Å; F565-E623 HydrophobicContact CZ-CB 3.93Å; F565-E623 HydrophobicContact CZ-CG 4.08Å; F565-I625 HydrophobicContact CB-CD1 4.04Å; F565-I625 HydrophobicContact CD1-CD1 3.82Å; F565-I625 HydrophobicContact CD2-CD1 3.51Å; F565-I625 HydrophobicContact CD2-CG1 3.94Å; F565-I625 HydrophobicContact CE1-CD1 4.14Å; F565-I625 HydrophobicContact CE2-CD1 3.87Å; F565-I625 HydrophobicContact CE2-CG1 4.19Å; F565-I625 HydrophobicContact CG-CD1 3.49Å; F565-I625 VanDerWaalsContact CG-CD1 3.49Å; F565-I625 HydrophobicContact CG-CG1 4.38Å; F565-I625 HydrophobicContact CZ-CD1 4.17Å; F565-V648 HydrophobicContact CE1-CG1 4.19Å; F565-V648 HydrophobicContact CZ-CB 4.28Å; F565-V648 HydrophobicContact CZ-CG1 4.12Å
566	K	94	Very high	76.7	Confident	81 Å²	81	80.6 Å²	80.6	35%	0.352	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	156.5	174.9	55.2	169.4	169.9	156.3	0	111	E568 V610	K566-E568 HydrophobicContact CD-CG 4.4Å; K566-E568 WeakPolarHBondContact CE-OE1 3.28Å; K566-E568 IonicContact NZ-OE1 2.72Å; K566-E568 PolarHBondContact NZ-OE1 3.08Å; K566-V610 HydrophobicContact CD-CG2 4.02Å; K566-V610 VanDerWaalsContact CE-CG2 3.47Å; K566-V610 HydrophobicContact CG-CG2 3.55Å; K566-V610 PolarHBondContact N-O 3.26Å; K566-V610 PolarHBondContact O-N 2.82Å
567	L	92.4	Very high	73.9	Confident	35 Å²	35	85 Å²	85	18%	0.183	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.3	169.8	-65.4	171	0	0	0	109.6	C558 I560 F607 K608 V609 I627	C558-L567 HydrophobicContact CB-CD1 4.38Å; I560-L567 HydrophobicContact CB-CD1 4.01Å; I560-L567 HydrophobicContact CB-CG 3.92Å; I560-L567 HydrophobicContact CD1-CD2 4.44Å; I560-L567 HydrophobicContact CD1-CG 4.45Å; I560-L567 HydrophobicContact CG2-CD1 4.39Å; I560-L567 HydrophobicContact CG2-CG 4.05Å; L567-F607 HydrophobicContact CB-CB 4.47Å; L567-F607 HydrophobicContact CB-CD1 3.87Å; L567-F607 HydrophobicContact CB-CE1 4.46Å; L567-F607 HydrophobicContact CB-CG 4.36Å; L567-F607 HydrophobicContact CD2-CB 3.97Å; L567-F607 HydrophobicContact CD2-CG 4.27Å; L567-K608 WeakPolarHBondContact CA-O 3.25Å; L567-V609 HydrophobicContact CD2-CG2 3.77Å; L567-I627 HydrophobicContact CD1-CG2 4.33Å; L567-I627 HydrophobicContact CD2-CD1 3.93Å
568	E	90.6	Very high	70.9	Confident	79 Å²	79	90.9 Å²	90.9	37%	0.369	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	112.7	170.1	-64.3	-170.9	161.6	0	0	109.3	K566 I570 F607 K608 V610	K566-E568 HydrophobicContact CD-CG 4.4Å; K566-E568 WeakPolarHBondContact CE-OE1 3.28Å; K566-E568 IonicContact NZ-OE1 2.72Å; K566-E568 PolarHBondContact NZ-OE1 3.08Å; E568-I570 PolarHBondContact O-N 3.49Å; E568-F607 CarbonylContact O-C 3.27Å; E568-F607 WeakPolarHBondContact O-CA 3.17Å; E568-K608 HydrophobicContact CB-CB 4.41Å; E568-K608 PolarHBondContact N-O 3.45Å; E568-K608 PolarHBondContact O-N 2.67Å; E568-V610 HydrophobicContact CG-CG2 3.97Å
569	Q	85.5	Confident	68	Low	98 Å²	98	96.9 Å²	96.9	46%	0.458	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	131.2	-178.7	-173.1	-175.5	-1.4	0	0	111	T571 F607	Q569-T571 PolarHBondContact O-N 3.43Å; Q569-T571 VanDerWaalsContact O-N 3.08Å; Q569-F607 HydrophobicContact CB-CD1 4.06Å; Q569-F607 HydrophobicContact CB-CE1 4.06Å; Q569-F607 HydrophobicContact CG-CE1 4.34Å
570	I	82	Confident	65	Low	64 Å²	64	98.7 Å²	98.7	33%	0.328	55%	0.546	S	S	.	.			trans	-79.7	94.2	178.2	-55.1	-176.3	0	0	0	108.7	F542 E568 D606 K608	F542-I570 HydrophobicContact CD1-CD1 3.72Å; F542-I570 HydrophobicContact CE1-CD1 3.64Å; E568-I570 PolarHBondContact O-N 3.49Å; I570-D606 HydrophobicContact CB-CB 4.11Å; I570-D606 HydrophobicContact CD1-CB 4.14Å; I570-D606 HydrophobicContact CG1-CB 4.33Å; I570-D606 PolarHBondContact N-O 2.7Å; I570-K608 HydrophobicContact CD1-CG 4.03Å; I570-K608 HydrophobicContact CG1-CG 4.1Å
571	T	63.1	Low	61.9	Low	98 Å²	98	101.2 Å²	101.2	60%	0.601	57%	0.566	S	S	*	*			trans	-82.3	119.3	168.6	39	0	0	0	0	109.9	Q569 S573	Q569-T571 PolarHBondContact O-N 3.43Å; Q569-T571 VanDerWaalsContact O-N 3.08Å; T571-S573 PolarHBondContact O-N 3.39Å; T571-S573 PolarHBondContact O-OG 3.45Å
572	L	50.9	Low	59	Low	181 Å²	181	103 Å²	103	95%	0.948	58%	0.576	S	S	*	*			trans	-66.4	72	169.8	-83.7	161.7	0	0	0	110.5
573	S	38.9	Very low	56.2	Low	93 Å²	93	109 Å²	109	65%	0.65	61%	0.608	S	S	*	*			trans	-86.6	130.1	178.2	45.6	0	0	0	0	110.1	T571 S575	T571-S573 PolarHBondContact O-N 3.39Å; T571-S573 PolarHBondContact O-OG 3.45Å; S573-S575 PolarHBondContact O-N 3.2Å; S573-S575 VanDerWaalsContact O-N 3.13Å
574	S	29.2	Very low	53.1	Low	131 Å²	131	110.8 Å²	110.8	92%	0.916	61%	0.611	S	S	*	*			trans	-86.5	83.7	-165	40.2	0	0	0	0	113.6
575	S	29.4	Very low	50.1	Low	100 Å²	100	114.8 Å²	114.8	70%	0.699	63%	0.634	S	S	*	*			trans	-155.4	119.7	158.9	51.2	0	0	0	0	113.1	S573	S573-S575 PolarHBondContact O-N 3.2Å; S573-S575 VanDerWaalsContact O-N 3.13Å
576	I	31.3	Very low	46.8	Very low	157 Å²	157	122.4 Å²	122.4	81%	0.805	68%	0.675	S	S	*	*			trans	-103.5	115.4	163.5	-61.7	173.8	0	0	0	107.1
577	P	30.6	Very low	43.8	Very low	109 Å²	109	125.4 Å²	125.4	71%	0.708	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-76.1	144	161.9	-9	26.8	0	0	0	110
578	D	28.8	Very low	40.8	Very low	169 Å²	169	134 Å²	134	90%	0.904	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-58.1	137	-173.3	-67.5	-69.6	0	0	0	114.5
579	I	31.9	Very low	37.7	Very low	153 Å²	153	135.4 Å²	135.4	79%	0.785	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-86.2	126.7	175.6	-62.7	174.5	0	0	0	110.2
580	Q	30.2	Very low	35.1	Very low	182 Å²	182	139.5 Å²	139.5	85%	0.85	76%	0.755	S	S	*	*			trans	-119	115.9	153.8	-74	-163.1	-8	0	0	110.9
581	S	29.5	Very low	32.5	Very low	89 Å²	89	144.8 Å²	144.8	62%	0.622	78%	0.779	S	S	*	*			trans	37.1	109.4	155.6	60.1	0	0	0	0	119.1
582	N	29.4	Very low	30.9	Very low	150 Å²	150	146.1 Å²	146.1	80%	0.802	79%	0.789	S	S	*	*				-165.6	172	91.4	-98.9	-47.5	0	0	0	113
583	N	31.6	Very low	29.8	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	79%	0.787	S	S	*	*			trans	-79.5	168.4	-163.9	-61.3	-37.8	0	0	0	115.1
584	N	27.6	Very low	29.3	Very low	153 Å²	153	146.2 Å²	146.2	82%	0.818	79%	0.791	S	S	*	*			trans	78.3	75.4	163.2	-58	-7.5	0	0	0	117.5
585	L	30	Very low	29.2	Very low	138 Å²	138	145.9 Å²	145.9	72%	0.723	79%	0.788	S	S	*	*			trans	-160.8	114.7	139.3	-108.2	154.5	0	0	0	109.6	F587	L585-F587 VanDerWaalsContact C-N 3.31Å; L585-F587 HydrophobicContact CB-CD2 3.95Å; L585-F587 HydrophobicContact CB-CE2 3.89Å; L585-F587 HydrophobicContact CD1-CE2 4.04Å; L585-F587 HydrophobicContact CD2-CD2 4.42Å; L585-F587 HydrophobicContact CD2-CE2 3.96Å; L585-F587 HydrophobicContact CD2-CZ 4.36Å; L585-F587 HydrophobicContact CG-CE2 4.17Å; L585-F587 PolarHBondContact O-N 2.8Å
586	N	26.9	Very low	29.2	Very low	167 Å²	167	150.1 Å²	150.1	89%	0.893	80%	0.797	S	S	*	*			trans	-79.4	79.8	174.6	-76.8	0.1	0	0	0	109.5
587	F	29.6	Very low	29	Very low	144 Å²	144	146.5 Å²	146.5	63%	0.632	79%	0.786	S	S	*	*			trans	-71.9	140.5	166.3	-82.5	-80.3	0	0	0	110.5	L519 L585 S589	L519-F587 HydrophobicContact CD2-CE1 4.3Å; L585-F587 VanDerWaalsContact C-N 3.31Å; L585-F587 HydrophobicContact CB-CD2 3.95Å; L585-F587 HydrophobicContact CB-CE2 3.89Å; L585-F587 HydrophobicContact CD1-CE2 4.04Å; L585-F587 HydrophobicContact CD2-CD2 4.42Å; L585-F587 HydrophobicContact CD2-CE2 3.96Å; L585-F587 HydrophobicContact CD2-CZ 4.36Å; L585-F587 HydrophobicContact CG-CE2 4.17Å; L585-F587 PolarHBondContact O-N 2.8Å; F587-S589 PolarHBondContact O-N 2.91Å; F587-S589 VanDerWaalsContact O-N 3.12Å
588	Y	29.5	Very low	29	Very low	215 Å²	215	150 Å²	150	84%	0.843	80%	0.798	S	S	*	*			trans	-62.6	112.1	172.3	-70.7	-84.8	0	0	0	109.9	F590	Y588-F590 PolarHBondContact O-N 3.12Å
589	S	26.5	Very low	29.5	Very low	109 Å²	109	151.8 Å²	151.8	76%	0.762	80%	0.797	S	S	*	*			trans	-77.1	101.1	176.3	55.3	0	0	0	0	110.4	F587 E591	F587-S589 PolarHBondContact O-N 2.91Å; F587-S589 VanDerWaalsContact O-N 3.12Å; S589-E591 PolarHBondContact O-N 3.07Å
590	F	29.7	Very low	30.1	Very low	184 Å²	184	150 Å²	150	81%	0.807	79%	0.785	S	S	*	*			trans	-64.1	118.1	158	-70.3	-91	0	0	0	108.1	Y588	Y588-F590 PolarHBondContact O-N 3.12Å
591	E	28.1	Very low	31.1	Very low	176 Å²	176	144 Å²	144	82%	0.822	76%	0.762	S	S	*	*			trans	-67.5	129.5	175.5	-68.5	-167.4	137.1	0	0	109.9	S589 L593	S589-E591 PolarHBondContact O-N 3.07Å; E591-L593 PolarHBondContact O-N 3.03Å; E591-L593 VanDerWaalsContact O-N 3.13Å
592	P	30.1	Very low	32.7	Very low	126 Å²	126	144.5 Å²	144.5	82%	0.818	76%	0.757	S	S	*	*			trans	-73.9	107.9	179.9	29.1	-33.2	0	0	0	110.2	S594	P592-S594 PolarHBondContact O-N 2.76Å
593	L	27.8	Very low	34.9	Very low	172 Å²	172	137.8 Å²	137.8	90%	0.901	72%	0.721	S	S	*	*			trans	-54.6	134.3	168.8	-77.8	169.2	0	0	0	110.2	E591 S595	E591-L593 PolarHBondContact O-N 3.03Å; E591-L593 VanDerWaalsContact O-N 3.13Å; L593-S595 PolarHBondContact O-N 3.04Å
594	S	28.3	Very low	37.5	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	71%	0.705	S	S	*	*			trans	-61.2	129.3	-169.3	56	0	0	0	0	112.5	P592 Q596	P592-S594 PolarHBondContact O-N 2.76Å; S594-Q596 PolarHBondContact O-N 2.88Å
595	S	26.3	Very low	40.3	Very low	123 Å²	123	127.6 Å²	127.6	86%	0.86	67%	0.669	S	S	*	*	S	Bend	trans	-66.1	88.4	-173.5	58.7	0	0	0	0	113.7	L593	L593-S595 PolarHBondContact O-N 3.04Å
596	Q	28.8	Very low	43.1	Very low	189 Å²	189	124.2 Å²	124.2	88%	0.883	65%	0.652	S	S	*	*			trans	-150	19.5	176.1	-129.1	169.5	36.1	0	0	117.7	S594	S594-Q596 PolarHBondContact O-N 2.88Å
597	S	28.3	Very low	46.1	Very low	82 Å²	82	117 Å²	117	57%	0.573	61%	0.613	S	S	*	*			trans	-135.5	43.1	179.2	56.2	0	0	0	0	115	K599	S597-K599 PolarHBondContact O-N 2.87Å
598	L	31	Very low	49	Very low	183 Å²	183	114 Å²	114	96%	0.958	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	62.8	179.4	-101.1	167.1	0	0	0	113.9
599	K	38.5	Very low	52	Low	205 Å²	205	103.8 Å²	103.8	89%	0.891	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-165	14.4	163.7	-122.6	173.4	-174.1	-178	0	117.7	S597	S597-K599 PolarHBondContact O-N 2.87Å
600	E	44.7	Very low	55.2	Low	116 Å²	116	98.8 Å²	98.8	54%	0.542	52%	0.524	S	S	.	.	S	Bend	trans	-90.5	154.8	179.3	-77.4	172.2	167.1	0	0	112.2
601	P	50.6	Low	58.3	Low	56 Å²	56	90.1 Å²	90.1	36%	0.364	49%	0.486	S	S	.	.			trans	-65.3	149.6	-176.1	28.8	-38.1	0	0	0	112.3	N603	P601-N603 WeakPolarHBondContact CG-OD1 3.4Å; P601-N603 PolarHBondContact O-N 2.6Å
602	L	62.8	Low	61.4	Low	99 Å²	99	83.6 Å²	83.6	52%	0.518	46%	0.46	S	S	.	.			trans	-82.9	65.8	175.3	-69.8	93.2	0	0	0	111.4	T604 L605	L602-T604 PolarHBondContact O-N 2.9Å; L602-T604 VanDerWaalsContact O-N 3.13Å; L602-L605 HydrophobicContact CB-CD2 3.84Å; L602-L605 HydrophobicContact CD2-CD2 3.55Å; L602-L605 HydrophobicContact CG-CD2 4.33Å
603	N	75.8	Confident	64.4	Low	9 Å²	9	80.4 Å²	80.4	5%	0.048	44%	0.438	C	S	.	.	S	Bend	trans	-57.8	-7	159.2	-82.3	57	0	0	0	113.3	Q474 T546 D547 D549 G554 P601	Q474-N603 PolarHBondContact NE2-ND2 2.87Å; Q474-N603 VanDerWaalsContact NE2-ND2 3.14Å; T546-N603 CarbonylContact C-O 3.57Å; T546-N603 VanDerWaalsContact CA-O 3.31Å; T546-N603 WeakPolarHBondContact CA-O 3.4Å; D547-N603 PolarHBondContact N-O 2.98Å; D547-N603 PolarHBondContact O-ND2 3.01Å; D549-N603 PolarHBondContact O-ND2 3.33Å; G554-N603 WeakPolarHBondContact O-CA 3.3Å; P601-N603 WeakPolarHBondContact CG-OD1 3.4Å; P601-N603 PolarHBondContact O-N 2.6Å
604	T	86	Confident	67.4	Low	68 Å²	68	77.2 Å²	77.2	42%	0.417	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	131.2	176.1	-58.8	0	0	0	0	109.2	T544 A545 T546 L602	T544-T604 HydrophobicContact CG2-CG2 4.05Å; A545-T604 CarbonylContact O-C 3.04Å; A545-T604 VanDerWaalsContact O-CA 3.3Å; A545-T604 WeakPolarHBondContact O-CA 3.36Å; T546-T604 HydrophobicContact CG2-CG2 3.94Å; L602-T604 PolarHBondContact O-N 2.9Å; L602-T604 VanDerWaalsContact O-N 3.13Å
605	L	87.3	Confident	70.5	Confident	14 Å²	14	72.6 Å²	72.6	7%	0.073	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	116.1	175.6	-68.6	-179.2	0	0	0	110.2	A545 L556 L602 F607	A545-L605 PolarHBondContact N-O 2.94Å; A545-L605 PolarHBondContact O-N 2.99Å; L556-L605 HydrophobicContact CB-CD1 3.5Å; L556-L605 VanDerWaalsContact CB-CD1 3.5Å; L556-L605 HydrophobicContact CB-CG 3.96Å; L556-L605 HydrophobicContact CD1-CB 4.46Å; L556-L605 HydrophobicContact CD1-CG 4.31Å; L556-L605 WeakPolarHBondContact O-CD1 2.98Å; L602-L605 HydrophobicContact CB-CD2 3.84Å; L602-L605 HydrophobicContact CD2-CD2 3.55Å; L602-L605 HydrophobicContact CG-CD2 4.33Å; L605-F607 HydrophobicContact CB-CD2 4.34Å; L605-F607 HydrophobicContact CB-CE2 3.48Å; L605-F607 VanDerWaalsContact CB-CE2 3.48Å; L605-F607 HydrophobicContact CB-CZ 3.75Å; L605-F607 HydrophobicContact CD1-CE2 4.25Å; L605-F607 HydrophobicContact CD1-CZ 3.82Å; L605-F607 HydrophobicContact CG-CZ 4.38Å
606	D	88.5	Confident	73.6	Confident	68 Å²	68	69.8 Å²	69.8	36%	0.364	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134.6	171.3	-66	-55.7	0	0	0	111.3	T544 I570	T544-D606 VanDerWaalsContact CB-OD1 3.3Å; T544-D606 WeakPolarHBondContact CB-OD1 3.14Å; T544-D606 VanDerWaalsContact CG2-OD1 3.25Å; T544-D606 WeakPolarHBondContact CG2-OD1 3.19Å; T544-D606 PolarHBondContact OG1-OD1 2.73Å; I570-D606 HydrophobicContact CB-CB 4.11Å; I570-D606 HydrophobicContact CD1-CB 4.14Å; I570-D606 HydrophobicContact CG1-CB 4.33Å; I570-D606 PolarHBondContact N-O 2.7Å
607	F	90.3	Very high	76.6	Confident	16 Å²	16	61.6 Å²	61.6	7%	0.07	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	152.6	179	-57.2	-87.5	0	0	0	111.4	V543 C558 L567 E568 Q569 L605	V543-F607 HydrophobicContact CB-CB 4.46Å; V543-F607 PolarHBondContact N-O 3.42Å; V543-F607 PolarHBondContact O-N 3.16Å; C558-F607 HydrophobicContact CB-CE2 3.77Å; C558-F607 HydrophobicContact CB-CZ 3.63Å; L567-F607 HydrophobicContact CB-CB 4.47Å; L567-F607 HydrophobicContact CB-CD1 3.87Å; L567-F607 HydrophobicContact CB-CE1 4.46Å; L567-F607 HydrophobicContact CB-CG 4.36Å; L567-F607 HydrophobicContact CD2-CB 3.97Å; L567-F607 HydrophobicContact CD2-CG 4.27Å; E568-F607 CarbonylContact O-C 3.27Å; E568-F607 WeakPolarHBondContact O-CA 3.17Å; Q569-F607 HydrophobicContact CB-CD1 4.06Å; Q569-F607 HydrophobicContact CB-CE1 4.06Å; Q569-F607 HydrophobicContact CG-CE1 4.34Å; L605-F607 HydrophobicContact CB-CD2 4.34Å; L605-F607 HydrophobicContact CB-CE2 3.48Å; L605-F607 VanDerWaalsContact CB-CE2 3.48Å; L605-F607 HydrophobicContact CB-CZ 3.75Å; L605-F607 HydrophobicContact CD1-CE2 4.25Å; L605-F607 HydrophobicContact CD1-CZ 3.82Å; L605-F607 HydrophobicContact CG-CZ 4.38Å
608	K	91	Very high	79.5	Confident	81 Å²	81	60.6 Å²	60.6	35%	0.352	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.5	156	-65	172.2	-176.8	175.6	0	108.6	L539 F542 L567 E568 I570 V610	L539-K608 HydrophobicContact CD1-CB 3.7Å; L539-K608 HydrophobicContact CD1-CD 4.15Å; L539-K608 HydrophobicContact CD1-CG 3.8Å; F542-K608 HydrophobicContact CD1-CG 4.1Å; F542-K608 HydrophobicContact CE1-CD 4.46Å; F542-K608 HydrophobicContact CE1-CG 3.73Å; L567-K608 WeakPolarHBondContact CA-O 3.25Å; E568-K608 HydrophobicContact CB-CB 4.41Å; E568-K608 PolarHBondContact N-O 3.45Å; E568-K608 PolarHBondContact O-N 2.67Å; I570-K608 HydrophobicContact CD1-CG 4.03Å; I570-K608 HydrophobicContact CG1-CG 4.1Å; K608-V610 HydrophobicContact CB-CG1 3.83Å
609	V	91.9	Very high	82.4	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	120.5	160.1	177.3	0	0	0	0	106.8	V540 A541 V543 I560 F565 L567 I625 I627 F646	V540-V609 HydrophobicContact CB-CG1 4.28Å; V540-V609 PolarHBondContact N-O 2.83Å; A541-V609 HydrophobicContact CB-CB 4.4Å; A541-V609 PolarHBondContact N-O 3.4Å; A541-V609 PolarHBondContact O-N 3.29Å; V543-V609 HydrophobicContact CG2-CG2 3.55Å; I560-V609 HydrophobicContact CD1-CG1 4.2Å; F565-V609 HydrophobicContact CB-CG1 4.31Å; F565-V609 HydrophobicContact CD1-CG1 4.36Å; L567-V609 HydrophobicContact CD2-CG2 3.77Å; V609-I625 HydrophobicContact CG1-CD1 4.02Å; V609-I627 HydrophobicContact CG2-CD1 3.89Å; V609-F646 HydrophobicContact CG1-CZ 4.32Å; V609-F646 HydrophobicContact CG2-CZ 4.16Å
610	V	93.2	Very high	84.8	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.018	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.6	178.6	-49.6	0	0	0	0	111.2	Q538 L539 F565 K566 E568 K608	Q538-V610 CarbonylContact O-C 3.51Å; Q538-V610 WeakPolarHBondContact O-CA 3.37Å; Q538-V610 VanDerWaalsContact O-CB 3.27Å; Q538-V610 WeakPolarHBondContact O-CB 3.34Å; L539-V610 HydrophobicContact CD1-CG1 4.16Å; F565-V610 CarbonylContact C-O 3.56Å; F565-V610 VanDerWaalsContact CA-O 3.3Å; F565-V610 WeakPolarHBondContact CA-O 3.28Å; K566-V610 HydrophobicContact CD-CG2 4.02Å; K566-V610 VanDerWaalsContact CE-CG2 3.47Å; K566-V610 HydrophobicContact CG-CG2 3.55Å; K566-V610 PolarHBondContact N-O 3.26Å; K566-V610 PolarHBondContact O-N 2.82Å; E568-V610 HydrophobicContact CG-CG2 3.97Å; K608-V610 HydrophobicContact CB-CG1 3.83Å
611	T	94.4	Very high	86.8	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.012	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	141.7	174.4	59.6	0	0	0	0	111.6	V530 G537 Q538 V540 F565 L615	V530-T611 HydrophobicContact CG2-CG2 4.07Å; G537-T611 WeakPolarHBondContact CA-O 3.25Å; G537-T611 PolarHBondContact N-O 2.93Å; G537-T611 PolarHBondContact N-OG1 3.06Å; Q538-T611 HydrophobicContact CB-CG2 4.19Å; Q538-T611 PolarHBondContact N-OG1 3.46Å; Q538-T611 VanDerWaalsContact N-OG1 3.08Å; Q538-T611 PolarHBondContact O-N 2.93Å; V540-T611 HydrophobicContact CG2-CG2 4.22Å; F565-T611 HydrophobicContact CD1-CG2 4.22Å; F565-T611 HydrophobicContact CE1-CG2 3.98Å; T611-L615 HydrophobicContact CG2-CD1 3.73Å; T611-L615 HydrophobicContact CG2-CG 4.29Å
612	S	93.2	Very high	88.6	Confident	39 Å²	39	49.8 Å²	49.8	27%	0.273	27%	0.266	S	S	.	.	S	Bend	trans	-106.5	-24.2	173.6	61	0	0	0	0	112.5	P563 K564 F565	P563-S612 PolarHBondContact O-OG 3.09Å; K564-S612 VanDerWaalsContact CA-OG 3.31Å; K564-S612 WeakPolarHBondContact CA-OG 3.29Å; K564-S612 PolarHBondContact O-N 3.24Å; K564-S612 PolarHBondContact O-OG 3.39Å; K564-S612 VanDerWaalsContact O-OG 3.06Å; F565-S612 PolarHBondContact N-OG 2.9Å; F565-S612 VanDerWaalsContact N-OG 3.14Å
613	T	93.2	Very high	90	Very high	59 Å²	59	46.1 Å²	46.1	36%	0.362	25%	0.246	S	C	.	.	S	Bend	trans	-119.1	170.3	173.1	65	0	0	0	0	110.2
614	E	91.6	Very high	90.7	Very high	106 Å²	106	50.2 Å²	50.2	50%	0.495	27%	0.267	S	S	.	.			trans	-65.2	158.2	157	-67.3	165.8	169.5	0	0	108.8	Q535 P536	Q535-E614 PolarHBondContact NE2-OE1 3.15Å; P536-E614 HydrophobicContact CG-CG 4.41Å
615	L	93	Very high	91	Very high	7 Å²	7	47 Å²	47	4%	0.037	25%	0.247	C	C	.	.			trans	-122.3	151.1	-178.7	-62.6	178.5	0	0	0	109.3	V530 E532 N533 K564 F565 T611 I650	V530-L615 HydrophobicContact CG1-CD1 3.47Å; V530-L615 VanDerWaalsContact CG1-CD1 3.47Å; V530-L615 HydrophobicContact CG2-CD1 4.27Å; E532-L615 WeakPolarHBondContact CB-O 3.5Å; N533-L615 PolarHBondContact N-O 3.32Å; K564-L615 HydrophobicContact CB-CD2 4Å; K564-L615 HydrophobicContact CD-CD2 3.78Å; K564-L615 HydrophobicContact CG-CD2 4.37Å; F565-L615 HydrophobicContact CE1-CD1 4.37Å; F565-L615 HydrophobicContact CZ-CD1 4.27Å; F565-L615 HydrophobicContact CZ-CD2 4.43Å; T611-L615 HydrophobicContact CG2-CD1 3.73Å; T611-L615 HydrophobicContact CG2-CG 4.29Å; L615-I650 HydrophobicContact CB-CD1 4.19Å; L615-I650 HydrophobicContact CD1-CD1 4.11Å; L615-I650 HydrophobicContact CD1-CG1 4.21Å; L615-I650 HydrophobicContact CD2-CD1 4.27Å; L615-I650 HydrophobicContact CG-CD1 4.44Å
616	D	92.2	Very high	91.3	Very high	64 Å²	64	47.5 Å²	47.5	34%	0.342	25%	0.249	S	C	.	.			trans	-142.8	122.7	-172.7	163.7	-35.6	0	0	0	105.4	E618 L619 S620	D616-E618 PolarHBondContact OD1-N 2.99Å; D616-L619 HydrophobicContact CB-CD1 4.39Å; D616-L619 VanDerWaalsContact OD1-CB 3.22Å; D616-L619 WeakPolarHBondContact OD1-CB 2.98Å; D616-L619 VanDerWaalsContact OD1-CG 3.23Å; D616-L619 WeakPolarHBondContact OD1-CG 3.07Å; D616-L619 PolarHBondContact OD1-N 2.9Å; D616-L619 VanDerWaalsContact OD2-CD1 3.22Å; D616-L619 WeakPolarHBondContact OD2-CD1 3.49Å; D616-L619 WeakPolarHBondContact OD2-CG 3.12Å; D616-S620 PolarHBondContact O-N 2.89Å
617	R	91.3	Very high	91.5	Very high	16 Å²	16	44.3 Å²	44.3	6%	0.06	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-25.2	-170.1	-167.9	-152.6	56.2	58.9	-5.6	112.4	E532 L619 S620 T621 I650 D652 P687 Y689	E532-R617 VanDerWaalsContact CD-CB 3.43Å; E532-R617 WeakPolarHBondContact OE1-CB 3.23Å; E532-R617 IonicContact OE1-NE 2.72Å; E532-R617 WeakPolarHBondContact OE2-CB 3.24Å; E532-R617 PolarHBondContact OE2-N 2.88Å; R617-L619 VanDerWaalsContact C-N 3.31Å; R617-S620 WeakPolarHBondContact CA-O 3.24Å; R617-S620 CarbonylContact O-C 3.46Å; R617-S620 VanDerWaalsContact O-C 3.32Å; R617-S620 PolarHBondContact O-N 3.28Å; R617-T621 HydrophobicContact CG-CG2 4.06Å; R617-T621 PolarHBondContact O-N 3.43Å; R617-I650 HydrophobicContact CB-CG2 3.75Å; R617-I650 HydrophobicContact CG-CB 4.27Å; R617-I650 HydrophobicContact CG-CG2 3.92Å; R617-D652 IonicContact CZ-OD1 3.46Å; R617-D652 IonicContact NE-OD1 3.43Å; R617-D652 PolarHBondContact NE-OD1 2.65Å; R617-D652 IonicContact NH2-OD1 2.68Å; R617-D652 PolarHBondContact NH2-OD1 3.32Å; R617-D652 VanDerWaalsContact NH2-OD1 3.17Å; R617-P687 PolarHBondContact NH2-O 2.96Å; R617-Y689 VanDerWaalsContact CZ-CB 3.41Å
618	E	89.9	Confident	91.7	Very high	61 Å²	61	43.7 Å²	43.7	29%	0.285	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-34.5	176.3	-68.4	61.6	-127.1	0	0	110.3	D616 P687	D616-E618 PolarHBondContact OD1-N 2.99Å; E618-P687 HydrophobicContact CG-CB 3.8Å; E618-P687 HydrophobicContact CG-CG 4.09Å
619	L	90.1	Very high	91.8	Very high	143 Å²	143	39.9 Å²	39.9	75%	0.749	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-33.6	168.8	-66.1	179.9	0	0	0	113.2	D616 R617	D616-L619 HydrophobicContact CB-CD1 4.39Å; D616-L619 VanDerWaalsContact OD1-CB 3.22Å; D616-L619 WeakPolarHBondContact OD1-CB 2.98Å; D616-L619 VanDerWaalsContact OD1-CG 3.23Å; D616-L619 WeakPolarHBondContact OD1-CG 3.07Å; D616-L619 PolarHBondContact OD1-N 2.9Å; D616-L619 VanDerWaalsContact OD2-CD1 3.22Å; D616-L619 WeakPolarHBondContact OD2-CD1 3.49Å; D616-L619 WeakPolarHBondContact OD2-CG 3.12Å; R617-L619 VanDerWaalsContact C-N 3.31Å
620	S	89.7	Confident	91.8	Very high	25 Å²	25	40.9 Å²	40.9	18%	0.175	22%	0.219	C	C	.	.			trans	-156.9	111.1	-177.3	-169.7	0	0	0	0	113.6	D616 R617 I622 E623 I650	D616-S620 PolarHBondContact O-N 2.89Å; R617-S620 WeakPolarHBondContact CA-O 3.24Å; R617-S620 CarbonylContact O-C 3.46Å; R617-S620 VanDerWaalsContact O-C 3.32Å; R617-S620 PolarHBondContact O-N 3.28Å; S620-I622 PolarHBondContact OG-O 3.24Å; S620-E623 VanDerWaalsContact CB-OE1 3.27Å; S620-E623 WeakPolarHBondContact CB-OE1 3.15Å; S620-E623 PolarHBondContact OG-OE1 2.78Å; S620-I650 VanDerWaalsContact O-CD1 3.29Å; S620-I650 WeakPolarHBondContact O-CD1 3.4Å
621	T	86	Confident	91.7	Very high	76 Å²	76	40.8 Å²	40.8	47%	0.466	22%	0.219	S	C	.	.	S	Bend	trans	-79.7	-23.9	177.4	50.4	0	0	0	0	114.1	R617 I650	R617-T621 HydrophobicContact CG-CG2 4.06Å; R617-T621 PolarHBondContact O-N 3.43Å; T621-I650 PolarHBondContact O-N 3.3Å
622	I	89.7	Confident	91.1	Very high	90 Å²	90	46 Å²	46	46%	0.462	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	123.5	-176.6	-57.5	178.8	0	0	0	109.1	S620 Y647 V648	S620-I622 PolarHBondContact OG-O 3.24Å; I622-Y647 HydrophobicContact CG2-CD1 3.99Å; I622-Y647 HydrophobicContact CG2-CG 4.32Å; I622-V648 WeakPolarHBondContact CA-O 3.47Å
623	E	91.6	Very high	90.3	Very high	21 Å²	21	45 Å²	45	10%	0.098	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	135.3	171.7	-72.4	-66.5	143.4	0	0	110.8	N562 K564 F565 S620 Y647 V648 I650	N562-E623 PolarHBondContact ND2-OE2 3.46Å; K564-E623 HydrophobicContact CD-CG 4.24Å; K564-E623 WeakPolarHBondContact CE-OE1 3.35Å; K564-E623 IonicContact NZ-OE1 2.71Å; K564-E623 PolarHBondContact NZ-OE1 2.8Å; F565-E623 HydrophobicContact CE2-CB 3.62Å; F565-E623 HydrophobicContact CE2-CG 3.81Å; F565-E623 HydrophobicContact CZ-CB 3.93Å; F565-E623 HydrophobicContact CZ-CG 4.08Å; S620-E623 VanDerWaalsContact CB-OE1 3.27Å; S620-E623 WeakPolarHBondContact CB-OE1 3.15Å; S620-E623 PolarHBondContact OG-OE1 2.78Å; E623-Y647 WeakPolarHBondContact O-CA 3.31Å; E623-V648 HydrophobicContact CB-CB 4.43Å; E623-V648 PolarHBondContact N-O 3.2Å; E623-V648 PolarHBondContact O-N 3.14Å; E623-I650 HydrophobicContact CG-CD1 3.8Å
624	I	91.2	Very high	89.1	Confident	96 Å²	96	48.4 Å²	48.4	49%	0.492	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128.1	173.5	-46.6	-176.2	0	0	0	108.1	N562 Y647	N562-I624 PolarHBondContact ND2-O 3.05Å; I624-Y647 HydrophobicContact CD1-CE1 4.1Å; I624-Y647 HydrophobicContact CG1-CD1 3.99Å; I624-Y647 HydrophobicContact CG1-CE1 3.91Å; I624-Y647 HydrophobicContact CG2-CD1 4.45Å; I624-Y647 HydrophobicContact CG2-CE1 4.19Å
625	I	91.8	Very high	87.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.2	175.6	-60	-173.1	0	0	0	109.1	I560 N562 F565 V609 I627 Q645 F646 V648	I560-I625 HydrophobicContact CD1-CG2 3.61Å; I560-I625 HydrophobicContact CG1-CG2 3.69Å; N562-I625 HydrophobicContact CB-CG1 4.36Å; F565-I625 HydrophobicContact CB-CD1 4.04Å; F565-I625 HydrophobicContact CD1-CD1 3.82Å; F565-I625 HydrophobicContact CD2-CD1 3.51Å; F565-I625 HydrophobicContact CD2-CG1 3.94Å; F565-I625 HydrophobicContact CE1-CD1 4.14Å; F565-I625 HydrophobicContact CE2-CD1 3.87Å; F565-I625 HydrophobicContact CE2-CG1 4.19Å; F565-I625 HydrophobicContact CG-CD1 3.49Å; F565-I625 VanDerWaalsContact CG-CD1 3.49Å; F565-I625 HydrophobicContact CG-CG1 4.38Å; F565-I625 HydrophobicContact CZ-CD1 4.17Å; V609-I625 HydrophobicContact CG1-CD1 4.02Å; I625-I627 HydrophobicContact CG2-CG1 4.09Å; I625-Q645 WeakPolarHBondContact O-CA 3.36Å; I625-F646 HydrophobicContact CB-CD1 4.25Å; I625-F646 HydrophobicContact CB-CE1 3.83Å; I625-F646 HydrophobicContact CB-CE2 4.23Å; I625-F646 HydrophobicContact CB-CZ 3.82Å; I625-F646 HydrophobicContact CD1-CE2 4.05Å; I625-F646 HydrophobicContact CD1-CZ 3.9Å; I625-F646 HydrophobicContact CG1-CZ 4.41Å; I625-F646 HydrophobicContact CG2-CD1 4.34Å; I625-F646 HydrophobicContact CG2-CE1 3.55Å; I625-F646 HydrophobicContact CG2-CZ 3.69Å; I625-F646 PolarHBondContact N-O 3.11Å; I625-F646 PolarHBondContact O-N 3.16Å; I625-V648 HydrophobicContact CD1-CG2 3.45Å; I625-V648 VanDerWaalsContact CD1-CG2 3.45Å; I625-V648 HydrophobicContact CG1-CG2 4.08Å
626	E	92.9	Very high	86.2	Confident	25 Å²	25	53.3 Å²	53.3	12%	0.117	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132.2	162.6	178.7	-175.2	62.4	0	0	109.4	N561 T628 R643 T644 Q645	N561-E626 HydrophobicContact CB-CB 4.06Å; N561-E626 PolarHBondContact N-O 3.39Å; N561-E626 PolarHBondContact ND2-OE1 3.08Å; E626-T628 HydrophobicContact CG-CG2 3.76Å; E626-R643 IonicContact OE2-NH1 2.77Å; E626-R643 PolarHBondContact OE2-NH1 3.14Å; E626-T644 WeakPolarHBondContact CA-O 3.15Å; E626-Q645 HydrophobicContact CB-CG 3.82Å; E626-Q645 HydrophobicContact CG-CG 3.85Å; E626-Q645 PolarHBondContact OE2-NE2 3.16Å
627	I	93.7	Very high	84.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.4	167.9	-62.4	172.2	0	0	0	107.5	I514 V543 R559 I560 L567 V609 I625 R643 T644 F646	I514-I627 HydrophobicContact CD1-CG2 4.32Å; I514-I627 HydrophobicContact CG2-CG2 4.36Å; V543-I627 HydrophobicContact CB-CD1 4.31Å; V543-I627 HydrophobicContact CG1-CD1 3.96Å; V543-I627 HydrophobicContact CG2-CD1 3.73Å; R559-I627 WeakPolarHBondContact O-CA 3.33Å; I560-I627 HydrophobicContact CB-CG1 4.43Å; I560-I627 HydrophobicContact CD1-CG1 4.47Å; I560-I627 HydrophobicContact CG1-CG1 4.18Å; L567-I627 HydrophobicContact CD1-CG2 4.33Å; L567-I627 HydrophobicContact CD2-CD1 3.93Å; V609-I627 HydrophobicContact CG2-CD1 3.89Å; I625-I627 HydrophobicContact CG2-CG1 4.09Å; I627-R643 WeakPolarHBondContact O-CA 3.49Å; I627-T644 HydrophobicContact CB-CG2 4.11Å; I627-T644 PolarHBondContact N-O 3.22Å; I627-T644 PolarHBondContact O-N 2.67Å; I627-F646 HydrophobicContact CD1-CE1 3.82Å; I627-F646 HydrophobicContact CD1-CZ 4.47Å; I627-F646 HydrophobicContact CG1-CE1 4.33Å
628	T	94.2	Very high	84.2	Confident	4 Å²	4	63 Å²	63	3%	0.025	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.5	177.2	73.1	0	0	0	0	110.2	C558 R559 E626 G642 R643	C558-T628 WeakPolarHBondContact CA-O 3.27Å; R559-T628 VanDerWaalsContact CG-OG1 3.28Å; R559-T628 WeakPolarHBondContact CG-OG1 3.32Å; R559-T628 PolarHBondContact N-O 3.38Å; R559-T628 PolarHBondContact NE-OG1 2.9Å; R559-T628 PolarHBondContact NH2-OG1 2.64Å; R559-T628 PolarHBondContact O-N 2.65Å; E626-T628 HydrophobicContact CG-CG2 3.76Å; T628-G642 CarbonylContact C-O 3.54Å; T628-G642 VanDerWaalsContact CA-O 3.3Å; T628-G642 WeakPolarHBondContact CA-O 3.2Å; T628-R643 HydrophobicContact CG2-CB 4.26Å; T628-R643 HydrophobicContact CG2-CG 3.74Å
629	C	93.7	Very high	84.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.3	176.8	-60.8	0	0	0	0	109.5	P512 I514 A545 L556 S557 C558 T641 G642	P512-C629 HydrophobicContact CB-CB 4Å; I514-C629 HydrophobicContact CD1-CB 3.88Å; I514-C629 VanDerWaalsContact CD1-SG 3.56Å; I514-C629 HydrophobicContact CG1-CB 4.26Å; A545-C629 VanDerWaalsContact CB-SG 3.59Å; L556-C629 HydrophobicContact CD2-CB 4.35Å; S557-C629 WeakPolarHBondContact O-CA 3.41Å; C558-C629 HydrophobicContact CB-CB 4.1Å; C558-C629 WeakPolarHBondContact CB-SG 3.47Å; C558-C629 WeakPolarHBondContact SG-CB 3.31Å; C558-C629 CovalentContact SG-SG 2.04Å; C558-C629 PolarHBondContact SG-SG 2.95Å; C629-T641 CarbonylContact O-C 3.58Å; C629-T641 VanDerWaalsContact O-CA 3.31Å; C629-T641 WeakPolarHBondContact O-CA 3.38Å; C629-G642 PolarHBondContact N-O 2.92Å; C629-G642 PolarHBondContact O-N 2.73Å
630	T	92.1	Very high	84.1	Confident	21 Å²	21	61.2 Å²	61.2	13%	0.129	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	156	172.1	71.3	0	0	0	0	110.2	L556 S557 V639 R640 T641	L556-T630 CarbonylContact C-O 3.59Å; L556-T630 WeakPolarHBondContact CA-O 3.42Å; S557-T630 PolarHBondContact N-O 2.92Å; S557-T630 PolarHBondContact O-N 2.88Å; T630-V639 HydrophobicContact CG2-CG1 4.48Å; T630-R640 WeakPolarHBondContact CA-O 3.2Å; T630-R640 WeakPolarHBondContact CB-O 3.46Å; T630-T641 HydrophobicContact CG2-CG2 4.23Å
631	D	89.5	Confident	84.2	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.011	33%	0.333	C	S	.	.			trans	-71.4	179.1	160.6	52.2	25.7	0	0	0	111.3	N508 N553 A555 P633 V639 R640	N508-D631 PolarHBondContact ND2-OD2 2.81Å; N508-D631 PolarHBondContact OD1-OD2 2.88Å; N553-D631 WeakPolarHBondContact O-CB 3.31Å; A555-D631 CarbonylContact O-C 3.57Å; D631-P633 VanDerWaalsContact OD1-CD 3.31Å; D631-P633 WeakPolarHBondContact OD1-CD 3.42Å; D631-V639 WeakPolarHBondContact OD1-CA 3.5Å; D631-V639 VanDerWaalsContact OD1-CG1 3.22Å; D631-V639 WeakPolarHBondContact OD1-CG1 3.49Å; D631-R640 PolarHBondContact OD1-N 2.9Å; D631-R640 WeakPolarHBondContact OD2-CA 3.35Å; D631-R640 WeakPolarHBondContact OD2-CB 3.34Å; D631-R640 WeakPolarHBondContact OD2-CG 3.39Å; D631-R640 PolarHBondContact OD2-N 3.4Å
632	Q	81.7	Confident	84.5	Confident	110 Å²	110	59.6 Å²	59.6	51%	0.514	32%	0.315	S	S	.	.			trans	-140.4	52.7	172.8	-64.7	-170	-12.9	0	0	113	P552 A555 S557 L634	P552-Q632 CarbonylContact O-C 3.6Å; P552-Q632 VanDerWaalsContact O-O 3.05Å; A555-Q632 HydrophobicContact CB-CB 4.15Å; A555-Q632 WeakPolarHBondContact O-CB 3.41Å; A555-Q632 WeakPolarHBondContact O-CG 3.31Å; A555-Q632 PolarHBondContact O-N 2.79Å; A555-Q632 VanDerWaalsContact O-N 3.1Å; S557-Q632 VanDerWaalsContact CB-NE2 3.34Å; Q632-L634 PolarHBondContact O-N 2.94Å
633	P	77.3	Confident	84.7	Confident	18 Å²	18	63 Å²	63	12%	0.117	32%	0.321	C	S	.	.			trans	-55.7	126.8	-179.6	19.8	-32	0	0	0	112.6	N508 D631 N635 V639	N508-P633 WeakPolarHBondContact OD1-CB 3.32Å; N508-P633 WeakPolarHBondContact OD1-CD 3.38Å; N508-P633 WeakPolarHBondContact OD1-CG 3.48Å; D631-P633 VanDerWaalsContact OD1-CD 3.31Å; D631-P633 WeakPolarHBondContact OD1-CD 3.42Å; P633-N635 VanDerWaalsContact C-N 3.29Å; P633-N635 PolarHBondContact O-N 2.87Å; P633-V639 HydrophobicContact CG-CG2 4.24Å
634	L	67.8	Low	84.6	Confident	132 Å²	132	63.6 Å²	63.6	69%	0.691	33%	0.327	S	S	*	.	S	Bend	trans	-72.8	-19.9	-179.1	-103.3	167.4	0	0	0	113.8	P552 Q632	P552-L634 HydrophobicContact CB-CB 3.83Å; P552-L634 HydrophobicContact CB-CD1 4.08Å; P552-L634 HydrophobicContact CB-CG 4.08Å; P552-L634 HydrophobicContact CG-CB 4.07Å; P552-L634 HydrophobicContact CG-CD1 3.81Å; P552-L634 HydrophobicContact CG-CG 4.31Å; Q632-L634 PolarHBondContact O-N 2.94Å
635	N	62.3	Low	84.6	Confident	166 Å²	166	64.7 Å²	64.7	89%	0.888	33%	0.33	S	S	*	.	S	Bend	trans	-142.6	13.5	-173.7	-64.2	-62.9	0	0	0	114.7	P633	P633-N635 VanDerWaalsContact C-N 3.29Å; P633-N635 PolarHBondContact O-N 2.87Å
636	S	62	Low	84.4	Confident	49 Å²	49	65.6 Å²	65.6	34%	0.343	33%	0.334	S	S	.	.			trans	-97.5	146.5	176	-171.4	0	0	0	0	111.3	T638	S636-T638 VanDerWaalsContact C-N 3.31Å; S636-T638 PolarHBondContact OG-N 3.43Å
637	E	62.8	Low	84.2	Confident	202 Å²	202	69.4 Å²	69.4	94%	0.944	35%	0.348	S	S	*	.	S	Bend	trans	-77	-17.5	172	-66	-166.4	157.9	0	0	112.8
638	T	78	Confident	84	Confident	82 Å²	82	69.4 Å²	69.4	50%	0.503	35%	0.348	S	S	.	.			trans	-117.6	95.8	-173.6	58.3	0	0	0	0	112.2	S636	S636-T638 VanDerWaalsContact C-N 3.31Å; S636-T638 PolarHBondContact OG-N 3.43Å
639	V	88.1	Confident	83.6	Confident	90 Å²	90	75 Å²	75	55%	0.545	37%	0.368	S	S	.	.			trans	-66.4	126.4	162	169.6	0	0	0	0	108.8	T630 D631 P633	T630-V639 HydrophobicContact CG2-CG1 4.48Å; D631-V639 WeakPolarHBondContact OD1-CA 3.5Å; D631-V639 VanDerWaalsContact OD1-CG1 3.22Å; D631-V639 WeakPolarHBondContact OD1-CG1 3.49Å; P633-V639 HydrophobicContact CG-CG2 4.24Å
640	R	90.5	Very high	83.4	Confident	76 Å²	76	75.1 Å²	75.1	29%	0.287	37%	0.369	S	S	.	.			trans	-98.4	169.9	178	-51.6	179.8	164.6	-140.5	-3.9	110.8	N508 D509 E510 T511 T630 D631	N508-R640 WeakPolarHBondContact ND2-CD 3.16Å; N508-R640 VanDerWaalsContact O-CZ 3.28Å; N508-R640 PolarHBondContact O-NE 3.02Å; N508-R640 PolarHBondContact O-NH2 2.82Å; D509-R640 VanDerWaalsContact CA-CZ 3.49Å; D509-R640 VanDerWaalsContact CA-NH2 3.34Å; D509-R640 PolarHBondContact O-NH1 2.75Å; D509-R640 PolarHBondContact O-NH2 3.45Å; E510-R640 WeakPolarHBondContact O-CD 3.48Å; E510-R640 PolarHBondContact O-NE 3.49Å; E510-R640 PolarHBondContact O-NH1 3.45Å; T511-R640 HydrophobicContact CG2-CB 4.29Å; T630-R640 WeakPolarHBondContact CA-O 3.2Å; T630-R640 WeakPolarHBondContact CB-O 3.46Å; D631-R640 PolarHBondContact OD1-N 2.9Å; D631-R640 WeakPolarHBondContact OD2-CA 3.35Å; D631-R640 WeakPolarHBondContact OD2-CB 3.34Å; D631-R640 WeakPolarHBondContact OD2-CG 3.39Å; D631-R640 PolarHBondContact OD2-N 3.4Å
641	T	91.3	Very high	83	Confident	60 Å²	60	76.4 Å²	76.4	37%	0.368	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	112.7	-172.9	-59.1	0	0	0	0	112.2	C629 T630 R643	C629-T641 CarbonylContact O-C 3.58Å; C629-T641 VanDerWaalsContact O-CA 3.31Å; C629-T641 WeakPolarHBondContact O-CA 3.38Å; T630-T641 HydrophobicContact CG2-CG2 4.23Å; T641-R643 HydrophobicContact CG2-CG 4.13Å
642	G	91.7	Very high	82.8	Confident	7 Å²	7	77.2 Å²	77.2	7%	0.072	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	147.6	163.7	0	0	0	0	0	112.1	P512 T628 C629	P512-G642 WeakPolarHBondContact O-CA 3.17Å; T628-G642 CarbonylContact C-O 3.54Å; T628-G642 VanDerWaalsContact CA-O 3.3Å; T628-G642 WeakPolarHBondContact CA-O 3.2Å; C629-G642 PolarHBondContact N-O 2.92Å; C629-G642 PolarHBondContact O-N 2.73Å
643	R	93.5	Very high	83	Confident	161 Å²	161	74.3 Å²	74.3	61%	0.608	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.3	146.1	171.6	-51.6	-165.8	-173.5	-164.6	6.9	110.8	E626 I627 T628 T641	E626-R643 IonicContact OE2-NH1 2.77Å; E626-R643 PolarHBondContact OE2-NH1 3.14Å; I627-R643 WeakPolarHBondContact O-CA 3.49Å; T628-R643 HydrophobicContact CG2-CB 4.26Å; T628-R643 HydrophobicContact CG2-CG 3.74Å; T641-R643 HydrophobicContact CG2-CG 4.13Å
644	T	90.9	Very high	83.4	Confident	34 Å²	34	74.6 Å²	74.6	21%	0.209	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.9	166.6	-171.1	0	0	0	0	109.6	I514 V516 E626 I627	I514-T644 HydrophobicContact CB-CG2 3.78Å; I514-T644 HydrophobicContact CD1-CG2 4.4Å; I514-T644 HydrophobicContact CG2-CG2 3.51Å; V516-T644 HydrophobicContact CG2-CG2 3.82Å; E626-T644 WeakPolarHBondContact CA-O 3.15Å; I627-T644 HydrophobicContact CB-CG2 4.11Å; I627-T644 PolarHBondContact N-O 3.22Å; I627-T644 PolarHBondContact O-N 2.67Å
645	Q	90.5	Very high	84.4	Confident	120 Å²	120	71.2 Å²	71.2	56%	0.561	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.5	177.8	-63.6	-168.2	-6.3	0	0	109.4	I625 E626	I625-Q645 WeakPolarHBondContact O-CA 3.36Å; E626-Q645 HydrophobicContact CB-CG 3.82Å; E626-Q645 HydrophobicContact CG-CG 3.85Å; E626-Q645 PolarHBondContact OE2-NE2 3.16Å
646	F	88.1	Confident	85.6	Confident	18 Å²	18	65.5 Å²	65.5	8%	0.079	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	160.9	175.8	67.2	-80	0	0	0	111	V516 P528 A541 V609 I625 I627 V648	V516-F646 HydrophobicContact CG1-CD1 4.2Å; V516-F646 HydrophobicContact CG1-CD2 4.34Å; V516-F646 HydrophobicContact CG1-CE1 4.24Å; V516-F646 HydrophobicContact CG1-CE2 4.38Å; V516-F646 HydrophobicContact CG1-CG 4.24Å; V516-F646 HydrophobicContact CG1-CZ 4.33Å; V516-F646 HydrophobicContact CG2-CD1 3.81Å; V516-F646 HydrophobicContact CG2-CE1 4.07Å; V516-F646 HydrophobicContact CG2-CG 4.46Å; P528-F646 HydrophobicContact CG-CD2 4.1Å; P528-F646 HydrophobicContact CG-CE2 4.19Å; A541-F646 HydrophobicContact CB-CE2 4.47Å; V609-F646 HydrophobicContact CG1-CZ 4.32Å; V609-F646 HydrophobicContact CG2-CZ 4.16Å; I625-F646 HydrophobicContact CB-CD1 4.25Å; I625-F646 HydrophobicContact CB-CE1 3.83Å; I625-F646 HydrophobicContact CB-CE2 4.23Å; I625-F646 HydrophobicContact CB-CZ 3.82Å; I625-F646 HydrophobicContact CD1-CE2 4.05Å; I625-F646 HydrophobicContact CD1-CZ 3.9Å; I625-F646 HydrophobicContact CG1-CZ 4.41Å; I625-F646 HydrophobicContact CG2-CD1 4.34Å; I625-F646 HydrophobicContact CG2-CE1 3.55Å; I625-F646 HydrophobicContact CG2-CZ 3.69Å; I625-F646 PolarHBondContact N-O 3.11Å; I625-F646 PolarHBondContact O-N 3.16Å; I627-F646 HydrophobicContact CD1-CE1 3.82Å; I627-F646 HydrophobicContact CD1-CZ 4.47Å; I627-F646 HydrophobicContact CG1-CE1 4.33Å; F646-V648 HydrophobicContact CD2-CG2 4.09Å; F646-V648 HydrophobicContact CE2-CG2 3.64Å
647	Y	88.6	Confident	86.9	Confident	106 Å²	106	65.7 Å²	65.7	42%	0.416	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.9	179.3	-56.7	-74.5	0	0	0	109.6	Y527 I622 E623 I624	Y527-Y647 HydrophobicContact CD1-CD2 4.19Å; Y527-Y647 AromaticContact CE1-CD2 3.77Å; Y527-Y647 HydrophobicContact CE1-CD2 3.77Å; I622-Y647 HydrophobicContact CG2-CD1 3.99Å; I622-Y647 HydrophobicContact CG2-CG 4.32Å; E623-Y647 WeakPolarHBondContact O-CA 3.31Å; I624-Y647 HydrophobicContact CD1-CE1 4.1Å; I624-Y647 HydrophobicContact CG1-CD1 3.99Å; I624-Y647 HydrophobicContact CG1-CE1 3.91Å; I624-Y647 HydrophobicContact CG2-CD1 4.45Å; I624-Y647 HydrophobicContact CG2-CE1 4.19Å
648	V	88.9	Confident	88.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.8	168.6	177.7	0	0	0	0	107.8	P528 V530 V540 F565 I622 E623 I625 F646	P528-V648 WeakPolarHBondContact O-CA 3.4Å; V530-V648 HydrophobicContact CB-CG1 4.42Å; V530-V648 HydrophobicContact CG1-CG1 3.66Å; V540-V648 HydrophobicContact CG1-CB 4.38Å; V540-V648 HydrophobicContact CG1-CG1 3.74Å; V540-V648 HydrophobicContact CG1-CG2 3.67Å; F565-V648 HydrophobicContact CE1-CG1 4.19Å; F565-V648 HydrophobicContact CZ-CB 4.28Å; F565-V648 HydrophobicContact CZ-CG1 4.12Å; I622-V648 WeakPolarHBondContact CA-O 3.47Å; E623-V648 HydrophobicContact CB-CB 4.43Å; E623-V648 PolarHBondContact N-O 3.2Å; E623-V648 PolarHBondContact O-N 3.14Å; I625-V648 HydrophobicContact CD1-CG2 3.45Å; I625-V648 VanDerWaalsContact CD1-CG2 3.45Å; I625-V648 HydrophobicContact CG1-CG2 4.08Å; F646-V648 HydrophobicContact CD2-CG2 4.09Å; F646-V648 HydrophobicContact CE2-CG2 3.64Å
649	R	86.8	Confident	88.9	Confident	120 Å²	120	55.3 Å²	55.3	45%	0.453	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	122.9	176.3	-177	-179.1	-178.5	-159.6	0.3	109.4	P528 T529 V530 L651	P528-R649 PolarHBondContact O-N 2.84Å; T529-R649 WeakPolarHBondContact CA-O 3.14Å; T529-R649 HydrophobicContact CG2-CB 4.25Å; V530-R649 PolarHBondContact N-O 2.8Å; R649-L651 HydrophobicContact CG-CD2 4.48Å
650	I	88.5	Confident	89.1	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	130.1	173.1	-62.4	173.9	0	0	0	108	V530 E532 L615 R617 S620 T621 E623	V530-I650 HydrophobicContact CG1-CG1 4.13Å; V530-I650 CarbonylContact O-C 3.54Å; V530-I650 WeakPolarHBondContact O-CA 3.22Å; E532-I650 HydrophobicContact CB-CG2 3.75Å; L615-I650 HydrophobicContact CB-CD1 4.19Å; L615-I650 HydrophobicContact CD1-CD1 4.11Å; L615-I650 HydrophobicContact CD1-CG1 4.21Å; L615-I650 HydrophobicContact CD2-CD1 4.27Å; L615-I650 HydrophobicContact CG-CD1 4.44Å; R617-I650 HydrophobicContact CB-CG2 3.75Å; R617-I650 HydrophobicContact CG-CB 4.27Å; R617-I650 HydrophobicContact CG-CG2 3.92Å; S620-I650 VanDerWaalsContact O-CD1 3.29Å; S620-I650 WeakPolarHBondContact O-CD1 3.4Å; T621-I650 PolarHBondContact O-N 3.3Å; E623-I650 HydrophobicContact CG-CD1 3.8Å
651	L	85	Confident	89	Confident	48 Å²	48	51.6 Å²	51.6	25%	0.251	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	140.5	-179.6	-64.5	-176.9	0	0	0	110.5	T529 V530 M531 E532 R649	T529-L651 HydrophobicContact CG2-CD1 4.14Å; T529-L651 HydrophobicContact CG2-CD2 4.03Å; T529-L651 HydrophobicContact CG2-CG 4.14Å; V530-L651 PolarHBondContact O-N 2.8Å; M531-L651 HydrophobicContact CE-CB 4.02Å; M531-L651 HydrophobicContact SD-CB 3.51Å; M531-L651 VanDerWaalsContact SD-CB 3.51Å; M531-L651 HydrophobicContact SD-CD1 3.71Å; M531-L651 HydrophobicContact SD-CG 4.27Å; E532-L651 PolarHBondContact N-O 2.77Å; E532-L651 VanDerWaalsContact N-O 3.1Å; R649-L651 HydrophobicContact CG-CD2 4.48Å
652	D	85.4	Confident	88.9	Confident	19 Å²	19	50.2 Å²	50.2	10%	0.102	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-68.9	131.6	-173.5	-166.7	76.6	0	0	0	113.5	M531 E532 R617 Y689 H692	M531-D652 WeakPolarHBondContact CE-O 3.48Å; E532-D652 VanDerWaalsContact OE1-CA 3.23Å; E532-D652 WeakPolarHBondContact OE1-CA 3.32Å; R617-D652 IonicContact CZ-OD1 3.46Å; R617-D652 IonicContact NE-OD1 3.43Å; R617-D652 PolarHBondContact NE-OD1 2.65Å; R617-D652 IonicContact NH2-OD1 2.68Å; R617-D652 PolarHBondContact NH2-OD1 3.32Å; R617-D652 VanDerWaalsContact NH2-OD1 3.17Å; D652-Y689 VanDerWaalsContact CG-N 3.32Å; D652-Y689 VanDerWaalsContact CG-O 3.25Å; D652-Y689 WeakPolarHBondContact OD1-CA 3.35Å; D652-Y689 WeakPolarHBondContact OD1-CB 3.37Å; D652-Y689 PolarHBondContact OD1-N 3.35Å; D652-Y689 PolarHBondContact OD2-N 2.98Å; D652-H692 IonicContact OD2-CE1 2.68Å; D652-H692 PolarHBondContact OD2-CE1 2.94Å; D652-H692 IonicContact OD2-ND1 3.89Å; D652-H692 PolarHBondContact OD2-ND1 2.88Å; D652-H692 VanDerWaalsContact OD2-ND1 3.11Å
653	E	84.8	Confident	88.9	Confident	50 Å²	50	56.3 Å²	56.3	23%	0.234	27%	0.269	C	S	.	.			trans	-112	142.2	157.9	-62.4	-89.9	-175.3	0	0	107.5	M531 E532 R534 D655	M531-E653 HydrophobicContact CE-CG 3.83Å; M531-E653 WeakPolarHBondContact CE-OE1 3.37Å; E532-E653 HydrophobicContact CG-CB 4.04Å; E532-E653 HydrophobicContact CG-CG 3.94Å; E532-E653 PolarHBondContact OE1-N 3.32Å; R534-E653 IonicContact CZ-OE1 2.73Å; R534-E653 IonicContact NE-OE1 2.76Å; R534-E653 PolarHBondContact NE-OE1 2.94Å; R534-E653 IonicContact NH2-OE1 3.16Å; R534-E653 PolarHBondContact NH2-OE1 3.47Å; E653-D655 WeakPolarHBondContact O-CB 3.46Å; E653-D655 PolarHBondContact O-N 2.97Å
654	N	86.9	Confident	88.9	Confident	24 Å²	24	54.8 Å²	54.8	13%	0.128	27%	0.267	C	S	.	.			trans	-75.3	79.2	179.8	-160	128.2	0	0	0	109.4	N656 D688 H692 D770 G772 K776	N654-N656 PolarHBondContact ND2-O 2.64Å; N654-D688 WeakPolarHBondContact CA-OD2 3.17Å; N654-D688 PolarHBondContact ND2-OD2 3.3Å; N654-H692 PolarHBondContact N-CE1 2.57Å; N654-H692 PolarHBondContact N-NE2 3.32Å; N654-D770 PolarHBondContact ND2-OD2 2.97Å; N654-G772 WeakPolarHBondContact OD1-CA 3.03Å; N654-K776 WeakPolarHBondContact O-CE 3.46Å; N654-K776 PolarHBondContact O-NZ 2.83Å
655	D	87.5	Confident	89.2	Confident	60 Å²	60	53.9 Å²	53.9	32%	0.321	26%	0.26	S	S	.	.			trans	-94.3	-32.6	-166.6	152	-75.2	0	0	0	112	N533 E653 D688 K776	N533-D655 PolarHBondContact ND2-OD2 2.89Å; E653-D655 WeakPolarHBondContact O-CB 3.46Å; E653-D655 PolarHBondContact O-N 2.97Å; D655-D688 PolarHBondContact N-OD2 2.8Å; D655-K776 VanDerWaalsContact CA-NZ 3.29Å; D655-K776 PolarHBondContact O-NZ 3Å
656	N	87.8	Confident	89.4	Confident	47 Å²	47	55.9 Å²	55.9	25%	0.251	27%	0.269	S	S	.	.	S	Bend	trans	-96.3	157.9	175.6	-61	-85.5	0	0	0	112	N654 P687 D688 K776	N654-N656 PolarHBondContact ND2-O 2.64Å; N656-P687 HydrophobicContact CB-CG 3.59Å; N656-P687 WeakPolarHBondContact ND2-CG 3.4Å; N656-D688 WeakPolarHBondContact CB-OD1 3.29Å; N656-D688 PolarHBondContact N-OD1 2.86Å; N656-D688 PolarHBondContact N-OD2 3.16Å; N656-D688 PolarHBondContact ND2-OD1 3.19Å; N656-K776 WeakPolarHBondContact O-CD 3.34Å
657	P	89.4	Confident	89.8	Confident	53 Å²	53	55.9 Å²	55.9	34%	0.344	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-93.4	159.7	161.6	36	-31.7	0	0	0	110.8	K776	P657-K776 HydrophobicContact CB-CB 3.95Å; P657-K776 HydrophobicContact CB-CD 4.49Å
658	P	91.5	Very high	90.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-54.6	149.5	164.7	-21.8	28.6	0	0	0	111.4	D686 I727 A768 D770 I778	P658-D686 WeakPolarHBondContact CD-OD2 3.37Å; P658-D686 VanDerWaalsContact CG-OD2 3.26Å; P658-D686 WeakPolarHBondContact CG-OD2 3.49Å; P658-I727 HydrophobicContact CB-CG2 4.3Å; P658-I727 HydrophobicContact CG-CG2 4.49Å; P658-A768 HydrophobicContact CB-CB 4.13Å; P658-D770 HydrophobicContact CG-CB 3.98Å; P658-I778 HydrophobicContact CB-CG2 4.21Å; P658-I778 WeakPolarHBondContact O-CB 3.15Å; P658-I778 WeakPolarHBondContact O-CG2 3.05Å
659	T	91.3	Very high	90.5	Very high	66 Å²	66	55.8 Å²	55.8	41%	0.405	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	132.8	-176.8	56.4	0	0	0	0	112	A684 T685	T659-A684 CarbonylContact O-C 3.56Å; T659-A684 WeakPolarHBondContact O-CA 3.29Å; T659-A684 WeakPolarHBondContact O-CB 3.26Å; T659-T685 PolarHBondContact N-O 3.3Å; T659-T685 PolarHBondContact O-N 3.08Å; T659-T685 PolarHBondContact OG1-O 3.43Å; T659-T685 PolarHBondContact OG1-OG1 3.32Å; T659-T685 VanDerWaalsContact OG1-OG1 3.12Å
660	F	92	Very high	90.8	Very high	17 Å²	17	54.2 Å²	54.2	8%	0.075	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	148.1	168.3	-71.1	-67.4	0	0	0	110.8	T662 F665 F682 A684 Y729 V766 A768 I778 A780	F660-T662 WeakPolarHBondContact CB-O 3.46Å; F660-T662 PolarHBondContact O-N 2.8Å; F660-T662 VanDerWaalsContact O-N 3.13Å; F660-F665 HydrophobicContact CB-CE2 4.35Å; F660-F665 HydrophobicContact CB-CZ 4.34Å; F660-F665 HydrophobicContact CD1-CE2 4.21Å; F660-F665 HydrophobicContact CD1-CZ 4.15Å; F660-F665 HydrophobicContact CG-CE2 4.25Å; F660-F665 HydrophobicContact CG-CZ 4.43Å; F660-F682 HydrophobicContact CE1-CB 4.25Å; F660-F682 HydrophobicContact CE1-CD1 4.46Å; F660-A684 HydrophobicContact CD1-CB 3.82Å; F660-A684 HydrophobicContact CE1-CB 3.83Å; F660-A684 HydrophobicContact CG-CB 4.44Å; F660-A684 HydrophobicContact CZ-CB 4.46Å; F660-Y729 HydrophobicContact CE1-CD1 4.45Å; F660-Y729 HydrophobicContact CE1-CE1 4.06Å; F660-Y729 HydrophobicContact CZ-CE1 4.48Å; F660-V766 HydrophobicContact CE1-CG1 4.41Å; F660-V766 HydrophobicContact CE2-CG1 4.14Å; F660-V766 HydrophobicContact CZ-CG1 3.82Å; F660-V766 HydrophobicContact CZ-CG2 4.19Å; F660-A768 HydrophobicContact CE1-CB 4.12Å; F660-A768 HydrophobicContact CE2-CB 3.93Å; F660-A768 HydrophobicContact CZ-CB 3.54Å; F660-I778 HydrophobicContact CD2-CG1 4.41Å; F660-I778 HydrophobicContact CD2-CG2 3.67Å; F660-I778 HydrophobicContact CE2-CG2 3.77Å; F660-A780 HydrophobicContact CD2-CB 3.63Å; F660-A780 HydrophobicContact CE2-CB 3.95Å; F660-A780 HydrophobicContact CG-CB 4.24Å
661	N	88.2	Confident	91	Very high	70 Å²	70	54.4 Å²	54.4	37%	0.374	28%	0.277	S	S	.	.	S	Bend	trans	-58.1	-21.8	171.5	67.1	-6.8	0	0	0	114.2	T212 F665	T212-N661 HydrophobicContact CG2-CB 4.24Å; T212-N661 PolarHBondContact OG1-ND2 2.82Å; N661-F665 WeakPolarHBondContact OD1-CE1 3.37Å; N661-F665 WeakPolarHBondContact OD1-CZ 3.36Å
662	T	90.7	Very high	91.3	Very high	32 Å²	32	54.2 Å²	54.2	20%	0.196	28%	0.276	C	S	.	.			trans	-147.7	153.6	174.9	79.5	0	0	0	0	110.4	T210 F660 K664	T210-T662 HydrophobicContact CG2-CG2 4.26Å; F660-T662 WeakPolarHBondContact CB-O 3.46Å; F660-T662 PolarHBondContact O-N 2.8Å; F660-T662 VanDerWaalsContact O-N 3.13Å; T662-K664 VanDerWaalsContact C-N 3.32Å; T662-K664 PolarHBondContact OG1-N 3.49Å; T662-K664 PolarHBondContact OG1-O 3.43Å
663	H	90	Very high	91.6	Very high	135 Å²	135	54.3 Å²	54.3	63%	0.625	28%	0.278	S	S	*	.	S	Bend	trans	-85	-4.2	169.7	-55.3	-61	0	0	0	113.7	A780 E781	H663-A780 WeakPolarHBondContact O-CA 3.4Å; H663-E781 PolarHBondContact O-N 3.44Å
664	K	94.4	Very high	91.9	Very high	129 Å²	129	54.9 Å²	54.9	56%	0.561	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.9	112.3	-173.8	-73.3	-178.3	-176.6	-80.5	0	111.4	T662 E781	T662-K664 VanDerWaalsContact C-N 3.32Å; T662-K664 PolarHBondContact OG1-N 3.49Å; T662-K664 PolarHBondContact OG1-O 3.43Å; K664-E781 CarbonylContact C-O 3.58Å; K664-E781 VanDerWaalsContact CA-O 3.28Å; K664-E781 WeakPolarHBondContact CA-O 3.28Å; K664-E781 HydrophobicContact CG-CB 4.47Å; K664-E781 IonicContact NZ-OE2 2.7Å; K664-E781 PolarHBondContact NZ-OE2 2.83Å
665	F	96.4	Very high	92.2	Very high	15 Å²	15	56.7 Å²	56.7	7%	0.066	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.7	173.7	-63.5	-91	0	0	0	109.9	F660 N661 F680 F682 A780 E781 V782 F783	F660-F665 HydrophobicContact CB-CE2 4.35Å; F660-F665 HydrophobicContact CB-CZ 4.34Å; F660-F665 HydrophobicContact CD1-CE2 4.21Å; F660-F665 HydrophobicContact CD1-CZ 4.15Å; F660-F665 HydrophobicContact CG-CE2 4.25Å; F660-F665 HydrophobicContact CG-CZ 4.43Å; N661-F665 WeakPolarHBondContact OD1-CE1 3.37Å; N661-F665 WeakPolarHBondContact OD1-CZ 3.36Å; F665-F680 AromaticContact CD1-CE1 3.75Å; F665-F680 HydrophobicContact CD1-CE1 3.75Å; F665-F680 AromaticContact CD1-CZ 3.97Å; F665-F680 HydrophobicContact CD1-CZ 3.97Å; F665-F680 AromaticContact CE1-CE1 3.84Å; F665-F680 HydrophobicContact CE1-CE1 3.84Å; F665-F680 HydrophobicContact CE1-CZ 4.09Å; F665-F682 HydrophobicContact CB-CE1 4.36Å; F665-F682 HydrophobicContact CD1-CD1 4.48Å; F665-F682 HydrophobicContact CD1-CE1 4.12Å; F665-F682 HydrophobicContact CD2-CD1 4.28Å; F665-F682 AromaticContact CD2-CE1 3.77Å; F665-F682 HydrophobicContact CD2-CE1 3.77Å; F665-F682 HydrophobicContact CE1-CD1 4.29Å; F665-F682 HydrophobicContact CE1-CE1 4.38Å; F665-F682 HydrophobicContact CE2-CD1 4.08Å; F665-F682 HydrophobicContact CE2-CE1 4.04Å; F665-F682 HydrophobicContact CG-CD1 4.48Å; F665-F682 AromaticContact CG-CE1 3.81Å; F665-F682 HydrophobicContact CG-CE1 3.81Å; F665-F682 HydrophobicContact CZ-CD1 4.08Å; F665-F682 HydrophobicContact CZ-CE1 4.34Å; F665-A780 HydrophobicContact CD2-CB 3.96Å; F665-A780 HydrophobicContact CE2-CB 3.72Å; F665-E781 PolarHBondContact N-O 3.11Å; F665-V782 HydrophobicContact CB-CG1 4.19Å; F665-V782 HydrophobicContact CB-CG2 4.32Å; F665-V782 HydrophobicContact CD2-CG2 4.38Å; F665-F783 PolarHBondContact O-N 2.96Å
666	Q	96.2	Very high	92.5	Very high	162 Å²	162	58.5 Å²	58.5	76%	0.757	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	118	170.7	-178.1	176.5	-20.2	0	0	107.5
667	L	96.1	Very high	92.8	Very high	18 Å²	18	61.1 Å²	61.1	9%	0.094	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.8	-172.3	-52.1	173.5	0	0	0	109.5	F680 F682 L748 V782 F783 I784 N785	L667-F680 HydrophobicContact CD1-CB 3.72Å; L667-F680 HydrophobicContact CD1-CD1 4.13Å; L667-F680 HydrophobicContact CD1-CD2 4.45Å; L667-F680 HydrophobicContact CD1-CG 3.85Å; L667-F680 HydrophobicContact CD2-CB 4.23Å; L667-F680 HydrophobicContact CD2-CD1 4.21Å; L667-F680 HydrophobicContact CD2-CD2 3.45Å; L667-F680 VanDerWaalsContact CD2-CD2 3.45Å; L667-F680 HydrophobicContact CD2-CE1 4.47Å; L667-F680 HydrophobicContact CD2-CE2 3.76Å; L667-F680 HydrophobicContact CD2-CG 3.7Å; L667-F680 HydrophobicContact CD2-CZ 4.27Å; L667-F680 HydrophobicContact CG-CG 4.46Å; L667-F682 HydrophobicContact CD1-CZ 4.36Å; L667-L748 HydrophobicContact CD1-CD2 4.11Å; L667-V782 HydrophobicContact CD1-CG1 3.79Å; L667-V782 HydrophobicContact CG-CG1 4.34Å; L667-F783 PolarHBondContact N-O 2.86Å; L667-I784 HydrophobicContact CB-CD1 3.79Å; L667-I784 HydrophobicContact CD1-CD1 3.88Å; L667-I784 HydrophobicContact CG-CD1 4.32Å; L667-I784 WeakPolarHBondContact O-CA 3.22Å; L667-N785 PolarHBondContact O-N 3.19Å
668	D	95.7	Very high	93.1	Very high	96 Å²	96	63.1 Å²	63.1	51%	0.513	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	141.6	172.5	-70.5	-48.5	0	0	0	109.6	N785 I787	D668-N785 WeakPolarHBondContact CA-O 3.25Å; D668-N785 WeakPolarHBondContact OD1-CB 3.42Å; D668-N785 PolarHBondContact OD1-ND2 3.4Å; D668-I787 HydrophobicContact CB-CD1 4.27Å; D668-I787 HydrophobicContact CB-CG1 3.8Å
669	I	95.1	Very high	93.2	Very high	8 Å²	8	64.7 Å²	64.7	4%	0.041	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	136.1	167.3	-164.3	-174.6	0	0	0	107.9	T673 I679 L739 V754 I784 N785 V786 I787	I669-T673 HydrophobicContact CD1-CG2 4.47Å; I669-T673 HydrophobicContact CG1-CG2 4.49Å; I669-I679 HydrophobicContact CD1-CD1 3.58Å; I669-I679 HydrophobicContact CD1-CG1 4.1Å; I669-I679 HydrophobicContact CG1-CD1 4.21Å; I669-I679 HydrophobicContact CG1-CG1 4.23Å; I669-L739 HydrophobicContact CD1-CD2 4.49Å; I669-V754 HydrophobicContact CD1-CG2 4.19Å; I669-I784 HydrophobicContact CB-CG2 4.07Å; I669-I784 HydrophobicContact CG2-CG2 3.47Å; I669-I784 VanDerWaalsContact CG2-CG2 3.47Å; I669-N785 PolarHBondContact N-O 3.21Å; I669-V786 HydrophobicContact CG2-CB 4.4Å; I669-V786 HydrophobicContact CG2-CG1 4.43Å; I669-V786 HydrophobicContact CG2-CG2 3.93Å; I669-V786 CarbonylContact O-C 3.32Å; I669-V786 WeakPolarHBondContact O-CA 3.46Å; I669-I787 PolarHBondContact O-N 3.08Å
670	L	93.4	Very high	93.4	Very high	86 Å²	86	64.6 Å²	64.6	45%	0.45	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	139	168	-69.7	162.9	0	0	0	108.8	T673 I787 Q789	L670-T673 WeakPolarHBondContact O-CB 3.42Å; L670-T673 PolarHBondContact O-OG1 2.97Å; L670-I787 HydrophobicContact CD2-CB 4.05Å; L670-I787 HydrophobicContact CD2-CG2 3.74Å; L670-Q789 HydrophobicContact CB-CG 4.43Å; L670-Q789 HydrophobicContact CD2-CG 4.22Å
671	E	93.5	Very high	93.5	Very high	8 Å²	8	68.4 Å²	68.4	4%	0.037	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	165	165.6	87.6	-171.5	113.3	0	0	110.7	T673 V754 K756 V786 I787 D788 Q789	E671-T673 PolarHBondContact O-N 3.01Å; E671-V754 CarbonylContact C-O 3.58Å; E671-V754 WeakPolarHBondContact CA-O 3.5Å; E671-V754 WeakPolarHBondContact CB-O 3.48Å; E671-K756 HydrophobicContact CB-CB 4.3Å; E671-K756 WeakPolarHBondContact OE2-CB 3.5Å; E671-K756 PolarHBondContact OE2-N 2.63Å; E671-V786 HydrophobicContact CB-CG1 3.68Å; E671-I787 PolarHBondContact N-O 3.45Å; E671-D788 VanDerWaalsContact OE1-CA 3.28Å; E671-D788 WeakPolarHBondContact OE1-CA 3.4Å; E671-Q789 HydrophobicContact CG-CB 4.08Å; E671-Q789 HydrophobicContact CG-CG 4.18Å; E671-Q789 VanDerWaalsContact O-CD 3.29Å; E671-Q789 PolarHBondContact O-OE1 3.01Å; E671-Q789 PolarHBondContact OE1-N 3.02Å
672	N	90.3	Very high	93.8	Very high	43 Å²	43	65.1 Å²	65.1	23%	0.23	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	-3.5	-174.6	-87.9	-65.8	0	0	0	116.9	K753 V754 D791	N672-K753 VanDerWaalsContact O-CE 3.24Å; N672-K753 WeakPolarHBondContact O-CE 3.3Å; N672-K753 PolarHBondContact O-NZ 3.43Å; N672-K753 PolarHBondContact OD1-NZ 3.36Å; N672-V754 PolarHBondContact N-O 2.9Å; N672-D791 PolarHBondContact ND2-OD2 2.94Å
673	T	92.5	Very high	93.7	Very high	21 Å²	21	66.7 Å²	66.7	13%	0.129	34%	0.338	C	S	.	.			trans	-42.1	121.3	172.4	-67.7	0	0	0	0	109.9	I669 L670 E671 E677	I669-T673 HydrophobicContact CD1-CG2 4.47Å; I669-T673 HydrophobicContact CG1-CG2 4.49Å; L670-T673 WeakPolarHBondContact O-CB 3.42Å; L670-T673 PolarHBondContact O-OG1 2.97Å; E671-T673 PolarHBondContact O-N 3.01Å; T673-E677 HydrophobicContact CG2-CB 3.74Å; T673-E677 HydrophobicContact CG2-CG 4.12Å
674	P	92.2	Very high	93.8	Very high	63 Å²	63	60.5 Å²	60.5	41%	0.409	31%	0.31	S	S	.	.			trans	-63.8	153.9	-177.2	23.5	-29.1	0	0	0	110.8	E677 S750	P674-E677 HydrophobicContact CG-CG 3.71Å; P674-S750 PolarHBondContact O-OG 3.14Å
675	P	93	Very high	93.5	Very high	62 Å²	62	57.2 Å²	57.2	40%	0.403	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	153.2	173.2	-23.2	34.5	0	0	0	112.2	E677 S750	P675-E677 PolarHBondContact O-N 3.1Å; P675-S750 WeakPolarHBondContact CA-OG 3.48Å
676	D	93.6	Very high	93.1	Very high	98 Å²	98	57.9 Å²	57.9	52%	0.524	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	13.3	178.4	-54.6	-56	0	0	0	115.8	R740 Y749 S750	D676-R740 IonicContact OD1-CZ 3.32Å; D676-R740 IonicContact OD1-NE 3.79Å; D676-R740 PolarHBondContact OD1-NE 2.8Å; D676-R740 IonicContact OD1-NH2 2.86Å; D676-R740 PolarHBondContact OD1-NH2 2.75Å; D676-Y749 WeakPolarHBondContact O-CD1 3.37Å; D676-S750 PolarHBondContact N-O 3.17Å; D676-S750 PolarHBondContact N-OG 3.01Å; D676-S750 VanDerWaalsContact N-OG 3.13Å
677	E	94.1	Very high	92.7	Very high	101 Å²	101	53.2 Å²	53.2	47%	0.472	29%	0.289	S	S	.	.			trans	-77	148	166.4	-81.7	-71.2	-174.7	0	0	112.3	T673 P674 P675 Y749 S750	T673-E677 HydrophobicContact CG2-CB 3.74Å; T673-E677 HydrophobicContact CG2-CG 4.12Å; P674-E677 HydrophobicContact CG-CG 3.71Å; P675-E677 PolarHBondContact O-N 3.1Å; E677-Y749 CarbonylContact O-C 3.55Å; E677-Y749 WeakPolarHBondContact O-CA 3.37Å; E677-S750 PolarHBondContact N-OG 2.85Å; E677-S750 PolarHBondContact O-N 3.25Å; E677-S750 PolarHBondContact O-OG 2.9Å
678	I	94.5	Very high	92.2	Very high	95 Å²	95	52.8 Å²	52.8	49%	0.487	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125.8	-180	-62.6	174.6	0	0	0	110.2	I747 Y749	I678-I747 HydrophobicContact CB-CG2 4.45Å; I678-I747 HydrophobicContact CD1-CG2 4.27Å; I678-I747 HydrophobicContact CG1-CG2 3.95Å; I678-I747 HydrophobicContact CG2-CG2 3.88Å; I678-Y749 HydrophobicContact CD1-CE1 4.29Å; I678-Y749 HydrophobicContact CG1-CD1 3.91Å; I678-Y749 HydrophobicContact CG1-CE1 3.55Å
679	I	94.4	Very high	91.3	Very high	33 Å²	33	53.5 Å²	53.5	17%	0.169	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-44.4	178.2	-59.7	164.4	0	0	0	110.8	I669 L739 L748	I669-I679 HydrophobicContact CD1-CD1 3.58Å; I669-I679 HydrophobicContact CD1-CG1 4.1Å; I669-I679 HydrophobicContact CG1-CD1 4.21Å; I669-I679 HydrophobicContact CG1-CG1 4.23Å; I679-L739 HydrophobicContact CD1-CD2 3.4Å; I679-L739 VanDerWaalsContact CD1-CD2 3.4Å; I679-L748 HydrophobicContact CB-CD2 4.31Å; I679-L748 HydrophobicContact CB-CG 4.47Å; I679-L748 HydrophobicContact CG2-CD2 4.2Å; I679-L748 PolarHBondContact N-O 3.06Å
680	F	95.6	Very high	89.6	Confident	64 Å²	64	56.2 Å²	56.2	28%	0.281	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	163.1	-176.4	-165.9	-111.6	0	0	0	111	F665 L667 F682 L748	F665-F680 AromaticContact CD1-CE1 3.75Å; F665-F680 HydrophobicContact CD1-CE1 3.75Å; F665-F680 AromaticContact CD1-CZ 3.97Å; F665-F680 HydrophobicContact CD1-CZ 3.97Å; F665-F680 AromaticContact CE1-CE1 3.84Å; F665-F680 HydrophobicContact CE1-CE1 3.84Å; F665-F680 HydrophobicContact CE1-CZ 4.09Å; L667-F680 HydrophobicContact CD1-CB 3.72Å; L667-F680 HydrophobicContact CD1-CD1 4.13Å; L667-F680 HydrophobicContact CD1-CD2 4.45Å; L667-F680 HydrophobicContact CD1-CG 3.85Å; L667-F680 HydrophobicContact CD2-CB 4.23Å; L667-F680 HydrophobicContact CD2-CD1 4.21Å; L667-F680 HydrophobicContact CD2-CD2 3.45Å; L667-F680 VanDerWaalsContact CD2-CD2 3.45Å; L667-F680 HydrophobicContact CD2-CE1 4.47Å; L667-F680 HydrophobicContact CD2-CE2 3.76Å; L667-F680 HydrophobicContact CD2-CG 3.7Å; L667-F680 HydrophobicContact CD2-CZ 4.27Å; L667-F680 HydrophobicContact CG-CG 4.46Å; F680-F682 AromaticContact CD1-CD1 3.84Å; F680-F682 HydrophobicContact CD1-CD1 3.84Å; F680-F682 HydrophobicContact CD1-CD2 4.37Å; F680-F682 AromaticContact CD1-CE1 3.75Å; F680-F682 HydrophobicContact CD1-CE1 3.75Å; F680-F682 HydrophobicContact CD1-CE2 4.32Å; F680-F682 HydrophobicContact CD1-CG 4.14Å; F680-F682 AromaticContact CD1-CZ 4Å; F680-F682 HydrophobicContact CD1-CZ 4Å; F680-F682 AromaticContact CE1-CD1 3.82Å; F680-F682 HydrophobicContact CE1-CD1 3.82Å; F680-F682 AromaticContact CE1-CE1 3.91Å; F680-F682 HydrophobicContact CE1-CE1 3.91Å; F680-F682 HydrophobicContact CE1-CG 4.41Å; F680-L748 HydrophobicContact CB-CB 4.39Å; F680-L748 HydrophobicContact CB-CD2 4.36Å; F680-L748 PolarHBondContact N-O 2.94Å; F680-L748 PolarHBondContact O-N 2.71Å
681	I	94.7	Very high	87.3	Confident	98 Å²	98	57 Å²	57	50%	0.503	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	111.7	172.9	-49.7	-173.8	0	0	0	108	I747	I681-I747 HydrophobicContact CD1-CG1 4.26Å; I681-I747 HydrophobicContact CG1-CG1 4.09Å; I681-I747 HydrophobicContact CG2-CG1 4.02Å
682	F	93.4	Very high	84.6	Confident	1 Å²	1	59.3 Å²	59.3	0%	0.004	31%	0.311	C	S	.	.			trans	-77.2	126.7	172.6	-67.4	-72.8	0	0	0	109.8	F660 F665 L667 F680 Y729 I741 G746 L748 V766 V782	F660-F682 HydrophobicContact CE1-CB 4.25Å; F660-F682 HydrophobicContact CE1-CD1 4.46Å; F665-F682 HydrophobicContact CB-CE1 4.36Å; F665-F682 HydrophobicContact CD1-CD1 4.48Å; F665-F682 HydrophobicContact CD1-CE1 4.12Å; F665-F682 HydrophobicContact CD2-CD1 4.28Å; F665-F682 AromaticContact CD2-CE1 3.77Å; F665-F682 HydrophobicContact CD2-CE1 3.77Å; F665-F682 HydrophobicContact CE1-CD1 4.29Å; F665-F682 HydrophobicContact CE1-CE1 4.38Å; F665-F682 HydrophobicContact CE2-CD1 4.08Å; F665-F682 HydrophobicContact CE2-CE1 4.04Å; F665-F682 HydrophobicContact CG-CD1 4.48Å; F665-F682 AromaticContact CG-CE1 3.81Å; F665-F682 HydrophobicContact CG-CE1 3.81Å; F665-F682 HydrophobicContact CZ-CD1 4.08Å; F665-F682 HydrophobicContact CZ-CE1 4.34Å; L667-F682 HydrophobicContact CD1-CZ 4.36Å; F680-F682 AromaticContact CD1-CD1 3.84Å; F680-F682 HydrophobicContact CD1-CD1 3.84Å; F680-F682 HydrophobicContact CD1-CD2 4.37Å; F680-F682 AromaticContact CD1-CE1 3.75Å; F680-F682 HydrophobicContact CD1-CE1 3.75Å; F680-F682 HydrophobicContact CD1-CE2 4.32Å; F680-F682 HydrophobicContact CD1-CG 4.14Å; F680-F682 AromaticContact CD1-CZ 4Å; F680-F682 HydrophobicContact CD1-CZ 4Å; F680-F682 AromaticContact CE1-CD1 3.82Å; F680-F682 HydrophobicContact CE1-CD1 3.82Å; F680-F682 AromaticContact CE1-CE1 3.91Å; F680-F682 HydrophobicContact CE1-CE1 3.91Å; F680-F682 HydrophobicContact CE1-CG 4.41Å; F682-Y729 HydrophobicContact CB-CD1 4.18Å; F682-Y729 HydrophobicContact CB-CE1 4.11Å; F682-I741 HydrophobicContact CD2-CD1 3.66Å; F682-I741 HydrophobicContact CE2-CD1 4.16Å; F682-G746 WeakPolarHBondContact CD2-O 3.15Å; F682-G746 PolarHBondContact N-O 2.78Å; F682-L748 HydrophobicContact CD2-CB 4.32Å; F682-L748 HydrophobicContact CE2-CB 3.92Å; F682-L748 HydrophobicContact CE2-CD1 4.22Å; F682-L748 HydrophobicContact CE2-CD2 3.89Å; F682-L748 HydrophobicContact CE2-CG 4.23Å; F682-L748 HydrophobicContact CZ-CD2 4.26Å; F682-V766 HydrophobicContact CD1-CG1 4.05Å; F682-V766 HydrophobicContact CD2-CG2 4.03Å; F682-V766 HydrophobicContact CE1-CG1 3.85Å; F682-V766 HydrophobicContact CE2-CB 4.42Å; F682-V766 HydrophobicContact CE2-CG2 4.17Å; F682-V766 HydrophobicContact CG-CG2 4.2Å; F682-V766 HydrophobicContact CZ-CB 4.35Å; F682-V766 HydrophobicContact CZ-CG1 4.15Å; F682-V782 HydrophobicContact CE1-CG2 3.93Å; F682-V782 HydrophobicContact CZ-CG1 4.2Å; F682-V782 HydrophobicContact CZ-CG2 3.68Å
683	N	89.7	Confident	81.7	Confident	65 Å²	65	63.9 Å²	63.9	35%	0.348	34%	0.335	S	S	.	.			trans	-120.5	111.5	172.4	-172.7	-0.1	0	0	0	108.3
684	A	90.3	Very high	78.6	Confident	4 Å²	4	68.5 Å²	68.5	3%	0.033	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	145.5	166.2	0	0	0	0	0	109.5	T659 F660 I727 Y729 A768	T659-A684 CarbonylContact O-C 3.56Å; T659-A684 WeakPolarHBondContact O-CA 3.29Å; T659-A684 WeakPolarHBondContact O-CB 3.26Å; F660-A684 HydrophobicContact CD1-CB 3.82Å; F660-A684 HydrophobicContact CE1-CB 3.83Å; F660-A684 HydrophobicContact CG-CB 4.44Å; F660-A684 HydrophobicContact CZ-CB 4.46Å; A684-I727 HydrophobicContact CB-CD1 4.5Å; A684-I727 HydrophobicContact CB-CG2 4.34Å; A684-I727 WeakPolarHBondContact O-CD1 3.38Å; A684-Y729 HydrophobicContact CB-CE1 3.94Å; A684-Y729 PolarHBondContact N-OH 2.72Å; A684-A768 HydrophobicContact CB-CB 3.63Å
685	T	88.2	Confident	75.4	Confident	61 Å²	61	69.1 Å²	69.1	37%	0.374	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.7	179.8	43.4	0	0	0	0	110.7	L214 T659	L214-T685 HydrophobicContact CD2-CG2 3.89Å; T659-T685 PolarHBondContact N-O 3.3Å; T659-T685 PolarHBondContact O-N 3.08Å; T659-T685 PolarHBondContact OG1-O 3.43Å; T659-T685 PolarHBondContact OG1-OG1 3.32Å; T659-T685 VanDerWaalsContact OG1-OG1 3.12Å
686	D	89.3	Confident	72.2	Confident	28 Å²	28	69.5 Å²	69.5	15%	0.15	40%	0.401	C	S	.	.			trans	-134.2	127.1	179.1	-163.9	-47.1	0	0	0	107.8	P658 D688 I727	P658-D686 WeakPolarHBondContact CD-OD2 3.37Å; P658-D686 VanDerWaalsContact CG-OD2 3.26Å; P658-D686 WeakPolarHBondContact CG-OD2 3.49Å; D686-D688 WeakPolarHBondContact OD1-CB 3.27Å; D686-D688 PolarHBondContact OD1-N 2.96Å; D686-D688 VanDerWaalsContact OD1-N 3.08Å; D686-I727 HydrophobicContact CB-CD1 3.72Å; D686-I727 HydrophobicContact CB-CG1 4.14Å
687	P	86.5	Confident	69	Low	65 Å²	65	72 Å²	72	42%	0.422	41%	0.414	S	S	.	.			trans	-86.1	-12.5	-176.3	37.9	-38.5	0	0	0	113.8	R617 E618 N656	R617-P687 PolarHBondContact NH2-O 2.96Å; E618-P687 HydrophobicContact CG-CB 3.8Å; E618-P687 HydrophobicContact CG-CG 4.09Å; N656-P687 HydrophobicContact CB-CG 3.59Å; N656-P687 WeakPolarHBondContact ND2-CG 3.4Å
688	D	86.7	Confident	65.8	Low	8 Å²	8	73.7 Å²	73.7	4%	0.043	43%	0.431	C	S	.	.	S	Bend	trans	-68.3	144.5	-174.5	-66.6	2.7	0	0	0	111.3	N654 D655 N656 D686 Q690	N654-D688 WeakPolarHBondContact CA-OD2 3.17Å; N654-D688 PolarHBondContact ND2-OD2 3.3Å; D655-D688 PolarHBondContact N-OD2 2.8Å; N656-D688 WeakPolarHBondContact CB-OD1 3.29Å; N656-D688 PolarHBondContact N-OD1 2.86Å; N656-D688 PolarHBondContact N-OD2 3.16Å; N656-D688 PolarHBondContact ND2-OD1 3.19Å; D686-D688 WeakPolarHBondContact OD1-CB 3.27Å; D686-D688 PolarHBondContact OD1-N 2.96Å; D686-D688 VanDerWaalsContact OD1-N 3.08Å; D688-Q690 WeakPolarHBondContact O-CG 3.33Å
689	Y	76.4	Confident	62.6	Low	111 Å²	111	77 Å²	77	44%	0.435	45%	0.445	S	S	.	.			trans	-94	134.7	-169.9	-178.1	-95.3	0	0	0	113.4	R617 D652 N691	R617-Y689 VanDerWaalsContact CZ-CB 3.41Å; D652-Y689 VanDerWaalsContact CG-N 3.32Å; D652-Y689 VanDerWaalsContact CG-O 3.25Å; D652-Y689 WeakPolarHBondContact OD1-CA 3.35Å; D652-Y689 WeakPolarHBondContact OD1-CB 3.37Å; D652-Y689 PolarHBondContact OD1-N 3.35Å; D652-Y689 PolarHBondContact OD2-N 2.98Å; Y689-N691 VanDerWaalsContact C-N 3.27Å; Y689-N691 HydrophobicContact CD1-CB 4.37Å; Y689-N691 HydrophobicContact CE1-CB 4.04Å; Y689-N691 PolarHBondContact O-N 2.8Å
690	Q	60.1	Low	59.3	Low	65 Å²	65	86.6 Å²	86.6	30%	0.304	48%	0.479	S	S	.	.	S	Bend	trans	-96.2	47.7	-134.2	-68.2	-177.4	-36.8	0	0	113.6	D688 R726	D688-Q690 WeakPolarHBondContact O-CG 3.33Å; Q690-R726 VanDerWaalsContact CB-NH1 3.33Å; Q690-R726 PolarHBondContact O-NH1 3.31Å; Q690-R726 VanDerWaalsContact O-NH1 3.12Å
691	N	44.9	Very low	56.3	Low	102 Å²	102	88.5 Å²	88.5	55%	0.545	49%	0.491	S	S	.	.			trans	-143.2	42	-167.3	-98	-23.6	0	0	0	114.7	Y689 L693	Y689-N691 VanDerWaalsContact C-N 3.27Å; Y689-N691 HydrophobicContact CD1-CB 4.37Å; Y689-N691 HydrophobicContact CE1-CB 4.04Å; Y689-N691 PolarHBondContact O-N 2.8Å; N691-L693 PolarHBondContact O-N 2.78Å
692	H	35.5	Very low	53.2	Low	57 Å²	57	91.9 Å²	91.9	26%	0.264	51%	0.51	S	S	.	.			trans	-67.2	35.8	166.2	-87.7	74.2	0	0	0	113.9	D652 N654	D652-H692 IonicContact OD2-CE1 2.68Å; D652-H692 PolarHBondContact OD2-CE1 2.94Å; D652-H692 IonicContact OD2-ND1 3.89Å; D652-H692 PolarHBondContact OD2-ND1 2.88Å; D652-H692 VanDerWaalsContact OD2-ND1 3.11Å; N654-H692 PolarHBondContact N-CE1 2.57Å; N654-H692 PolarHBondContact N-NE2 3.32Å
693	L	29.5	Very low	50.2	Low	140 Å²	140	96 Å²	96	73%	0.733	53%	0.532	S	S	*	.			trans	-137.6	57.2	-173.7	-77.4	179.2	0	0	0	114.1	N691	N691-L693 PolarHBondContact O-N 2.78Å
694	S	28.2	Very low	47.6	Very low	117 Å²	117	98.7 Å²	98.7	82%	0.818	55%	0.553	S	S	*	*			trans	-152.9	22.3	152.1	54.1	0	0	0	0	114.6	G696	S694-G696 PolarHBondContact O-N 3.44Å
695	G	25.9	Very low	44.8	Very low	77 Å²	77	103.4 Å²	103.4	79%	0.794	58%	0.577	S	S	*	*			trans	-68	89.3	169.7	0	0	0	0	0	111.2	N697	G695-N697 VanDerWaalsContact C-N 3.29Å; G695-N697 PolarHBondContact O-N 2.99Å
696	G	24.8	Very low	42.3	Very low	69 Å²	69	107.8 Å²	107.8	71%	0.711	59%	0.588	S	S	*	*			trans	-70.6	65.3	-169.2	0	0	0	0	0	116.1	S694 T698	S694-G696 PolarHBondContact O-N 3.44Å; G696-T698 PolarHBondContact O-N 2.72Å
697	N	26.8	Very low	39.6	Very low	152 Å²	152	114.5 Å²	114.5	81%	0.813	62%	0.618	S	S	*	*			trans	-75.3	110	171.1	-101.2	-35.3	0	0	0	111.1	G695 H699	G695-N697 VanDerWaalsContact C-N 3.29Å; G695-N697 PolarHBondContact O-N 2.99Å; N697-H699 PolarHBondContact O-N 2.89Å
698	T	26	Very low	36.9	Very low	135 Å²	135	120.1 Å²	120.1	83%	0.828	63%	0.632	S	S	*	*			trans	-77.3	66.7	-165.6	44.7	0	0	0	0	114.8	G696	G696-T698 PolarHBondContact O-N 2.72Å
699	H	27	Very low	34.4	Very low	165 Å²	165	124.4 Å²	124.4	76%	0.764	66%	0.659	S	S	*	*			trans	-106.5	80.3	175.4	-86	-70.3	0	0	0	114.8	N697	N697-H699 PolarHBondContact O-N 2.89Å
700	R	26.5	Very low	32.3	Very low	235 Å²	235	125.5 Å²	125.5	89%	0.887	67%	0.668	S	S	*	*			trans	47	76.9	153	-66	-176.8	170.2	-174.2	-3.2	117.5	N702	R700-N702 PolarHBondContact O-N 3Å
701	I	32.6	Very low	31	Very low	103 Å²	103	129.4 Å²	129.4	53%	0.528	69%	0.686	S	S	.	*			trans	-92.1	90.7	164	-55.7	-174.1	0	0	0	109.7	D703 Y706	I701-D703 VanDerWaalsContact C-N 3.26Å; I701-D703 HydrophobicContact CG2-CB 3.96Å; I701-Y706 HydrophobicContact CD1-CD2 3.68Å; I701-Y706 HydrophobicContact CD1-CE2 3.44Å; I701-Y706 VanDerWaalsContact CD1-CE2 3.44Å; I701-Y706 HydrophobicContact CG2-CD2 4.2Å
702	N	28	Very low	30.4	Very low	169 Å²	169	131 Å²	131	90%	0.904	69%	0.69	S	S	*	*			trans	-96.8	39.7	157.9	-84.6	4.8	0	0	0	109.7	R700	R700-N702 PolarHBondContact O-N 3Å
703	D	31.8	Very low	30.4	Very low	88 Å²	88	134.3 Å²	134.3	47%	0.471	71%	0.706	S	S	.	*			trans	-107.7	117	178.3	-163.9	-43	0	0	0	109.9	I701 N705	I701-D703 VanDerWaalsContact C-N 3.26Å; I701-D703 HydrophobicContact CG2-CB 3.96Å; D703-N705 PolarHBondContact O-N 3.4Å; D703-N705 VanDerWaalsContact O-N 3.15Å; D703-N705 VanDerWaalsContact OD1-CB 3.32Å; D703-N705 WeakPolarHBondContact OD1-CB 3.4Å; D703-N705 PolarHBondContact OD1-N 2.79Å; D703-N705 PolarHBondContact OD1-ND2 2.92Å
704	P	33.8	Very low	30.5	Very low	121 Å²	121	136.1 Å²	136.1	79%	0.786	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-62.7	-14.7	179	-24	35.1	0	0	0	115.3	Y706	P704-Y706 PolarHBondContact O-N 3.14Å
705	N	32.6	Very low	30.6	Very low	103 Å²	103	138.7 Å²	138.7	55%	0.551	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-85.3	-2.9	-168.6	-61.1	-72.5	0	0	0	114.9	D703 H707 Y708	D703-N705 PolarHBondContact O-N 3.4Å; D703-N705 VanDerWaalsContact O-N 3.15Å; D703-N705 VanDerWaalsContact OD1-CB 3.32Å; D703-N705 WeakPolarHBondContact OD1-CB 3.4Å; D703-N705 PolarHBondContact OD1-N 2.79Å; D703-N705 PolarHBondContact OD1-ND2 2.92Å; N705-H707 PolarHBondContact O-N 3.19Å; N705-Y708 PolarHBondContact O-N 3.12Å; N705-Y708 VanDerWaalsContact O-N 3.08Å
706	Y	34.9	Very low	30.9	Very low	153 Å²	153	140.2 Å²	140.2	60%	0.6	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-61	-14.9	-174.6	-150	-95.4	0	0	0	114.5	I701 P704	I701-Y706 HydrophobicContact CD1-CD2 3.68Å; I701-Y706 HydrophobicContact CD1-CE2 3.44Å; I701-Y706 VanDerWaalsContact CD1-CE2 3.44Å; I701-Y706 HydrophobicContact CG2-CD2 4.2Å; P704-Y706 PolarHBondContact O-N 3.14Å
707	H	33.1	Very low	31.1	Very low	169 Å²	169	144.2 Å²	144.2	78%	0.782	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-79.9	-12.1	177.4	-123.3	50.7	0	0	0	114.9	N705	N705-H707 PolarHBondContact O-N 3.19Å
708	Y	29.8	Very low	31.3	Very low	183 Å²	183	143.9 Å²	143.9	72%	0.718	69%	0.691	S	S	*	*	S	Bend	trans	-85.8	-18.1	-175.9	-94.7	-82.7	0	0	0	115.3	N705	N705-Y708 PolarHBondContact O-N 3.12Å; N705-Y708 VanDerWaalsContact O-N 3.08Å
709	V	34.9	Very low	31.3	Very low	99 Å²	99	142.6 Å²	142.6	60%	0.6	68%	0.679	S	S	*	*	S	Bend	trans	-79.4	-38.5	-174	-176.3	0	0	0	0	112.2	Q711 Q712	V709-Q711 VanDerWaalsContact C-N 3.25Å; V709-Q711 PolarHBondContact O-N 3.12Å; V709-Q711 VanDerWaalsContact O-N 3.16Å; V709-Q712 PolarHBondContact O-N 2.84Å
710	H	32.8	Very low	31.1	Very low	134 Å²	134	139 Å²	139	62%	0.62	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-13.1	-172.4	-102.7	-70	0	0	0	115.6
711	Q	31.5	Very low	31.2	Very low	146 Å²	146	132.7 Å²	132.7	68%	0.682	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-9	-179.3	-71.5	-170.2	-15.7	0	0	114.8	V709	V709-Q711 VanDerWaalsContact C-N 3.25Å; V709-Q711 PolarHBondContact O-N 3.12Å; V709-Q711 VanDerWaalsContact O-N 3.16Å
712	Q	33.1	Very low	31	Very low	135 Å²	135	135.8 Å²	135.8	63%	0.631	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-29	177.4	-65.4	-157.3	-2.2	0	0	113.6	V709 Q714 R715	V709-Q712 PolarHBondContact O-N 2.84Å; Q712-Q714 PolarHBondContact O-N 3.48Å; Q712-Q714 VanDerWaalsContact O-N 3.09Å; Q712-R715 PolarHBondContact O-N 2.96Å
713	Q	34.5	Very low	31.3	Very low	128 Å²	128	130 Å²	130	60%	0.598	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-10.5	-177.5	-72.9	-177.4	-27.8	0	0	114.9
714	Q	31.8	Very low	31.6	Very low	177 Å²	177	127.5 Å²	127.5	83%	0.827	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	1.2	177.4	-72.2	-174.2	-25.9	0	0	114.7	Q712	Q712-Q714 PolarHBondContact O-N 3.48Å; Q712-Q714 VanDerWaalsContact O-N 3.09Å
715	R	31.1	Very low	32.2	Very low	171 Å²	171	124.5 Å²	124.5	65%	0.645	62%	0.619	S	S	*	*	S	Bend	trans	-103.7	7.1	-177.9	-71.9	-166.2	71.5	147.6	0	116.2	Q712	Q712-R715 PolarHBondContact O-N 2.96Å
716	Q	32.4	Very low	34	Very low	109 Å²	109	123.8 Å²	123.8	51%	0.509	61%	0.609	S	S	.	*			trans	-106.2	-1.4	-175	-72.2	-179.3	-66.3	0	0	116	L718 N725	Q716-L718 VanDerWaalsContact C-N 3.33Å; Q716-L718 PolarHBondContact O-N 3.21Å; Q716-N725 PolarHBondContact NE2-OD1 3.4Å; Q716-N725 PolarHBondContact OE1-ND2 2.88Å; Q716-N725 PolarHBondContact OE1-OD1 2.87Å
717	N	27.5	Very low	36.4	Very low	153 Å²	153	117.2 Å²	117.2	82%	0.818	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	30.5	-177.9	-76.9	5.7	0	0	0	114.5
718	L	32.2	Very low	39.2	Very low	145 Å²	145	111.9 Å²	111.9	76%	0.759	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	8.7	-177.9	-146.6	74.3	0	0	0	115.2	Q716	Q716-L718 VanDerWaalsContact C-N 3.33Å; Q716-L718 PolarHBondContact O-N 3.21Å
719	L	26	Very low	42.3	Very low	109 Å²	109	103.3 Å²	103.3	57%	0.571	53%	0.525	S	S	*	.	S	Bend	trans	-126.5	143	161.4	-71.5	173.1	0	0	0	108.2	I721	L719-I721 PolarHBondContact O-N 3.2Å
720	G	23.3	Very low	45.3	Very low	89 Å²	89	102.1 Å²	102.1	92%	0.918	52%	0.518	S	S	*	.	S	Bend	trans	-70.4	27.2	-170	0	0	0	0	0	116.6
721	I	28.6	Very low	48.3	Very low	102 Å²	102	96 Å²	96	52%	0.523	49%	0.489	S	S	.	.			trans	-84.9	120.2	176.9	-58.2	174.6	0	0	0	107.9	L719 S723 T724	L719-I721 PolarHBondContact O-N 3.2Å; I721-S723 VanDerWaalsContact C-N 3.29Å; I721-S723 PolarHBondContact O-N 2.97Å; I721-T724 HydrophobicContact CG2-CG2 3.61Å
722	Q	28.4	Very low	51.4	Low	168 Å²	168	91 Å²	91	79%	0.785	47%	0.467	S	S	*	.			trans	-69.4	81.3	178.9	-73.3	-175.8	-34.7	0	0	112	T724	Q722-T724 PolarHBondContact O-N 2.9Å
723	S	32.7	Very low	54.4	Low	47 Å²	47	88.7 Å²	88.7	33%	0.329	47%	0.466	S	S	.	.			trans	37.8	58.6	169.5	68.4	0	0	0	0	116.5	I721 N725	I721-S723 VanDerWaalsContact C-N 3.29Å; I721-S723 PolarHBondContact O-N 2.97Å; S723-N725 PolarHBondContact O-N 2.93Å; S723-N725 VanDerWaalsContact O-N 3.14Å
724	T	37.9	Very low	57.2	Low	36 Å²	36	86.7 Å²	86.7	22%	0.221	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-64.7	-11.7	173.1	55.2	0	0	0	0	113.9	I721 Q722 R726 I727 D744	I721-T724 HydrophobicContact CG2-CG2 3.61Å; Q722-T724 PolarHBondContact O-N 2.9Å; T724-R726 PolarHBondContact O-N 2.83Å; T724-I727 PolarHBondContact O-N 3.06Å; T724-I727 VanDerWaalsContact O-N 3.14Å; T724-D744 WeakPolarHBondContact CB-O 3.28Å; T724-D744 PolarHBondContact OG1-O 3.4Å
725	N	46.4	Very low	60.1	Low	58 Å²	58	78.3 Å²	78.3	31%	0.31	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-39.7	-8.8	172.9	-89.5	0.9	0	0	0	117.5	Q716 S723 N771	Q716-N725 PolarHBondContact NE2-OD1 3.4Å; Q716-N725 PolarHBondContact OE1-ND2 2.88Å; Q716-N725 PolarHBondContact OE1-OD1 2.87Å; S723-N725 PolarHBondContact O-N 2.93Å; S723-N725 VanDerWaalsContact O-N 3.14Å; N725-N771 PolarHBondContact O-ND2 3.18Å
726	R	71.2	Confident	63.2	Low	88 Å²	88	74.7 Å²	74.7	33%	0.332	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-129.7	-1.8	-165.4	-60.4	-170.1	-91.9	-146.3	-3.9	114.7	Q690 T724 N771	Q690-R726 VanDerWaalsContact CB-NH1 3.33Å; Q690-R726 PolarHBondContact O-NH1 3.31Å; Q690-R726 VanDerWaalsContact O-NH1 3.12Å; T724-R726 PolarHBondContact O-N 2.83Å; R726-N771 PolarHBondContact O-N 3.03Å
727	I	86	Confident	66.1	Low	15 Å²	15	75 Å²	75	8%	0.077	41%	0.412	C	S	.	.	S	Bend	trans	-120.3	118.2	165.8	-59.3	170.1	0	0	0	107.9	P658 A684 D686 T724 Y729 A768 M769	P658-I727 HydrophobicContact CB-CG2 4.3Å; P658-I727 HydrophobicContact CG-CG2 4.49Å; A684-I727 HydrophobicContact CB-CD1 4.5Å; A684-I727 HydrophobicContact CB-CG2 4.34Å; A684-I727 WeakPolarHBondContact O-CD1 3.38Å; D686-I727 HydrophobicContact CB-CD1 3.72Å; D686-I727 HydrophobicContact CB-CG1 4.14Å; T724-I727 PolarHBondContact O-N 3.06Å; T724-I727 VanDerWaalsContact O-N 3.14Å; I727-Y729 HydrophobicContact CB-CE2 4.39Å; I727-Y729 HydrophobicContact CG2-CE1 4.32Å; I727-Y729 HydrophobicContact CG2-CE2 4.11Å; I727-Y729 WeakPolarHBondContact O-CE2 3.35Å; I727-A768 HydrophobicContact CG2-CB 3.75Å; I727-M769 CarbonylContact C-O 3.56Å; I727-M769 VanDerWaalsContact CA-O 3.31Å; I727-M769 WeakPolarHBondContact CA-O 3.13Å
728	K	91.6	Very high	69.2	Low	57 Å²	57	69.6 Å²	69.6	25%	0.248	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	129.1	177.3	-65.6	-57.7	-167.3	-178.9	0	111.6	P743 D744 A768 M769	K728-P743 VanDerWaalsContact CA-O 3.29Å; K728-P743 WeakPolarHBondContact CA-O 3.48Å; K728-D744 IonicContact NZ-OD1 3.19Å; K728-D744 PolarHBondContact NZ-OD1 2.64Å; K728-D744 IonicContact NZ-OD2 2.74Å; K728-D744 PolarHBondContact NZ-OD2 3.23Å; K728-A768 WeakPolarHBondContact O-CA 3.19Å; K728-M769 HydrophobicContact CB-CE 4.43Å; K728-M769 PolarHBondContact N-O 2.93Å; K728-M769 PolarHBondContact O-N 3.2Å
729	Y	95.3	Very high	72.3	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.016	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	133	178.8	-60.8	-89.8	0	0	0	112.4	F660 F682 A684 I727 P743 G746 T767 A768	F660-Y729 HydrophobicContact CE1-CD1 4.45Å; F660-Y729 HydrophobicContact CE1-CE1 4.06Å; F660-Y729 HydrophobicContact CZ-CE1 4.48Å; F682-Y729 HydrophobicContact CB-CD1 4.18Å; F682-Y729 HydrophobicContact CB-CE1 4.11Å; A684-Y729 HydrophobicContact CB-CE1 3.94Å; A684-Y729 PolarHBondContact N-OH 2.72Å; I727-Y729 HydrophobicContact CB-CE2 4.39Å; I727-Y729 HydrophobicContact CG2-CE1 4.32Å; I727-Y729 HydrophobicContact CG2-CE2 4.11Å; I727-Y729 WeakPolarHBondContact O-CE2 3.35Å; Y729-P743 PolarHBondContact N-O 3.23Å; Y729-P743 WeakPolarHBondContact O-CA 3.31Å; Y729-P743 WeakPolarHBondContact O-CB 3.36Å; Y729-G746 VanDerWaalsContact CD2-CA 3.48Å; Y729-T767 CarbonylContact C-O 3.55Å; Y729-T767 WeakPolarHBondContact CA-O 3.31Å; Y729-A768 HydrophobicContact CD1-CB 4.14Å; Y729-A768 HydrophobicContact CE1-CB 4Å
730	V	96.1	Very high	75.7	Confident	74 Å²	74	61.8 Å²	61.8	45%	0.448	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	133.4	179.3	-176.6	0	0	0	0	110.4	T767	V730-T767 PolarHBondContact N-O 2.9Å; V730-T767 PolarHBondContact O-N 2.75Å
731	I	97.5	Very high	79.2	Confident	6 Å²	6	58.7 Å²	58.7	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	147.4	172.2	59.5	174.7	0	0	0	111.3	Q736 L739 I741 L748 F764 N765 V766	I731-Q736 HydrophobicContact CD1-CG 4.42Å; I731-Q736 HydrophobicContact CG1-CG 3.96Å; I731-Q736 PolarHBondContact O-NE2 2.98Å; I731-L739 HydrophobicContact CD1-CB 4.12Å; I731-I741 HydrophobicContact CB-CG2 4.46Å; I731-I741 HydrophobicContact CD1-CB 4.34Å; I731-I741 HydrophobicContact CD1-CG2 4.49Å; I731-I741 HydrophobicContact CG1-CB 4.32Å; I731-I741 HydrophobicContact CG1-CG2 3.98Å; I731-I741 HydrophobicContact CG2-CB 4.03Å; I731-I741 HydrophobicContact CG2-CD1 3.85Å; I731-I741 HydrophobicContact CG2-CG2 4.04Å; I731-L748 HydrophobicContact CD1-CD1 4.26Å; I731-L748 HydrophobicContact CG2-CD1 4.44Å; I731-F764 HydrophobicContact CB-CD2 3.94Å; I731-F764 HydrophobicContact CB-CE2 4.07Å; I731-F764 HydrophobicContact CG2-CD2 3.83Å; I731-F764 HydrophobicContact CG2-CE2 3.47Å; I731-F764 VanDerWaalsContact CG2-CE2 3.47Å; I731-F764 HydrophobicContact CG2-CZ 4.46Å; I731-N765 WeakPolarHBondContact CA-O 3.43Å; I731-V766 HydrophobicContact CG2-CB 4.21Å; I731-V766 HydrophobicContact CG2-CG2 4.05Å
732	D	96.4	Very high	82.3	Confident	39 Å²	39	55.7 Å²	55.7	21%	0.209	28%	0.281	C	S	.	.			trans	-68.5	174.1	179.8	79.4	29.2	0	0	0	114.2	N734 G735 Q736 F764 N765	D732-N734 PolarHBondContact O-N 2.92Å; D732-N734 WeakPolarHBondContact OD1-CA 3.33Å; D732-N734 WeakPolarHBondContact OD1-CB 3.35Å; D732-N734 PolarHBondContact OD1-N 3.27Å; D732-N734 PolarHBondContact OD1-ND2 3.12Å; D732-N734 PolarHBondContact OD2-ND2 3Å; D732-G735 PolarHBondContact O-N 3.09Å; D732-G735 VanDerWaalsContact O-N 3.09Å; D732-G735 PolarHBondContact OD1-N 3.14Å; D732-G735 VanDerWaalsContact OD1-N 3.12Å; D732-Q736 WeakPolarHBondContact O-CG 3.39Å; D732-Q736 PolarHBondContact O-N 3.31Å; D732-F764 WeakPolarHBondContact OD1-CB 3.35Å; D732-F764 WeakPolarHBondContact OD2-CA 3.42Å; D732-N765 PolarHBondContact N-O 3.49Å; D732-N765 VanDerWaalsContact N-O 3.07Å; D732-N765 PolarHBondContact OD2-N 3.15Å
733	S	94.9	Very high	85.4	Confident	88 Å²	88	50.5 Å²	50.5	62%	0.615	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-27.6	-178.4	54.1	0	0	0	0	115	Q737	S733-Q737 PolarHBondContact O-N 3.45Å
734	N	93.7	Very high	88.2	Confident	86 Å²	86	50.7 Å²	50.7	46%	0.46	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-39.2	177.6	-45.5	-53.1	0	0	0	110	D732 F764	D732-N734 PolarHBondContact O-N 2.92Å; D732-N734 WeakPolarHBondContact OD1-CA 3.33Å; D732-N734 WeakPolarHBondContact OD1-CB 3.35Å; D732-N734 PolarHBondContact OD1-N 3.27Å; D732-N734 PolarHBondContact OD1-ND2 3.12Å; D732-N734 PolarHBondContact OD2-ND2 3Å; N734-F764 HydrophobicContact CB-CB 4.36Å
735	G	93.4	Very high	90.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-48.3	171.5	0	0	0	0	0	111.3	D732 Q737 Y738 L739 F764	D732-G735 PolarHBondContact O-N 3.09Å; D732-G735 VanDerWaalsContact O-N 3.09Å; D732-G735 PolarHBondContact OD1-N 3.14Å; D732-G735 VanDerWaalsContact OD1-N 3.12Å; G735-Q737 PolarHBondContact O-N 3.26Å; G735-Y738 PolarHBondContact O-N 3.06Å; G735-Y738 VanDerWaalsContact O-N 3.15Å; G735-L739 WeakPolarHBondContact O-CB 3.43Å; G735-L739 PolarHBondContact O-N 3.11Å; G735-F764 VanDerWaalsContact N-CB 3.34Å
736	Q	94.7	Very high	92.8	Very high	96 Å²	96	48 Å²	48	45%	0.449	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-15.2	179.8	-68.1	179.3	29	0	0	114.5	I731 D732 K751	I731-Q736 HydrophobicContact CD1-CG 4.42Å; I731-Q736 HydrophobicContact CG1-CG 3.96Å; I731-Q736 PolarHBondContact O-NE2 2.98Å; D732-Q736 WeakPolarHBondContact O-CG 3.39Å; D732-Q736 PolarHBondContact O-N 3.31Å; Q736-K751 PolarHBondContact O-NZ 3.36Å
737	Q	93.3	Very high	94	Very high	116 Å²	116	45.1 Å²	45.1	54%	0.542	24%	0.235	S	C	.	.	H	α-helix	trans	-67.2	-42.8	174.2	-176.8	174.9	-5.9	0	0	111.7	S733 G735	S733-Q737 PolarHBondContact O-N 3.45Å; G735-Q737 PolarHBondContact O-N 3.26Å
738	Y	94.6	Very high	94.5	Very high	39 Å²	39	44.4 Å²	44.4	15%	0.153	23%	0.232	C	C	.	.	H	α-helix	trans	-111.1	-24.9	-171.9	-61.3	-77	0	0	0	113.9	G735 K751 V752 V754 V759 F762	G735-Y738 PolarHBondContact O-N 3.06Å; G735-Y738 VanDerWaalsContact O-N 3.15Å; Y738-K751 WeakPolarHBondContact O-CB 2.91Å; Y738-K751 PolarHBondContact O-N 2.85Å; Y738-V752 HydrophobicContact CD1-CG2 4.04Å; Y738-V752 PolarHBondContact O-N 3.05Å; Y738-V754 HydrophobicContact CD1-CG2 4.24Å; Y738-V759 HydrophobicContact CE1-CG2 4.49Å; Y738-V759 WeakPolarHBondContact OH-CG2 3.36Å; Y738-F762 HydrophobicContact CD2-CD2 4.14Å; Y738-F762 HydrophobicContact CD2-CE2 4.15Å; Y738-F762 HydrophobicContact CD2-CG 4.37Å; Y738-F762 HydrophobicContact CD2-CZ 4.39Å; Y738-F762 HydrophobicContact CG-CE2 4.47Å; Y738-F762 HydrophobicContact CG-CZ 4.33Å
739	L	96.5	Very high	94.8	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	167.6	-168.3	-51.3	-177.4	0	0	0	111.6	I669 I679 I731 G735 L748 Y749 K751 F762 F764 I784	I669-L739 HydrophobicContact CD1-CD2 4.49Å; I679-L739 HydrophobicContact CD1-CD2 3.4Å; I679-L739 VanDerWaalsContact CD1-CD2 3.4Å; I731-L739 HydrophobicContact CD1-CB 4.12Å; G735-L739 WeakPolarHBondContact O-CB 3.43Å; G735-L739 PolarHBondContact O-N 3.11Å; L739-L748 HydrophobicContact CB-CD1 4.1Å; L739-L748 HydrophobicContact CD1-CD1 3.88Å; L739-L748 HydrophobicContact CD1-CD2 3.98Å; L739-L748 HydrophobicContact CD1-CG 4.14Å; L739-Y749 WeakPolarHBondContact CA-O 3.31Å; L739-Y749 WeakPolarHBondContact CB-O 3.38Å; L739-K751 VanDerWaalsContact C-CB 3.47Å; L739-K751 VanDerWaalsContact O-CD 3.3Å; L739-K751 WeakPolarHBondContact O-CD 3.26Å; L739-F762 HydrophobicContact CD1-CE2 3.87Å; L739-F762 HydrophobicContact CD1-CZ 4Å; L739-F762 HydrophobicContact CD2-CZ 4.2Å; L739-F762 HydrophobicContact CG-CE2 4.07Å; L739-F762 HydrophobicContact CG-CZ 4.05Å; L739-F764 HydrophobicContact CD1-CD1 4.31Å; L739-F764 HydrophobicContact CD1-CE1 3.49Å; L739-F764 VanDerWaalsContact CD1-CE1 3.49Å; L739-F764 HydrophobicContact CD1-CZ 3.9Å; L739-I784 HydrophobicContact CD1-CG1 4.29Å
740	R	96.4	Very high	94.8	Very high	88 Å²	88	43.3 Å²	43.3	33%	0.332	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.4	162.3	65.4	177	-177.3	73.2	4.7	109.3	D676 Y749 K751	D676-R740 IonicContact OD1-CZ 3.32Å; D676-R740 IonicContact OD1-NE 3.79Å; D676-R740 PolarHBondContact OD1-NE 2.8Å; D676-R740 IonicContact OD1-NH2 2.86Å; D676-R740 PolarHBondContact OD1-NH2 2.75Å; R740-Y749 HydrophobicContact CG-CD2 4.49Å; R740-Y749 PolarHBondContact N-O 2.81Å; R740-Y749 PolarHBondContact O-N 3.08Å; R740-K751 HydrophobicContact CB-CB 4.42Å
741	I	97.2	Very high	94.7	Very high	24 Å²	24	44.7 Å²	44.7	12%	0.123	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.9	170.5	-162.3	162.4	0	0	0	108.6	F682 I731 I747 L748 V766	F682-I741 HydrophobicContact CD2-CD1 3.66Å; F682-I741 HydrophobicContact CE2-CD1 4.16Å; I731-I741 HydrophobicContact CB-CG2 4.46Å; I731-I741 HydrophobicContact CD1-CB 4.34Å; I731-I741 HydrophobicContact CD1-CG2 4.49Å; I731-I741 HydrophobicContact CG1-CB 4.32Å; I731-I741 HydrophobicContact CG1-CG2 3.98Å; I731-I741 HydrophobicContact CG2-CB 4.03Å; I731-I741 HydrophobicContact CG2-CD1 3.85Å; I731-I741 HydrophobicContact CG2-CG2 4.04Å; I741-I747 WeakPolarHBondContact CA-O 3.47Å; I741-L748 HydrophobicContact CB-CD1 4.47Å; I741-V766 HydrophobicContact CD1-CG2 3.83Å
742	D	94.9	Very high	94.5	Very high	40 Å²	40	47.2 Å²	47.2	21%	0.214	24%	0.242	C	C	.	.			trans	-77.5	119.9	163.4	176.3	-15.9	0	0	0	108.4	D744 T745 G746 I747 Y749	D742-D744 PolarHBondContact O-N 2.85Å; D742-D744 PolarHBondContact OD1-N 3.47Å; D742-T745 VanDerWaalsContact CB-OG1 3.26Å; D742-T745 WeakPolarHBondContact CB-OG1 3.47Å; D742-T745 PolarHBondContact OD1-N 2.97Å; D742-T745 WeakPolarHBondContact OD2-CG2 3.29Å; D742-T745 PolarHBondContact OD2-OG1 2.65Å; D742-G746 WeakPolarHBondContact O-CA 3.35Å; D742-G746 PolarHBondContact O-N 3.13Å; D742-I747 PolarHBondContact N-O 3.12Å; D742-Y749 HydrophobicContact CB-CE2 4.07Å
743	P	93.8	Very high	94.3	Very high	59 Å²	59	50.9 Å²	50.9	38%	0.383	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.1	-176.2	32	-37.1	0	0	0	113.9	K728 Y729	K728-P743 VanDerWaalsContact CA-O 3.29Å; K728-P743 WeakPolarHBondContact CA-O 3.48Å; Y729-P743 PolarHBondContact N-O 3.23Å; Y729-P743 WeakPolarHBondContact O-CA 3.31Å; Y729-P743 WeakPolarHBondContact O-CB 3.36Å
744	D	90.1	Very high	94.2	Very high	51 Å²	51	46.8 Å²	46.8	27%	0.273	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-19.9	-175.5	-82.6	-77.4	0	0	0	113.5	T724 K728 D742	T724-D744 WeakPolarHBondContact CB-O 3.28Å; T724-D744 PolarHBondContact OG1-O 3.4Å; K728-D744 IonicContact NZ-OD1 3.19Å; K728-D744 PolarHBondContact NZ-OD1 2.64Å; K728-D744 IonicContact NZ-OD2 2.74Å; K728-D744 PolarHBondContact NZ-OD2 3.23Å; D742-D744 PolarHBondContact O-N 2.85Å; D742-D744 PolarHBondContact OD1-N 3.47Å
745	T	90	Very high	94.1	Very high	37 Å²	37	45.6 Å²	45.6	23%	0.227	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-12.9	178.8	66.1	0	0	0	0	114.2	D742 I747	D742-T745 VanDerWaalsContact CB-OG1 3.26Å; D742-T745 WeakPolarHBondContact CB-OG1 3.47Å; D742-T745 PolarHBondContact OD1-N 2.97Å; D742-T745 WeakPolarHBondContact OD2-CG2 3.29Å; D742-T745 PolarHBondContact OD2-OG1 2.65Å; T745-I747 PolarHBondContact O-N 2.5Å; T745-I747 WeakPolarHBondContact OG1-CD1 3.19Å; T745-I747 VanDerWaalsContact OG1-CG1 3.27Å; T745-I747 WeakPolarHBondContact OG1-CG1 3.5Å; T745-I747 PolarHBondContact OG1-N 3.32Å
746	G	91.8	Very high	94.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.226	C	C	.	.			trans	71.5	6.1	-176.2	0	0	0	0	0	114.3	F682 Y729 D742 L748	F682-G746 WeakPolarHBondContact CD2-O 3.15Å; F682-G746 PolarHBondContact N-O 2.78Å; Y729-G746 VanDerWaalsContact CD2-CA 3.48Å; D742-G746 WeakPolarHBondContact O-CA 3.35Å; D742-G746 PolarHBondContact O-N 3.13Å; G746-L748 PolarHBondContact O-N 3.27Å
747	I	95.9	Very high	93.8	Very high	27 Å²	27	47.1 Å²	47.1	14%	0.138	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	124.5	179.2	-56.9	169.3	0	0	0	109.8	I678 I681 I741 D742 T745 Y749	I678-I747 HydrophobicContact CB-CG2 4.45Å; I678-I747 HydrophobicContact CD1-CG2 4.27Å; I678-I747 HydrophobicContact CG1-CG2 3.95Å; I678-I747 HydrophobicContact CG2-CG2 3.88Å; I681-I747 HydrophobicContact CD1-CG1 4.26Å; I681-I747 HydrophobicContact CG1-CG1 4.09Å; I681-I747 HydrophobicContact CG2-CG1 4.02Å; I741-I747 WeakPolarHBondContact CA-O 3.47Å; D742-I747 PolarHBondContact N-O 3.12Å; T745-I747 PolarHBondContact O-N 2.5Å; T745-I747 WeakPolarHBondContact OG1-CD1 3.19Å; T745-I747 VanDerWaalsContact OG1-CG1 3.27Å; T745-I747 WeakPolarHBondContact OG1-CG1 3.5Å; T745-I747 PolarHBondContact OG1-N 3.32Å; I747-Y749 HydrophobicContact CB-CD2 4.39Å; I747-Y749 HydrophobicContact CB-CE2 3.64Å; I747-Y749 HydrophobicContact CG2-CD1 4.45Å; I747-Y749 HydrophobicContact CG2-CD2 3.97Å; I747-Y749 HydrophobicContact CG2-CE1 3.98Å; I747-Y749 HydrophobicContact CG2-CE2 3.43Å; I747-Y749 VanDerWaalsContact CG2-CE2 3.43Å; I747-Y749 HydrophobicContact CG2-CG 4.46Å; I747-Y749 VanDerWaalsContact CG2-CZ 3.42Å; I747-Y749 WeakPolarHBondContact O-CD2 3.46Å; I747-Y749 WeakPolarHBondContact O-CE2 3.07Å
748	L	97.3	Very high	93.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	121	177.6	-176	72.2	0	0	0	109.6	L667 I679 F680 F682 I731 L739 I741 G746 F764	L667-L748 HydrophobicContact CD1-CD2 4.11Å; I679-L748 HydrophobicContact CB-CD2 4.31Å; I679-L748 HydrophobicContact CB-CG 4.47Å; I679-L748 HydrophobicContact CG2-CD2 4.2Å; I679-L748 PolarHBondContact N-O 3.06Å; F680-L748 HydrophobicContact CB-CB 4.39Å; F680-L748 HydrophobicContact CB-CD2 4.36Å; F680-L748 PolarHBondContact N-O 2.94Å; F680-L748 PolarHBondContact O-N 2.71Å; F682-L748 HydrophobicContact CD2-CB 4.32Å; F682-L748 HydrophobicContact CE2-CB 3.92Å; F682-L748 HydrophobicContact CE2-CD1 4.22Å; F682-L748 HydrophobicContact CE2-CD2 3.89Å; F682-L748 HydrophobicContact CE2-CG 4.23Å; F682-L748 HydrophobicContact CZ-CD2 4.26Å; I731-L748 HydrophobicContact CD1-CD1 4.26Å; I731-L748 HydrophobicContact CG2-CD1 4.44Å; L739-L748 HydrophobicContact CB-CD1 4.1Å; L739-L748 HydrophobicContact CD1-CD1 3.88Å; L739-L748 HydrophobicContact CD1-CD2 3.98Å; L739-L748 HydrophobicContact CD1-CG 4.14Å; I741-L748 HydrophobicContact CB-CD1 4.47Å; G746-L748 PolarHBondContact O-N 3.27Å; L748-F764 HydrophobicContact CD1-CE2 4.48Å; L748-F764 HydrophobicContact CD1-CZ 4.01Å; L748-F764 HydrophobicContact CD2-CZ 3.94Å
749	Y	96.5	Very high	93.6	Very high	39 Å²	39	46.8 Å²	46.8	15%	0.153	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	152.5	-179.2	-58.6	-97.6	0	0	0	112.4	D676 E677 I678 L739 R740 D742 I747	D676-Y749 WeakPolarHBondContact O-CD1 3.37Å; E677-Y749 CarbonylContact O-C 3.55Å; E677-Y749 WeakPolarHBondContact O-CA 3.37Å; I678-Y749 HydrophobicContact CD1-CE1 4.29Å; I678-Y749 HydrophobicContact CG1-CD1 3.91Å; I678-Y749 HydrophobicContact CG1-CE1 3.55Å; L739-Y749 WeakPolarHBondContact CA-O 3.31Å; L739-Y749 WeakPolarHBondContact CB-O 3.38Å; R740-Y749 HydrophobicContact CG-CD2 4.49Å; R740-Y749 PolarHBondContact N-O 2.81Å; R740-Y749 PolarHBondContact O-N 3.08Å; D742-Y749 HydrophobicContact CB-CE2 4.07Å; I747-Y749 HydrophobicContact CB-CD2 4.39Å; I747-Y749 HydrophobicContact CB-CE2 3.64Å; I747-Y749 HydrophobicContact CG2-CD1 4.45Å; I747-Y749 HydrophobicContact CG2-CD2 3.97Å; I747-Y749 HydrophobicContact CG2-CE1 3.98Å; I747-Y749 HydrophobicContact CG2-CE2 3.43Å; I747-Y749 VanDerWaalsContact CG2-CE2 3.43Å; I747-Y749 HydrophobicContact CG2-CG 4.46Å; I747-Y749 VanDerWaalsContact CG2-CZ 3.42Å; I747-Y749 WeakPolarHBondContact O-CD2 3.46Å; I747-Y749 WeakPolarHBondContact O-CE2 3.07Å
750	S	95.8	Very high	93.4	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	140.1	161	57.3	0	0	0	0	110.3	P674 P675 D676 E677	P674-S750 PolarHBondContact O-OG 3.14Å; P675-S750 WeakPolarHBondContact CA-OG 3.48Å; D676-S750 PolarHBondContact N-O 3.17Å; D676-S750 PolarHBondContact N-OG 3.01Å; D676-S750 VanDerWaalsContact N-OG 3.13Å; E677-S750 PolarHBondContact N-OG 2.85Å; E677-S750 PolarHBondContact O-N 3.25Å; E677-S750 PolarHBondContact O-OG 2.9Å
751	K	94.4	Very high	93.4	Very high	103 Å²	103	51.6 Å²	51.6	45%	0.448	26%	0.257	S	S	.	.	S	Bend	trans	-114.5	-26.3	175.4	170.9	-175.7	170.8	-177.7	0	112.1	Q736 Y738 L739 R740	Q736-K751 PolarHBondContact O-NZ 3.36Å; Y738-K751 WeakPolarHBondContact O-CB 2.91Å; Y738-K751 PolarHBondContact O-N 2.85Å; L739-K751 VanDerWaalsContact C-CB 3.47Å; L739-K751 VanDerWaalsContact O-CD 3.3Å; L739-K751 WeakPolarHBondContact O-CD 3.26Å; R740-K751 HydrophobicContact CB-CB 4.42Å
752	V	93.5	Very high	93.3	Very high	58 Å²	58	51.6 Å²	51.6	35%	0.352	26%	0.256	S	S	.	.	S	Bend	trans	-137.4	161	171.1	-60.5	0	0	0	0	108.6	Y738 V754	Y738-V752 HydrophobicContact CD1-CG2 4.04Å; Y738-V752 PolarHBondContact O-N 3.05Å; V752-V754 PolarHBondContact O-N 3.36Å
753	K	92.2	Very high	93.3	Very high	116 Å²	116	55 Å²	55	50%	0.504	27%	0.268	S	S	.	.			trans	-62	124.3	162	-71.4	-170.6	163.2	-127.3	0	108.8	N672	N672-K753 VanDerWaalsContact O-CE 3.24Å; N672-K753 WeakPolarHBondContact O-CE 3.3Å; N672-K753 PolarHBondContact O-NZ 3.43Å; N672-K753 PolarHBondContact OD1-NZ 3.36Å
754	V	92.4	Very high	93.5	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.012	25%	0.251	C	S	.	.			trans	-88.4	141.1	170.7	-170.2	0	0	0	0	108.1	I669 E671 N672 Y738 V752 V786	I669-V754 HydrophobicContact CD1-CG2 4.19Å; E671-V754 CarbonylContact C-O 3.58Å; E671-V754 WeakPolarHBondContact CA-O 3.5Å; E671-V754 WeakPolarHBondContact CB-O 3.48Å; N672-V754 PolarHBondContact N-O 2.9Å; Y738-V754 HydrophobicContact CD1-CG2 4.24Å; V752-V754 PolarHBondContact O-N 3.36Å; V754-V786 HydrophobicContact CG1-CG1 4.17Å; V754-V786 HydrophobicContact CG1-CG2 3.74Å
755	D	90.8	Very high	93.9	Very high	62 Å²	62	53 Å²	53	33%	0.332	25%	0.254	S	S	.	.			trans	-119.8	124.3	179.8	163.6	-31.1	0	0	0	106.1	K757 I758 V759	D755-K757 VanDerWaalsContact C-N 3.34Å; D755-K757 VanDerWaalsContact OD1-CA 3.28Å; D755-K757 WeakPolarHBondContact OD1-CA 3.42Å; D755-K757 WeakPolarHBondContact OD1-CB 3.28Å; D755-K757 PolarHBondContact OD1-N 3.48Å; D755-I758 HydrophobicContact CB-CB 4.27Å; D755-I758 HydrophobicContact CB-CD1 4.01Å; D755-I758 HydrophobicContact CB-CG1 4.18Å; D755-I758 PolarHBondContact O-N 2.82Å; D755-I758 PolarHBondContact OD1-N 3.21Å; D755-I758 WeakPolarHBondContact OD2-CD1 3.49Å; D755-V759 PolarHBondContact O-N 3.26Å
756	K	93.3	Very high	94.2	Very high	24 Å²	24	51.2 Å²	51.2	10%	0.104	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-31.7	-174.3	-171.7	-167.8	175	53.7	0	112.5	E671 I758 V759 D760 V786 D788 F825	E671-K756 HydrophobicContact CB-CB 4.3Å; E671-K756 WeakPolarHBondContact OE2-CB 3.5Å; E671-K756 PolarHBondContact OE2-N 2.63Å; K756-I758 PolarHBondContact O-N 2.91Å; K756-V759 WeakPolarHBondContact CA-O 3.42Å; K756-V759 CarbonylContact O-C 3.46Å; K756-V759 PolarHBondContact O-N 3.49Å; K756-D760 IonicContact NZ-OD1 2.65Å; K756-D760 PolarHBondContact NZ-OD1 3.44Å; K756-D760 PolarHBondContact O-N 2.91Å; K756-V786 HydrophobicContact CB-CB 4.4Å; K756-V786 HydrophobicContact CB-CG1 3.81Å; K756-V786 HydrophobicContact CG-CB 4.28Å; K756-V786 HydrophobicContact CG-CG1 4.18Å; K756-V786 PolarHBondContact NZ-O 2.9Å; K756-D788 HydrophobicContact CD-CB 3.9Å; K756-D788 WeakPolarHBondContact CD-OD1 3.43Å; K756-D788 VanDerWaalsContact CE-OD1 3.31Å; K756-D788 WeakPolarHBondContact CE-OD1 3.24Å; K756-F825 HydrophobicContact CD-CD2 3.84Å; K756-F825 HydrophobicContact CD-CE2 4.3Å; K756-F825 HydrophobicContact CD-CG 4.3Å; K756-F825 HydrophobicContact CG-CD2 4.47Å; K756-F825 HydrophobicContact CG-CE2 4.45Å
757	K	90.2	Very high	94.4	Very high	103 Å²	103	52.9 Å²	52.9	45%	0.448	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-32	175.2	-151.3	-161.2	-154.6	80.6	0	111.3	D755 D823 F825	D755-K757 VanDerWaalsContact C-N 3.34Å; D755-K757 VanDerWaalsContact OD1-CA 3.28Å; D755-K757 WeakPolarHBondContact OD1-CA 3.42Å; D755-K757 WeakPolarHBondContact OD1-CB 3.28Å; D755-K757 PolarHBondContact OD1-N 3.48Å; K757-D823 WeakPolarHBondContact CE-OD1 3.48Å; K757-D823 VanDerWaalsContact NZ-CG 3.25Å; K757-D823 PolarHBondContact NZ-O 2.78Å; K757-D823 IonicContact NZ-OD1 2.72Å; K757-D823 PolarHBondContact NZ-OD1 3.3Å; K757-F825 HydrophobicContact CB-CE2 4.12Å; K757-F825 HydrophobicContact CB-CZ 4.39Å; K757-F825 HydrophobicContact CG-CE2 4.18Å; K757-F825 HydrophobicContact CG-CZ 4.17Å
758	I	90.6	Very high	94.4	Very high	125 Å²	125	51.6 Å²	51.6	64%	0.641	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-43.2	174.1	-60.8	176.3	0	0	0	111.2	D755 K756	D755-I758 HydrophobicContact CB-CB 4.27Å; D755-I758 HydrophobicContact CB-CD1 4.01Å; D755-I758 HydrophobicContact CB-CG1 4.18Å; D755-I758 PolarHBondContact O-N 2.82Å; D755-I758 PolarHBondContact OD1-N 3.21Å; D755-I758 WeakPolarHBondContact OD2-CD1 3.49Å; K756-I758 PolarHBondContact O-N 2.91Å
759	V	92.1	Very high	94.1	Very high	24 Å²	24	54.8 Å²	54.8	15%	0.145	26%	0.263	C	S	.	.			trans	-142.4	107.2	177.6	170.2	0	0	0	0	111.3	Y738 D755 K756 F762 V786	Y738-V759 HydrophobicContact CE1-CG2 4.49Å; Y738-V759 WeakPolarHBondContact OH-CG2 3.36Å; D755-V759 PolarHBondContact O-N 3.26Å; K756-V759 WeakPolarHBondContact CA-O 3.42Å; K756-V759 CarbonylContact O-C 3.46Å; K756-V759 PolarHBondContact O-N 3.49Å; V759-F762 HydrophobicContact CG1-CB 3.95Å; V759-F762 HydrophobicContact CG1-CD1 3.68Å; V759-F762 HydrophobicContact CG1-CG 4.25Å; V759-V786 WeakPolarHBondContact O-CB 3.1Å; V759-V786 WeakPolarHBondContact O-CG2 2.98Å
760	D	93	Very high	93.8	Very high	68 Å²	68	53.2 Å²	53.2	36%	0.364	26%	0.257	S	S	.	.	S	Bend	trans	-71.3	-39.9	171.7	168.7	62.7	0	0	0	112.3	K756 V786	K756-D760 IonicContact NZ-OD1 2.65Å; K756-D760 PolarHBondContact NZ-OD1 3.44Å; K756-D760 PolarHBondContact O-N 2.91Å; D760-V786 WeakPolarHBondContact O-CB 3.26Å; D760-V786 PolarHBondContact O-N 3.47Å
761	K	95.1	Very high	93.2	Very high	121 Å²	121	57 Å²	57	53%	0.526	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	141.7	-177.9	-74.5	160.4	-172.2	55.6	0	110.5	I784 N785	K761-I784 VanDerWaalsContact CA-O 3.31Å; K761-I784 WeakPolarHBondContact CA-O 3.2Å; K761-N785 WeakPolarHBondContact CE-OD1 3.45Å; K761-N785 HydrophobicContact CG-CB 4.23Å; K761-N785 PolarHBondContact NZ-OD1 2.99Å
762	F	95.2	Very high	92.5	Very high	25 Å²	25	52.2 Å²	52.2	11%	0.11	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	163.2	169.7	63.7	-79.9	0	0	0	111.2	Y738 L739 V759 F764 I784 V786	Y738-F762 HydrophobicContact CD2-CD2 4.14Å; Y738-F762 HydrophobicContact CD2-CE2 4.15Å; Y738-F762 HydrophobicContact CD2-CG 4.37Å; Y738-F762 HydrophobicContact CD2-CZ 4.39Å; Y738-F762 HydrophobicContact CG-CE2 4.47Å; Y738-F762 HydrophobicContact CG-CZ 4.33Å; L739-F762 HydrophobicContact CD1-CE2 3.87Å; L739-F762 HydrophobicContact CD1-CZ 4Å; L739-F762 HydrophobicContact CD2-CZ 4.2Å; L739-F762 HydrophobicContact CG-CE2 4.07Å; L739-F762 HydrophobicContact CG-CZ 4.05Å; V759-F762 HydrophobicContact CG1-CB 3.95Å; V759-F762 HydrophobicContact CG1-CD1 3.68Å; V759-F762 HydrophobicContact CG1-CG 4.25Å; F762-F764 HydrophobicContact CD2-CD1 4.33Å; F762-F764 HydrophobicContact CE2-CD1 4.16Å; F762-F764 HydrophobicContact CE2-CE1 4.37Å; F762-I784 HydrophobicContact CD1-CB 3.88Å; F762-I784 HydrophobicContact CD1-CG2 4.14Å; F762-I784 HydrophobicContact CD2-CB 4.31Å; F762-I784 HydrophobicContact CD2-CG1 4.21Å; F762-I784 HydrophobicContact CE1-CB 3.59Å; F762-I784 HydrophobicContact CE1-CG1 4.1Å; F762-I784 HydrophobicContact CE1-CG2 3.47Å; F762-I784 VanDerWaalsContact CE1-CG2 3.47Å; F762-I784 HydrophobicContact CE2-CB 4.04Å; F762-I784 HydrophobicContact CE2-CG1 3.68Å; F762-I784 HydrophobicContact CG-CB 4.25Å; F762-I784 HydrophobicContact CZ-CB 3.68Å; F762-I784 HydrophobicContact CZ-CG1 3.63Å; F762-I784 HydrophobicContact CZ-CG2 3.73Å; F762-I784 PolarHBondContact N-O 2.98Å; F762-I784 PolarHBondContact O-N 2.64Å; F762-V786 HydrophobicContact CD1-CG2 4.41Å; F762-V786 HydrophobicContact CE1-CG2 4.26Å
763	K	96.4	Very high	91.8	Very high	110 Å²	110	55.8 Å²	55.8	48%	0.478	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	149.5	177	73.1	170	-158.3	160.6	0	111.6	E781 V782 F783	K763-E781 WeakPolarHBondContact CD-OE1 3.13Å; K763-E781 IonicContact NZ-OE1 3.81Å; K763-E781 PolarHBondContact NZ-OE1 3.36Å; K763-V782 WeakPolarHBondContact CA-O 3.35Å; K763-V782 WeakPolarHBondContact CB-O 3.3Å; K763-F783 HydrophobicContact CB-CD1 3.94Å; K763-F783 HydrophobicContact CB-CE1 4.09Å; K763-F783 HydrophobicContact CB-CG 4.49Å; K763-F783 HydrophobicContact CD-CE1 3.82Å; K763-F783 HydrophobicContact CD-CZ 4.21Å
764	F	97.2	Very high	91.4	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.009	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	158.9	176.7	65.5	-91.1	0	0	0	109.9	I731 D732 N734 G735 L739 L748 F762 V766 V782 I784	I731-F764 HydrophobicContact CB-CD2 3.94Å; I731-F764 HydrophobicContact CB-CE2 4.07Å; I731-F764 HydrophobicContact CG2-CD2 3.83Å; I731-F764 HydrophobicContact CG2-CE2 3.47Å; I731-F764 VanDerWaalsContact CG2-CE2 3.47Å; I731-F764 HydrophobicContact CG2-CZ 4.46Å; D732-F764 WeakPolarHBondContact OD1-CB 3.35Å; D732-F764 WeakPolarHBondContact OD2-CA 3.42Å; N734-F764 HydrophobicContact CB-CB 4.36Å; G735-F764 VanDerWaalsContact N-CB 3.34Å; L739-F764 HydrophobicContact CD1-CD1 4.31Å; L739-F764 HydrophobicContact CD1-CE1 3.49Å; L739-F764 VanDerWaalsContact CD1-CE1 3.49Å; L739-F764 HydrophobicContact CD1-CZ 3.9Å; L748-F764 HydrophobicContact CD1-CE2 4.48Å; L748-F764 HydrophobicContact CD1-CZ 4.01Å; L748-F764 HydrophobicContact CD2-CZ 3.94Å; F762-F764 HydrophobicContact CD2-CD1 4.33Å; F762-F764 HydrophobicContact CE2-CD1 4.16Å; F762-F764 HydrophobicContact CE2-CE1 4.37Å; F764-V766 HydrophobicContact CE2-CB 4.37Å; F764-V782 HydrophobicContact CD1-CB 4.19Å; F764-V782 HydrophobicContact CD1-CG1 4.45Å; F764-V782 HydrophobicContact CD2-CB 4.12Å; F764-V782 HydrophobicContact CD2-CG2 4.18Å; F764-V782 HydrophobicContact CE1-CB 3.86Å; F764-V782 HydrophobicContact CE1-CG1 3.7Å; F764-V782 HydrophobicContact CE2-CB 3.76Å; F764-V782 HydrophobicContact CE2-CG1 4.16Å; F764-V782 HydrophobicContact CE2-CG2 3.66Å; F764-V782 HydrophobicContact CG-CB 4.32Å; F764-V782 HydrophobicContact CZ-CB 3.63Å; F764-V782 HydrophobicContact CZ-CG1 3.53Å; F764-V782 HydrophobicContact CZ-CG2 3.93Å; F764-V782 PolarHBondContact N-O 2.85Å; F764-V782 WeakPolarHBondContact O-CB 2.9Å; F764-V782 PolarHBondContact O-N 2.66Å; F764-I784 HydrophobicContact CD1-CG1 4.32Å; F764-I784 HydrophobicContact CE1-CD1 3.91Å; F764-I784 HydrophobicContact CE1-CG1 3.7Å
765	N	97.4	Very high	91.1	Very high	66 Å²	66	58.5 Å²	58.5	35%	0.353	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	133.4	170.1	-65.1	-22.4	0	0	0	110.3	I731 D732 A780	I731-N765 WeakPolarHBondContact CA-O 3.43Å; D732-N765 PolarHBondContact N-O 3.49Å; D732-N765 VanDerWaalsContact N-O 3.07Å; D732-N765 PolarHBondContact OD2-N 3.15Å; N765-A780 WeakPolarHBondContact CA-O 3.18Å
766	V	97.5	Very high	91.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	136.6	163.1	65.6	0	0	0	0	108.8	F660 F682 I731 I741 F764 T779 A780 V782	F660-V766 HydrophobicContact CE1-CG1 4.41Å; F660-V766 HydrophobicContact CE2-CG1 4.14Å; F660-V766 HydrophobicContact CZ-CG1 3.82Å; F660-V766 HydrophobicContact CZ-CG2 4.19Å; F682-V766 HydrophobicContact CD1-CG1 4.05Å; F682-V766 HydrophobicContact CD2-CG2 4.03Å; F682-V766 HydrophobicContact CE1-CG1 3.85Å; F682-V766 HydrophobicContact CE2-CB 4.42Å; F682-V766 HydrophobicContact CE2-CG2 4.17Å; F682-V766 HydrophobicContact CG-CG2 4.2Å; F682-V766 HydrophobicContact CZ-CB 4.35Å; F682-V766 HydrophobicContact CZ-CG1 4.15Å; I731-V766 HydrophobicContact CG2-CB 4.21Å; I731-V766 HydrophobicContact CG2-CG2 4.05Å; I741-V766 HydrophobicContact CD1-CG2 3.83Å; F764-V766 HydrophobicContact CE2-CB 4.37Å; V766-T779 CarbonylContact O-C 3.55Å; V766-T779 VanDerWaalsContact O-CA 3.31Å; V766-T779 WeakPolarHBondContact O-CA 3.38Å; V766-A780 HydrophobicContact CG1-CB 4.02Å; V766-A780 PolarHBondContact N-O 3.26Å; V766-A780 PolarHBondContact O-N 2.66Å; V766-V782 HydrophobicContact CB-CG2 4.07Å; V766-V782 HydrophobicContact CG1-CG2 3.68Å
767	T	96.3	Very high	91.1	Very high	36 Å²	36	61.9 Å²	61.9	22%	0.221	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.8	177.9	-46.2	0	0	0	0	108.3	Y729 V730 N777 I778 T779	Y729-T767 CarbonylContact C-O 3.55Å; Y729-T767 WeakPolarHBondContact CA-O 3.31Å; V730-T767 PolarHBondContact N-O 2.9Å; V730-T767 PolarHBondContact O-N 2.75Å; T767-N777 HydrophobicContact CG2-CB 3.96Å; T767-I778 CarbonylContact C-O 3.57Å; T767-I778 VanDerWaalsContact CA-O 3.29Å; T767-I778 WeakPolarHBondContact CA-O 3.3Å; T767-T779 HydrophobicContact CG2-CG2 4.1Å
768	A	94.4	Very high	91.2	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.8	164.2	0	0	0	0	0	108	P658 F660 A684 I727 K728 Y729 N777 I778	P658-A768 HydrophobicContact CB-CB 4.13Å; F660-A768 HydrophobicContact CE1-CB 4.12Å; F660-A768 HydrophobicContact CE2-CB 3.93Å; F660-A768 HydrophobicContact CZ-CB 3.54Å; A684-A768 HydrophobicContact CB-CB 3.63Å; I727-A768 HydrophobicContact CG2-CB 3.75Å; K728-A768 WeakPolarHBondContact O-CA 3.19Å; Y729-A768 HydrophobicContact CD1-CB 4.14Å; Y729-A768 HydrophobicContact CE1-CB 4Å; A768-N777 CarbonylContact O-C 3.55Å; A768-N777 WeakPolarHBondContact O-CA 3.42Å; A768-N777 WeakPolarHBondContact O-CB 3.09Å; A768-I778 HydrophobicContact CB-CG2 3.99Å; A768-I778 PolarHBondContact N-O 2.75Å; A768-I778 PolarHBondContact O-N 2.92Å
769	M	92.3	Very high	91.5	Very high	67 Å²	67	56.6 Å²	56.6	33%	0.33	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	137.5	-175.9	-176.4	-179.9	77.3	0	0	109.6	I727 K728 P775 K776 N777	I727-M769 CarbonylContact C-O 3.56Å; I727-M769 VanDerWaalsContact CA-O 3.31Å; I727-M769 WeakPolarHBondContact CA-O 3.13Å; K728-M769 HydrophobicContact CB-CE 4.43Å; K728-M769 PolarHBondContact N-O 2.93Å; K728-M769 PolarHBondContact O-N 3.2Å; M769-P775 HydrophobicContact CG-CB 4.45Å; M769-K776 VanDerWaalsContact CA-O 3.3Å; M769-K776 WeakPolarHBondContact CA-O 3.38Å; M769-K776 WeakPolarHBondContact CG-O 3.26Å; M769-N777 HydrophobicContact CB-CB 3.86Å; M769-N777 HydrophobicContact CG-CB 4.02Å
770	D	89.5	Confident	91.7	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.027	29%	0.29	C	S	.	.			trans	-75.1	-174	175.6	61.9	35.8	0	0	0	112.1	N654 P658 G772 P775 K776	N654-D770 PolarHBondContact ND2-OD2 2.97Å; P658-D770 HydrophobicContact CG-CB 3.98Å; D770-G772 WeakPolarHBondContact OD1-CA 3.22Å; D770-G772 PolarHBondContact OD1-N 3.47Å; D770-P775 WeakPolarHBondContact OD1-CA 3.4Å; D770-P775 WeakPolarHBondContact OD1-CB 3.13Å; D770-K776 PolarHBondContact N-O 2.84Å; D770-K776 PolarHBondContact OD1-N 3.17Å; D770-K776 WeakPolarHBondContact OD2-CA 3.21Å; D770-K776 VanDerWaalsContact OD2-CB 3.28Å; D770-K776 WeakPolarHBondContact OD2-CB 3.35Å; D770-K776 PolarHBondContact OD2-N 2.74Å
771	N	83.6	Confident	91.9	Very high	80 Å²	80	54 Å²	54	43%	0.428	28%	0.28	S	S	.	.			trans	-108.3	31.6	166.9	-70.5	-33.5	0	0	0	111.6	N725 R726 H773	N725-N771 PolarHBondContact O-ND2 3.18Å; R726-N771 PolarHBondContact O-N 3.03Å; N771-H773 PolarHBondContact O-ND1 2.71Å
772	G	79	Confident	92	Very high	3 Å²	3	48.2 Å²	48.2	3%	0.031	26%	0.255	C	S	.	.			trans	-71.5	172.3	-175.4	0	0	0	0	0	115.1	N654 D770 P774 P775	N654-G772 WeakPolarHBondContact OD1-CA 3.03Å; D770-G772 WeakPolarHBondContact OD1-CA 3.22Å; D770-G772 PolarHBondContact OD1-N 3.47Å; G772-P774 CarbonylContact C-O 3.57Å; G772-P774 CarbonylContact O-C 3.56Å; G772-P775 WeakPolarHBondContact O-CA 3.49Å; G772-P775 WeakPolarHBondContact O-CB 3.18Å; G772-P775 VanDerWaalsContact O-CD 3.28Å; G772-P775 WeakPolarHBondContact O-CD 3.21Å; G772-P775 VanDerWaalsContact O-N 3.16Å
773	H	78.8	Confident	92.2	Very high	132 Å²	132	50.7 Å²	50.7	61%	0.611	27%	0.266	S	S	*	.	S	Bend	trans	-138.4	85.1	-177.8	-72.9	76	0	0	0	111.2	N771	N771-H773 PolarHBondContact O-ND1 2.71Å
774	P	84.6	Confident	92.2	Very high	105 Å²	105	45.5 Å²	45.5	68%	0.682	24%	0.244	S	C	*	.	S	Bend	cis	-76.3	150.8	4.9	32.8	-36.3	0	0	0	112.9	G772	G772-P774 CarbonylContact C-O 3.57Å; G772-P774 CarbonylContact O-C 3.56Å
775	P	86.6	Confident	92.2	Very high	71 Å²	71	46.9 Å²	46.9	46%	0.461	25%	0.251	S	S	.	.			trans	-77.2	144.1	-179.1	30.7	-34.4	0	0	0	112.2	M769 D770 G772	M769-P775 HydrophobicContact CG-CB 4.45Å; D770-P775 WeakPolarHBondContact OD1-CA 3.4Å; D770-P775 WeakPolarHBondContact OD1-CB 3.13Å; G772-P775 WeakPolarHBondContact O-CA 3.49Å; G772-P775 WeakPolarHBondContact O-CB 3.18Å; G772-P775 VanDerWaalsContact O-CD 3.28Å; G772-P775 WeakPolarHBondContact O-CD 3.21Å; G772-P775 VanDerWaalsContact O-N 3.16Å
776	K	89.6	Confident	92.1	Very high	69 Å²	69	43.8 Å²	43.8	30%	0.3	24%	0.235	S	C	.	.			trans	-109.6	162.3	175.5	-66.3	164.4	173.9	168.4	0	111	N654 D655 N656 P657 M769 D770	N654-K776 WeakPolarHBondContact O-CE 3.46Å; N654-K776 PolarHBondContact O-NZ 2.83Å; D655-K776 VanDerWaalsContact CA-NZ 3.29Å; D655-K776 PolarHBondContact O-NZ 3Å; N656-K776 WeakPolarHBondContact O-CD 3.34Å; P657-K776 HydrophobicContact CB-CB 3.95Å; P657-K776 HydrophobicContact CB-CD 4.49Å; M769-K776 VanDerWaalsContact CA-O 3.3Å; M769-K776 WeakPolarHBondContact CA-O 3.38Å; M769-K776 WeakPolarHBondContact CG-O 3.26Å; D770-K776 PolarHBondContact N-O 2.84Å; D770-K776 PolarHBondContact OD1-N 3.17Å; D770-K776 WeakPolarHBondContact OD2-CA 3.21Å; D770-K776 VanDerWaalsContact OD2-CB 3.28Å; D770-K776 WeakPolarHBondContact OD2-CB 3.35Å; D770-K776 PolarHBondContact OD2-N 2.74Å
777	N	93	Very high	92	Very high	87 Å²	87	46.6 Å²	46.6	47%	0.465	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	162.2	179.9	54	65.9	0	0	0	112.8	T767 A768 M769	T767-N777 HydrophobicContact CG2-CB 3.96Å; A768-N777 CarbonylContact O-C 3.55Å; A768-N777 WeakPolarHBondContact O-CA 3.42Å; A768-N777 WeakPolarHBondContact O-CB 3.09Å; M769-N777 HydrophobicContact CB-CB 3.86Å; M769-N777 HydrophobicContact CG-CB 4.02Å
778	I	93.9	Very high	91.9	Very high	43 Å²	43	46.3 Å²	46.3	22%	0.221	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	146.5	173.9	-169.4	60.2	0	0	0	109.8	P658 F660 T767 A768	P658-I778 HydrophobicContact CB-CG2 4.21Å; P658-I778 WeakPolarHBondContact O-CB 3.15Å; P658-I778 WeakPolarHBondContact O-CG2 3.05Å; F660-I778 HydrophobicContact CD2-CG1 4.41Å; F660-I778 HydrophobicContact CD2-CG2 3.67Å; F660-I778 HydrophobicContact CE2-CG2 3.77Å; T767-I778 CarbonylContact C-O 3.57Å; T767-I778 VanDerWaalsContact CA-O 3.29Å; T767-I778 WeakPolarHBondContact CA-O 3.3Å; A768-I778 HydrophobicContact CB-CG2 3.99Å; A768-I778 PolarHBondContact N-O 2.75Å; A768-I778 PolarHBondContact O-N 2.92Å
779	T	95.9	Very high	91.9	Very high	75 Å²	75	49.5 Å²	49.5	46%	0.46	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136	176.8	59.5	0	0	0	0	111.5	V766 T767	V766-T779 CarbonylContact O-C 3.55Å; V766-T779 VanDerWaalsContact O-CA 3.31Å; V766-T779 WeakPolarHBondContact O-CA 3.38Å; T767-T779 HydrophobicContact CG2-CG2 4.1Å
780	A	96.6	Very high	91.9	Very high	2 Å²	2	47.2 Å²	47.2	2%	0.017	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145.1	169.8	0	0	0	0	0	111	F660 H663 F665 N765 V766	F660-A780 HydrophobicContact CD2-CB 3.63Å; F660-A780 HydrophobicContact CE2-CB 3.95Å; F660-A780 HydrophobicContact CG-CB 4.24Å; H663-A780 WeakPolarHBondContact O-CA 3.4Å; F665-A780 HydrophobicContact CD2-CB 3.96Å; F665-A780 HydrophobicContact CE2-CB 3.72Å; N765-A780 WeakPolarHBondContact CA-O 3.18Å; V766-A780 HydrophobicContact CG1-CB 4.02Å; V766-A780 PolarHBondContact N-O 3.26Å; V766-A780 PolarHBondContact O-N 2.66Å
781	E	97.4	Very high	92	Very high	34 Å²	34	50 Å²	50	16%	0.159	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	125.8	179.2	-171.4	179.7	-144.7	0	0	110	H663 K664 F665 K763 F783	H663-E781 PolarHBondContact O-N 3.44Å; K664-E781 CarbonylContact C-O 3.58Å; K664-E781 VanDerWaalsContact CA-O 3.28Å; K664-E781 WeakPolarHBondContact CA-O 3.28Å; K664-E781 HydrophobicContact CG-CB 4.47Å; K664-E781 IonicContact NZ-OE2 2.7Å; K664-E781 PolarHBondContact NZ-OE2 2.83Å; F665-E781 PolarHBondContact N-O 3.11Å; K763-E781 WeakPolarHBondContact CD-OE1 3.13Å; K763-E781 IonicContact NZ-OE1 3.81Å; K763-E781 PolarHBondContact NZ-OE1 3.36Å; E781-F783 HydrophobicContact CB-CE2 4.37Å; E781-F783 VanDerWaalsContact CD-CE2 3.46Å; E781-F783 HydrophobicContact CG-CD2 4.35Å; E781-F783 HydrophobicContact CG-CE2 3.62Å; E781-F783 HydrophobicContact CG-CZ 3.93Å; E781-F783 VanDerWaalsContact OE2-CE2 3.3Å; E781-F783 WeakPolarHBondContact OE2-CE2 3.22Å; E781-F783 WeakPolarHBondContact OE2-CZ 3.42Å
782	V	97.7	Very high	92.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.5	-178.6	-171.4	0	0	0	0	109.3	F665 L667 F682 K763 F764 V766 I784	F665-V782 HydrophobicContact CB-CG1 4.19Å; F665-V782 HydrophobicContact CB-CG2 4.32Å; F665-V782 HydrophobicContact CD2-CG2 4.38Å; L667-V782 HydrophobicContact CD1-CG1 3.79Å; L667-V782 HydrophobicContact CG-CG1 4.34Å; F682-V782 HydrophobicContact CE1-CG2 3.93Å; F682-V782 HydrophobicContact CZ-CG1 4.2Å; F682-V782 HydrophobicContact CZ-CG2 3.68Å; K763-V782 WeakPolarHBondContact CA-O 3.35Å; K763-V782 WeakPolarHBondContact CB-O 3.3Å; F764-V782 HydrophobicContact CD1-CB 4.19Å; F764-V782 HydrophobicContact CD1-CG1 4.45Å; F764-V782 HydrophobicContact CD2-CB 4.12Å; F764-V782 HydrophobicContact CD2-CG2 4.18Å; F764-V782 HydrophobicContact CE1-CB 3.86Å; F764-V782 HydrophobicContact CE1-CG1 3.7Å; F764-V782 HydrophobicContact CE2-CB 3.76Å; F764-V782 HydrophobicContact CE2-CG1 4.16Å; F764-V782 HydrophobicContact CE2-CG2 3.66Å; F764-V782 HydrophobicContact CG-CB 4.32Å; F764-V782 HydrophobicContact CZ-CB 3.63Å; F764-V782 HydrophobicContact CZ-CG1 3.53Å; F764-V782 HydrophobicContact CZ-CG2 3.93Å; F764-V782 PolarHBondContact N-O 2.85Å; F764-V782 WeakPolarHBondContact O-CB 2.9Å; F764-V782 PolarHBondContact O-N 2.66Å; V766-V782 HydrophobicContact CB-CG2 4.07Å; V766-V782 HydrophobicContact CG1-CG2 3.68Å; V782-I784 HydrophobicContact CG1-CD1 3.85Å
783	F	97.7	Very high	93.2	Very high	77 Å²	77	51.4 Å²	51.4	34%	0.338	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.5	172.2	-66.8	-92.4	0	0	0	109.4	F665 L667 K763 E781	F665-F783 PolarHBondContact O-N 2.96Å; L667-F783 PolarHBondContact N-O 2.86Å; K763-F783 HydrophobicContact CB-CD1 3.94Å; K763-F783 HydrophobicContact CB-CE1 4.09Å; K763-F783 HydrophobicContact CB-CG 4.49Å; K763-F783 HydrophobicContact CD-CE1 3.82Å; K763-F783 HydrophobicContact CD-CZ 4.21Å; E781-F783 HydrophobicContact CB-CE2 4.37Å; E781-F783 VanDerWaalsContact CD-CE2 3.46Å; E781-F783 HydrophobicContact CG-CD2 4.35Å; E781-F783 HydrophobicContact CG-CE2 3.62Å; E781-F783 HydrophobicContact CG-CZ 3.93Å; E781-F783 VanDerWaalsContact OE2-CE2 3.3Å; E781-F783 WeakPolarHBondContact OE2-CE2 3.22Å; E781-F783 WeakPolarHBondContact OE2-CZ 3.42Å
784	I	96.8	Very high	94.1	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.9	170.2	-51.7	-56.1	0	0	0	108.7	L667 I669 L739 K761 F762 F764 V782	L667-I784 HydrophobicContact CB-CD1 3.79Å; L667-I784 HydrophobicContact CD1-CD1 3.88Å; L667-I784 HydrophobicContact CG-CD1 4.32Å; L667-I784 WeakPolarHBondContact O-CA 3.22Å; I669-I784 HydrophobicContact CB-CG2 4.07Å; I669-I784 HydrophobicContact CG2-CG2 3.47Å; I669-I784 VanDerWaalsContact CG2-CG2 3.47Å; L739-I784 HydrophobicContact CD1-CG1 4.29Å; K761-I784 VanDerWaalsContact CA-O 3.31Å; K761-I784 WeakPolarHBondContact CA-O 3.2Å; F762-I784 HydrophobicContact CD1-CB 3.88Å; F762-I784 HydrophobicContact CD1-CG2 4.14Å; F762-I784 HydrophobicContact CD2-CB 4.31Å; F762-I784 HydrophobicContact CD2-CG1 4.21Å; F762-I784 HydrophobicContact CE1-CB 3.59Å; F762-I784 HydrophobicContact CE1-CG1 4.1Å; F762-I784 HydrophobicContact CE1-CG2 3.47Å; F762-I784 VanDerWaalsContact CE1-CG2 3.47Å; F762-I784 HydrophobicContact CE2-CB 4.04Å; F762-I784 HydrophobicContact CE2-CG1 3.68Å; F762-I784 HydrophobicContact CG-CB 4.25Å; F762-I784 HydrophobicContact CZ-CB 3.68Å; F762-I784 HydrophobicContact CZ-CG1 3.63Å; F762-I784 HydrophobicContact CZ-CG2 3.73Å; F762-I784 PolarHBondContact N-O 2.98Å; F762-I784 PolarHBondContact O-N 2.64Å; F764-I784 HydrophobicContact CD1-CG1 4.32Å; F764-I784 HydrophobicContact CE1-CD1 3.91Å; F764-I784 HydrophobicContact CE1-CG1 3.7Å; V782-I784 HydrophobicContact CG1-CD1 3.85Å
785	N	97.1	Very high	94.6	Very high	31 Å²	31	47 Å²	47	17%	0.166	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.1	169.2	170.7	67	0	0	0	108.9	L667 D668 I669 K761 I787	L667-N785 PolarHBondContact O-N 3.19Å; D668-N785 WeakPolarHBondContact CA-O 3.25Å; D668-N785 WeakPolarHBondContact OD1-CB 3.42Å; D668-N785 PolarHBondContact OD1-ND2 3.4Å; I669-N785 PolarHBondContact N-O 3.21Å; K761-N785 WeakPolarHBondContact CE-OD1 3.45Å; K761-N785 HydrophobicContact CG-CB 4.23Å; K761-N785 PolarHBondContact NZ-OD1 2.99Å; N785-I787 VanDerWaalsContact ND2-CD1 3.29Å; N785-I787 WeakPolarHBondContact ND2-CD1 3.27Å
786	V	95.8	Very high	95.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	117.6	-178.1	-174.2	0	0	0	0	108.5	I669 E671 V754 K756 V759 D760 F762	I669-V786 HydrophobicContact CG2-CB 4.4Å; I669-V786 HydrophobicContact CG2-CG1 4.43Å; I669-V786 HydrophobicContact CG2-CG2 3.93Å; I669-V786 CarbonylContact O-C 3.32Å; I669-V786 WeakPolarHBondContact O-CA 3.46Å; E671-V786 HydrophobicContact CB-CG1 3.68Å; V754-V786 HydrophobicContact CG1-CG1 4.17Å; V754-V786 HydrophobicContact CG1-CG2 3.74Å; K756-V786 HydrophobicContact CB-CB 4.4Å; K756-V786 HydrophobicContact CB-CG1 3.81Å; K756-V786 HydrophobicContact CG-CB 4.28Å; K756-V786 HydrophobicContact CG-CG1 4.18Å; K756-V786 PolarHBondContact NZ-O 2.9Å; V759-V786 WeakPolarHBondContact O-CB 3.1Å; V759-V786 WeakPolarHBondContact O-CG2 2.98Å; D760-V786 WeakPolarHBondContact O-CB 3.26Å; D760-V786 PolarHBondContact O-N 3.47Å; F762-V786 HydrophobicContact CD1-CG2 4.41Å; F762-V786 HydrophobicContact CE1-CG2 4.26Å
787	I	95.1	Very high	95.2	Very high	60 Å²	60	48.1 Å²	48.1	31%	0.308	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.3	-179.4	-60.4	-64.5	0	0	0	109.3	D668 I669 L670 E671 N785	D668-I787 HydrophobicContact CB-CD1 4.27Å; D668-I787 HydrophobicContact CB-CG1 3.8Å; I669-I787 PolarHBondContact O-N 3.08Å; L670-I787 HydrophobicContact CD2-CB 4.05Å; L670-I787 HydrophobicContact CD2-CG2 3.74Å; E671-I787 PolarHBondContact N-O 3.45Å; N785-I787 VanDerWaalsContact ND2-CD1 3.29Å; N785-I787 WeakPolarHBondContact ND2-CD1 3.27Å
788	D	94.7	Very high	95.2	Very high	29 Å²	29	48.5 Å²	48.5	16%	0.155	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-62.7	132.4	-179.8	-148.5	76.5	0	0	0	111.3	E671 K756 F825 N828	E671-D788 VanDerWaalsContact OE1-CA 3.28Å; E671-D788 WeakPolarHBondContact OE1-CA 3.4Å; K756-D788 HydrophobicContact CD-CB 3.9Å; K756-D788 WeakPolarHBondContact CD-OD1 3.43Å; K756-D788 VanDerWaalsContact CE-OD1 3.31Å; K756-D788 WeakPolarHBondContact CE-OD1 3.24Å; D788-F825 WeakPolarHBondContact OD1-CB 3.33Å; D788-F825 WeakPolarHBondContact OD1-CD2 3.41Å; D788-F825 PolarHBondContact OD1-N 2.04Å; D788-F825 PolarHBondContact OD2-N 3.35Å; D788-N828 VanDerWaalsContact OD2-CB 3.29Å; D788-N828 WeakPolarHBondContact OD2-CB 3.38Å; D788-N828 PolarHBondContact OD2-ND2 3.45Å
789	Q	93.3	Very high	95.1	Very high	67 Å²	67	54.5 Å²	54.5	31%	0.313	27%	0.267	S	S	.	.			trans	-104.8	146.5	163	-67.3	-158.9	-24.9	0	0	109.5	L670 E671 D791	L670-Q789 HydrophobicContact CB-CG 4.43Å; L670-Q789 HydrophobicContact CD2-CG 4.22Å; E671-Q789 HydrophobicContact CG-CB 4.08Å; E671-Q789 HydrophobicContact CG-CG 4.18Å; E671-Q789 VanDerWaalsContact O-CD 3.29Å; E671-Q789 PolarHBondContact O-OE1 3.01Å; E671-Q789 PolarHBondContact OE1-N 3.02Å; Q789-D791 HydrophobicContact CB-CB 4.5Å; Q789-D791 PolarHBondContact O-N 3.1Å
790	N	94.3	Very high	95.1	Very high	19 Å²	19	54.2 Å²	54.2	10%	0.102	26%	0.262	C	S	.	.			trans	-81.2	61.8	176.6	-160.4	67.4	0	0	0	109.4	D824 N828 D877 P881 Q883	N790-D824 VanDerWaalsContact C-OD2 3.28Å; N790-D824 VanDerWaalsContact CA-OD2 3.25Å; N790-D824 WeakPolarHBondContact CA-OD2 3.09Å; N790-N828 HydrophobicContact CB-CB 4.23Å; N790-N828 PolarHBondContact N-ND2 2.85Å; N790-N828 WeakPolarHBondContact OD1-CA 3.22Å; N790-N828 WeakPolarHBondContact OD1-CB 3.37Å; N790-N828 PolarHBondContact OD1-O 3.45Å; N790-N828 PolarHBondContact OD1-OD1 2.93Å; N790-D877 PolarHBondContact ND2-OD2 3.36Å; N790-D877 PolarHBondContact OD1-OD2 3.14Å; N790-P881 PolarHBondContact ND2-O 2.81Å; N790-Q883 WeakPolarHBondContact ND2-CG 3.33Å; N790-Q883 PolarHBondContact O-NE2 2.93Å
791	D	91.2	Very high	95	Very high	65 Å²	65	54.8 Å²	54.8	35%	0.348	26%	0.264	S	S	.	.			trans	-97.7	-19	-171.6	95	-51.9	0	0	0	114.1	N672 Q789 D824 Q883	N672-D791 PolarHBondContact ND2-OD2 2.94Å; Q789-D791 HydrophobicContact CB-CB 4.5Å; Q789-D791 PolarHBondContact O-N 3.1Å; D791-D824 PolarHBondContact N-OD2 2.04Å; D791-Q883 PolarHBondContact O-NE2 3.01Å; D791-Q883 VanDerWaalsContact O-NE2 3.07Å
792	H	92.5	Very high	95	Very high	75 Å²	75	60.8 Å²	60.8	35%	0.347	29%	0.286	S	S	.	.	S	Bend	trans	-89.6	171.7	166.4	-60.9	76	0	0	0	111.7	D822 D823 D824 Q883	H792-D822 VanDerWaalsContact CB-OD1 3.32Å; H792-D822 WeakPolarHBondContact CB-OD1 3.47Å; H792-D823 HydrophobicContact CB-CB 3.89Å; H792-D823 VanDerWaalsContact CD2-CB 3.5Å; H792-D823 WeakPolarHBondContact CD2-CB 3.49Å; H792-D824 VanDerWaalsContact CB-OD1 3.28Å; H792-D824 WeakPolarHBondContact CB-OD1 3.42Å; H792-D824 IonicContact CE1-OD1 3.45Å; H792-D824 IonicContact CG-OD1 3.11Å; H792-D824 VanDerWaalsContact CG-OD1 3.31Å; H792-D824 PolarHBondContact N-OD1 3.46Å; H792-D824 PolarHBondContact N-OD2 2.9Å; H792-D824 IonicContact ND1-OD1 3Å; H792-D824 PolarHBondContact ND1-OD1 3.31Å; H792-Q883 WeakPolarHBondContact O-CG 3.05Å; H792-Q883 PolarHBondContact O-NE2 2.85Å
793	A	94.9	Very high	94.8	Very high	36 Å²	36	63.4 Å²	63.4	30%	0.298	30%	0.297	S	S	.	.			trans	-138.3	144	-175.8	0	0	0	0	0	110.8	K795 Q883	A793-K795 PolarHBondContact O-N 3.38Å; A793-K795 VanDerWaalsContact O-N 3.14Å; A793-Q883 HydrophobicContact CB-CB 3.77Å; A793-Q883 HydrophobicContact CB-CG 4.43Å
794	P	97.3	Very high	94.7	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.313	C	S	.	.			trans	-60.8	121.1	-174.6	-24.4	30.7	0	0	0	111.1	A820 D822 I831 A875 D877 S885	P794-A820 HydrophobicContact CB-CB 4.38Å; P794-D822 VanDerWaalsContact CA-OD2 3.27Å; P794-D822 WeakPolarHBondContact CA-OD2 3.28Å; P794-D822 WeakPolarHBondContact CD-OD2 3.34Å; P794-D822 WeakPolarHBondContact CG-OD2 3.33Å; P794-I831 HydrophobicContact CB-CD1 4.15Å; P794-I831 HydrophobicContact CB-CG1 4.13Å; P794-I831 HydrophobicContact CB-CG2 4.43Å; P794-I831 HydrophobicContact CG-CG1 4.39Å; P794-A875 HydrophobicContact CB-CB 3.67Å; P794-D877 HydrophobicContact CG-CB 4.25Å; P794-S885 WeakPolarHBondContact O-CB 3.46Å; P794-S885 PolarHBondContact O-OG 2.84Å
795	K	96	Very high	94.7	Very high	145 Å²	145	66.3 Å²	66.3	63%	0.63	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	114.9	-166.4	-176.4	178.2	176.6	-176.6	0	112.5	A793 A820 Q821	A793-K795 PolarHBondContact O-N 3.38Å; A793-K795 VanDerWaalsContact O-N 3.14Å; K795-A820 CarbonylContact O-C 3.38Å; K795-A820 VanDerWaalsContact O-CA 3.28Å; K795-A820 WeakPolarHBondContact O-CA 3.34Å; K795-Q821 PolarHBondContact N-O 2.78Å; K795-Q821 PolarHBondContact O-N 3.25Å
796	F	96.1	Very high	94.6	Very high	19 Å²	19	66.6 Å²	66.6	8%	0.083	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	145.6	172.7	-66.3	-81.9	0	0	0	112.2	K798 L818 A820 Y833 V873 A875 S885 C887	F796-K798 WeakPolarHBondContact CB-O 3.4Å; F796-K798 PolarHBondContact O-N 3.43Å; F796-L818 HydrophobicContact CE1-CB 4.44Å; F796-A820 HydrophobicContact CD1-CB 3.94Å; F796-A820 HydrophobicContact CD2-CB 4.41Å; F796-A820 HydrophobicContact CE1-CB 3.99Å; F796-A820 HydrophobicContact CE2-CB 4.45Å; F796-A820 HydrophobicContact CG-CB 4.16Å; F796-A820 HydrophobicContact CZ-CB 4.25Å; F796-Y833 HydrophobicContact CE1-CD1 4.13Å; F796-Y833 AromaticContact CE1-CE1 3.87Å; F796-Y833 HydrophobicContact CE1-CE1 3.87Å; F796-Y833 HydrophobicContact CZ-CD1 4.23Å; F796-Y833 HydrophobicContact CZ-CE1 4.26Å; F796-V873 HydrophobicContact CE1-CG1 4.3Å; F796-V873 HydrophobicContact CZ-CG1 4Å; F796-A875 HydrophobicContact CE1-CB 4.42Å; F796-A875 HydrophobicContact CE2-CB 3.67Å; F796-A875 HydrophobicContact CZ-CB 3.55Å; F796-S885 WeakPolarHBondContact CD2-OG 3.47Å; F796-C887 HydrophobicContact CB-CB 4.09Å; F796-C887 HydrophobicContact CD1-CB 4.3Å; F796-C887 VanDerWaalsContact CD1-SG 3.54Å; F796-C887 HydrophobicContact CD2-CB 3.84Å; F796-C887 HydrophobicContact CE2-CB 4.36Å; F796-C887 HydrophobicContact CG-CB 3.81Å
797	E	91.2	Very high	94.5	Very high	144 Å²	144	67.4 Å²	67.4	67%	0.673	32%	0.324	S	S	*	.	S	Bend	trans	-57.1	-32.6	174.6	-168.6	-134.6	155	0	0	112.5
798	K	93	Very high	94.5	Very high	95 Å²	95	69.6 Å²	69.6	41%	0.413	34%	0.336	S	S	.	.			trans	-136	142.8	179.6	-54.1	-174.3	177.3	77.8	0	110.2	F796 I800 F801 C887	F796-K798 WeakPolarHBondContact CB-O 3.4Å; F796-K798 PolarHBondContact O-N 3.43Å; K798-I800 VanDerWaalsContact C-N 3.32Å; K798-F801 HydrophobicContact CB-CD1 4.46Å; K798-F801 HydrophobicContact CB-CD2 4.39Å; K798-F801 HydrophobicContact CB-CE1 4.05Å; K798-F801 HydrophobicContact CB-CE2 3.96Å; K798-F801 HydrophobicContact CB-CZ 3.78Å; K798-F801 HydrophobicContact CD-CD1 4.3Å; K798-F801 HydrophobicContact CD-CE1 4.11Å; K798-F801 HydrophobicContact CG-CE1 4.15Å; K798-F801 HydrophobicContact CG-CZ 4.24Å; K798-F801 VanDerWaalsContact O-CE2 3.24Å; K798-F801 WeakPolarHBondContact O-CE2 3.48Å; K798-C887 WeakPolarHBondContact O-CB 3.31Å
799	Q	92.9	Very high	94.5	Very high	170 Å²	170	69.9 Å²	69.9	79%	0.794	34%	0.337	S	S	*	.	S	Bend	trans	-72.8	-27.1	172.1	-71.6	-178.1	-22.1	0	0	112.5	C887 Q888	Q799-C887 CarbonylContact O-C 3.45Å; Q799-C887 WeakPolarHBondContact O-CA 3.28Å; Q799-Q888 PolarHBondContact O-N 3.02Å
800	I	96	Very high	94.6	Very high	68 Å²	68	71.5 Å²	71.5	35%	0.349	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	132.6	-179	-49.3	-179.6	0	0	0	109.1	K798 Y802 Q888 H890	K798-I800 VanDerWaalsContact C-N 3.32Å; I800-Y802 HydrophobicContact CB-CE2 4.28Å; I800-Y802 HydrophobicContact CG2-CD2 4.15Å; I800-Y802 HydrophobicContact CG2-CE1 4.47Å; I800-Y802 HydrophobicContact CG2-CE2 3.48Å; I800-Y802 VanDerWaalsContact CG2-CE2 3.48Å; I800-Q888 CarbonylContact C-O 3.48Å; I800-Q888 WeakPolarHBondContact CA-O 3.34Å; I800-Q888 HydrophobicContact CG1-CB 4.49Å; I800-H890 VanDerWaalsContact CG2-CD2 3.41Å; I800-H890 WeakPolarHBondContact CG2-CD2 3.45Å
801	F	95	Very high	94.7	Very high	15 Å²	15	73.1 Å²	73.1	7%	0.066	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	142.8	172.5	-65.6	-94.7	0	0	0	110.2	K798 Y803 L818 C887 Q888 H890	K798-F801 HydrophobicContact CB-CD1 4.46Å; K798-F801 HydrophobicContact CB-CD2 4.39Å; K798-F801 HydrophobicContact CB-CE1 4.05Å; K798-F801 HydrophobicContact CB-CE2 3.96Å; K798-F801 HydrophobicContact CB-CZ 3.78Å; K798-F801 HydrophobicContact CD-CD1 4.3Å; K798-F801 HydrophobicContact CD-CE1 4.11Å; K798-F801 HydrophobicContact CG-CE1 4.15Å; K798-F801 HydrophobicContact CG-CZ 4.24Å; K798-F801 VanDerWaalsContact O-CE2 3.24Å; K798-F801 WeakPolarHBondContact O-CE2 3.48Å; F801-Y803 HydrophobicContact CB-CE2 3.67Å; F801-Y803 WeakPolarHBondContact CD1-OH 3.47Å; F801-Y803 HydrophobicContact CG-CE2 4.49Å; F801-L818 HydrophobicContact CB-CD2 4.44Å; F801-L818 HydrophobicContact CD1-CD2 4.01Å; F801-L818 HydrophobicContact CD2-CD2 3.86Å; F801-L818 HydrophobicContact CE1-CD2 4.18Å; F801-L818 HydrophobicContact CE2-CD2 4.03Å; F801-L818 HydrophobicContact CG-CD2 3.85Å; F801-L818 HydrophobicContact CZ-CD2 4.18Å; F801-C887 HydrophobicContact CD2-CB 4.11Å; F801-C887 HydrophobicContact CE2-CB 3.92Å; F801-Q888 PolarHBondContact N-O 3.02Å; F801-H890 PolarHBondContact O-N 3.1Å
802	Y	95.6	Very high	94.8	Very high	159 Å²	159	74.9 Å²	74.9	62%	0.624	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.5	177.7	-67.9	-85.9	0	0	0	109.6	I800 H890	I800-Y802 HydrophobicContact CB-CE2 4.28Å; I800-Y802 HydrophobicContact CG2-CD2 4.15Å; I800-Y802 HydrophobicContact CG2-CE1 4.47Å; I800-Y802 HydrophobicContact CG2-CE2 3.48Å; I800-Y802 VanDerWaalsContact CG2-CE2 3.48Å; Y802-H890 WeakPolarHBondContact CA-O 3.39Å; Y802-H890 HydrophobicContact CD1-CB 3.63Å; Y802-H890 AromaticContact CD1-CD2 3.98Å; Y802-H890 HydrophobicContact CE1-CB 3.79Å; Y802-H890 AromaticContact CE1-CD2 3.35Å; Y802-H890 WeakPolarHBondContact CE1-CD2 3.34Å; Y802-H890 AromaticContact CE1-CG 3.74Å; Y802-H890 AromaticContact CZ-CD2 3.65Å
803	Y	95.2	Very high	95	Very high	56 Å²	56	72.6 Å²	72.6	22%	0.22	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	143.9	174.4	-57.7	-78.7	0	0	0	110.3	F801 A816 L818 V889 H890 I891 K892	F801-Y803 HydrophobicContact CB-CE2 3.67Å; F801-Y803 WeakPolarHBondContact CD1-OH 3.47Å; F801-Y803 HydrophobicContact CG-CE2 4.49Å; Y803-A816 HydrophobicContact CD2-CB 4.48Å; Y803-A816 HydrophobicContact CE1-CB 3.86Å; Y803-A816 HydrophobicContact CE2-CB 3.74Å; Y803-A816 WeakPolarHBondContact OH-CB 3.46Å; Y803-L818 HydrophobicContact CE2-CD2 4.47Å; Y803-V889 HydrophobicContact CD2-CG1 3.98Å; Y803-V889 HydrophobicContact CE2-CG1 4.06Å; Y803-H890 PolarHBondContact N-O 2.95Å; Y803-I891 CarbonylContact O-C 3.49Å; Y803-I891 VanDerWaalsContact O-CA 3.28Å; Y803-I891 WeakPolarHBondContact O-CA 3.43Å; Y803-K892 PolarHBondContact O-N 2.84Å
804	N	95.2	Very high	95	Very high	127 Å²	127	75 Å²	75	68%	0.679	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.8	168.5	-64.9	-4.8	0	0	0	107	K892	N804-K892 WeakPolarHBondContact CA-O 3.43Å
805	L	95.8	Very high	94.9	Very high	13 Å²	13	75.8 Å²	75.8	7%	0.068	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.4	-178.9	-53.3	-180	0	0	0	109.5	M809 V815 F846 L861 I891 K892 V893 H894	L805-M809 HydrophobicContact CB-SD 3.9Å; L805-M809 HydrophobicContact CD1-SD 4.09Å; L805-M809 HydrophobicContact CD2-CE 4.15Å; L805-M809 HydrophobicContact CD2-SD 3.73Å; L805-M809 HydrophobicContact CG-SD 4.1Å; L805-V815 HydrophobicContact CD1-CB 4.39Å; L805-V815 HydrophobicContact CD1-CG1 3.79Å; L805-V815 HydrophobicContact CD1-CG2 3.75Å; L805-V815 HydrophobicContact CD2-CG1 4.06Å; L805-V815 HydrophobicContact CG-CG1 4.46Å; L805-F846 HydrophobicContact CD1-CE1 4.19Å; L805-L861 HydrophobicContact CB-CD1 3.84Å; L805-L861 HydrophobicContact CD1-CD1 4.14Å; L805-I891 HydrophobicContact CB-CG2 4.41Å; L805-I891 HydrophobicContact CD1-CD1 4.33Å; L805-I891 HydrophobicContact CD1-CG2 3.63Å; L805-I891 HydrophobicContact CG-CG2 3.78Å; L805-K892 PolarHBondContact N-O 2.64Å; L805-V893 CarbonylContact O-C 3.47Å; L805-V893 WeakPolarHBondContact O-CA 3.2Å; L805-H894 PolarHBondContact O-N 2.73Å
806	S	95	Very high	94.8	Very high	37 Å²	37	69.2 Å²	69.2	26%	0.259	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	146	169	-165.7	0	0	0	0	110	D808 M809 I896	S806-D808 WeakPolarHBondContact CB-OD1 3.2Å; S806-D808 PolarHBondContact OG-OD1 2.79Å; S806-M809 WeakPolarHBondContact O-CB 3.48Å; S806-M809 PolarHBondContact O-N 2.91Å; S806-I896 WeakPolarHBondContact OG-CD1 3.47Å; S806-I896 VanDerWaalsContact OG-CG1 3.28Å; S806-I896 WeakPolarHBondContact OG-CG1 3.46Å
807	E	95.3	Very high	94.7	Very high	17 Å²	17	72.9 Å²	72.9	8%	0.079	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-27.1	-179	68.3	-160.6	119	0	0	114.6	M809 L861 R863 V893 H894 D895 I896	E807-M809 PolarHBondContact O-N 2.82Å; E807-M809 VanDerWaalsContact O-N 3.1Å; E807-L861 HydrophobicContact CB-CB 3.95Å; E807-R863 WeakPolarHBondContact OE2-CB 3.3Å; E807-R863 PolarHBondContact OE2-N 2.7Å; E807-V893 HydrophobicContact CB-CG1 3.66Å; E807-H894 PolarHBondContact N-O 2.76Å; E807-D895 VanDerWaalsContact OE1-CA 3.23Å; E807-D895 WeakPolarHBondContact OE1-CA 3.41Å; E807-I896 HydrophobicContact CG-CB 4.04Å; E807-I896 HydrophobicContact CG-CG1 4.18Å; E807-I896 PolarHBondContact OE1-N 2.75Å
808	D	94.1	Very high	94.9	Very high	105 Å²	105	66 Å²	66	56%	0.561	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-2.3	170.6	80.3	-35.5	0	0	0	113.6	S806 P810 I896	S806-D808 WeakPolarHBondContact CB-OD1 3.2Å; S806-D808 PolarHBondContact OG-OD1 2.79Å; D808-P810 VanDerWaalsContact O-CD 3.31Å; D808-P810 WeakPolarHBondContact O-CD 3.5Å; D808-I896 HydrophobicContact CB-CG1 4.37Å
809	M	95.1	Very high	94.9	Very high	36 Å²	36	65.9 Å²	65.9	18%	0.177	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-55.1	118.1	-178.6	-178.8	169.5	-172.4	0	0	111.3	L805 S806 E807 S813 I814 V815 L857	L805-M809 HydrophobicContact CB-SD 3.9Å; L805-M809 HydrophobicContact CD1-SD 4.09Å; L805-M809 HydrophobicContact CD2-CE 4.15Å; L805-M809 HydrophobicContact CD2-SD 3.73Å; L805-M809 HydrophobicContact CG-SD 4.1Å; S806-M809 WeakPolarHBondContact O-CB 3.48Å; S806-M809 PolarHBondContact O-N 2.91Å; E807-M809 PolarHBondContact O-N 2.82Å; E807-M809 VanDerWaalsContact O-N 3.1Å; M809-S813 VanDerWaalsContact CE-OG 3.25Å; M809-S813 WeakPolarHBondContact CE-OG 3.44Å; M809-S813 WeakPolarHBondContact CG-OG 3.23Å; M809-I814 WeakPolarHBondContact CE-O 3.48Å; M809-V815 HydrophobicContact CE-CG2 4.2Å; M809-L857 HydrophobicContact CB-CD2 4.13Å; M809-L857 HydrophobicContact CG-CD2 3.94Å; M809-L857 WeakPolarHBondContact O-CD2 3.22Å; M809-L857 HydrophobicContact SD-CD2 4.5Å
810	P	96	Very high	95	Very high	100 Å²	100	58 Å²	58	65%	0.649	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-60.6	140.3	-173	-28.8	36.2	0	0	0	114	D808 S813	D808-P810 VanDerWaalsContact O-CD 3.31Å; D808-P810 WeakPolarHBondContact O-CD 3.5Å; P810-S813 WeakPolarHBondContact O-CB 3.28Å; P810-S813 PolarHBondContact O-N 3.02Å; P810-S813 VanDerWaalsContact O-N 3.07Å; P810-S813 PolarHBondContact O-OG 3.5Å
811	V	94.9	Very high	95	Very high	53 Å²	53	61.8 Å²	61.8	32%	0.321	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	140.9	175.9	-172.3	0	0	0	0	110.8	S813 R858 P860	V811-S813 VanDerWaalsContact C-N 3.3Å; V811-R858 VanDerWaalsContact CG1-O 3.28Å; V811-R858 WeakPolarHBondContact CG1-O 3.42Å; V811-P860 HydrophobicContact CG2-CB 4.48Å; V811-P860 HydrophobicContact CG2-CG 3.85Å
812	N	94.5	Very high	95	Very high	102 Å²	102	62.2 Å²	62.2	55%	0.545	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	17	-167.6	-44.4	-85.1	0	0	0	115	W856 L857	N812-W856 VanDerWaalsContact O-CE3 3.27Å; N812-W856 WeakPolarHBondContact O-CZ3 3.27Å; N812-L857 WeakPolarHBondContact CA-O 3.48Å; N812-L857 PolarHBondContact N-O 3.13Å
813	S	95.9	Very high	94.9	Very high	27 Å²	27	58.2 Å²	58.2	19%	0.189	31%	0.313	C	S	.	.			trans	-68.5	155.9	159.4	52.9	0	0	0	0	111.7	M809 P810 V811 W856 L857	M809-S813 VanDerWaalsContact CE-OG 3.25Å; M809-S813 WeakPolarHBondContact CE-OG 3.44Å; M809-S813 WeakPolarHBondContact CG-OG 3.23Å; P810-S813 WeakPolarHBondContact O-CB 3.28Å; P810-S813 PolarHBondContact O-N 3.02Å; P810-S813 VanDerWaalsContact O-N 3.07Å; P810-S813 PolarHBondContact O-OG 3.5Å; V811-S813 VanDerWaalsContact C-N 3.3Å; S813-W856 WeakPolarHBondContact O-CA 3.41Å; S813-L857 PolarHBondContact O-N 2.88Å
814	I	95.9	Very high	94.9	Very high	87 Å²	87	56 Å²	56	45%	0.446	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.1	170.4	-62.1	174.3	0	0	0	108.1	M809 I817 T854 W856	M809-I814 WeakPolarHBondContact CE-O 3.48Å; I814-I817 HydrophobicContact CG2-CG1 4.46Å; I814-T854 HydrophobicContact CB-CG2 4.49Å; I814-T854 HydrophobicContact CD1-CG2 4.18Å; I814-T854 HydrophobicContact CG1-CG2 4.02Å; I814-T854 HydrophobicContact CG2-CG2 3.79Å; I814-W856 HydrophobicContact CD1-CH2 3.79Å; I814-W856 HydrophobicContact CD1-CZ2 4.21Å; I814-W856 HydrophobicContact CD1-CZ3 4.08Å; I814-W856 HydrophobicContact CG1-CD2 4.15Å; I814-W856 HydrophobicContact CG1-CE3 3.69Å; I814-W856 HydrophobicContact CG1-CH2 3.61Å; I814-W856 HydrophobicContact CG1-CZ2 4.06Å; I814-W856 HydrophobicContact CG1-CZ3 3.42Å; I814-W856 VanDerWaalsContact CG1-CZ3 3.42Å
815	V	94.9	Very high	94.8	Very high	16 Å²	16	54.5 Å²	54.5	10%	0.097	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-46.4	173.2	173	0	0	0	0	110.4	L805 M809 F846 L855 L857 I891	L805-V815 HydrophobicContact CD1-CB 4.39Å; L805-V815 HydrophobicContact CD1-CG1 3.79Å; L805-V815 HydrophobicContact CD1-CG2 3.75Å; L805-V815 HydrophobicContact CD2-CG1 4.06Å; L805-V815 HydrophobicContact CG-CG1 4.46Å; M809-V815 HydrophobicContact CE-CG2 4.2Å; V815-F846 HydrophobicContact CG2-CD1 4.19Å; V815-F846 HydrophobicContact CG2-CE1 4.14Å; V815-L855 HydrophobicContact CB-CB 4.4Å; V815-L855 HydrophobicContact CB-CD2 4.02Å; V815-L855 HydrophobicContact CB-CG 4.15Å; V815-L855 WeakPolarHBondContact CB-O 3.42Å; V815-L855 HydrophobicContact CG1-CD2 3.7Å; V815-L855 HydrophobicContact CG1-CG 4.38Å; V815-L855 PolarHBondContact N-O 3.44Å; V815-L857 HydrophobicContact CG2-CB 4.17Å; V815-I891 HydrophobicContact CG1-CD1 4.11Å
816	A	93	Very high	94.7	Very high	8 Å²	8	56.9 Å²	56.9	7%	0.066	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	166.6	-174.2	0	0	0	0	0	111.9	Y803 L818 T854 L855	Y803-A816 HydrophobicContact CD2-CB 4.48Å; Y803-A816 HydrophobicContact CE1-CB 3.86Å; Y803-A816 HydrophobicContact CE2-CB 3.74Å; Y803-A816 WeakPolarHBondContact OH-CB 3.46Å; A816-L818 HydrophobicContact CB-CD2 4.3Å; A816-L818 HydrophobicContact CB-CG 4.35Å; A816-T854 WeakPolarHBondContact O-CA 3.48Å; A816-L855 HydrophobicContact CB-CB 4.13Å; A816-L855 HydrophobicContact CB-CD2 4.38Å; A816-L855 PolarHBondContact N-O 3.06Å; A816-L855 PolarHBondContact O-N 3.06Å
817	I	94.4	Very high	94.6	Very high	95 Å²	95	61.3 Å²	61.3	49%	0.487	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	114.9	161.5	-54.7	177	0	0	0	106.4	I814 I819 T854	I814-I817 HydrophobicContact CG2-CG1 4.46Å; I817-I819 HydrophobicContact CG2-CD1 4.4Å; I817-I819 HydrophobicContact CG2-CG1 4.01Å; I817-T854 HydrophobicContact CG1-CG2 4.25Å
818	L	94.4	Very high	94.5	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.34	C	S	.	.			trans	-102.5	100.5	-174	-61.4	172.6	0	0	0	109.2	F796 F801 Y803 A816 Y833 L848 G853 V873 V889	F796-L818 HydrophobicContact CE1-CB 4.44Å; F801-L818 HydrophobicContact CB-CD2 4.44Å; F801-L818 HydrophobicContact CD1-CD2 4.01Å; F801-L818 HydrophobicContact CD2-CD2 3.86Å; F801-L818 HydrophobicContact CE1-CD2 4.18Å; F801-L818 HydrophobicContact CE2-CD2 4.03Å; F801-L818 HydrophobicContact CG-CD2 3.85Å; F801-L818 HydrophobicContact CZ-CD2 4.18Å; Y803-L818 HydrophobicContact CE2-CD2 4.47Å; A816-L818 HydrophobicContact CB-CD2 4.3Å; A816-L818 HydrophobicContact CB-CG 4.35Å; L818-Y833 WeakPolarHBondContact O-CE1 3.02Å; L818-L848 HydrophobicContact CD1-CD1 4.38Å; L818-G853 PolarHBondContact N-O 3.31Å; L818-V873 HydrophobicContact CD1-CB 4.18Å; L818-V873 HydrophobicContact CD1-CG1 4.29Å; L818-V873 HydrophobicContact CD1-CG2 3.74Å; L818-V889 HydrophobicContact CD1-CG2 3.77Å; L818-V889 HydrophobicContact CD2-CG2 4.44Å
819	I	93.3	Very high	94.5	Very high	92 Å²	92	58.1 Å²	58.1	47%	0.472	33%	0.325	S	S	.	.			trans	-96.4	125.2	-175.6	-56.3	177.6	0	0	0	109.8	I817 Q821	I817-I819 HydrophobicContact CG2-CD1 4.4Å; I817-I819 HydrophobicContact CG2-CG1 4.01Å; I819-Q821 HydrophobicContact CG2-CG 4.3Å
820	A	95.7	Very high	94.5	Very high	5 Å²	5	61 Å²	61	4%	0.041	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	153.6	156.2	0	0	0	0	0	109.5	P794 K795 F796 I831 Y833 A875	P794-A820 HydrophobicContact CB-CB 4.38Å; K795-A820 CarbonylContact O-C 3.38Å; K795-A820 VanDerWaalsContact O-CA 3.28Å; K795-A820 WeakPolarHBondContact O-CA 3.34Å; F796-A820 HydrophobicContact CD1-CB 3.94Å; F796-A820 HydrophobicContact CD2-CB 4.41Å; F796-A820 HydrophobicContact CE1-CB 3.99Å; F796-A820 HydrophobicContact CE2-CB 4.45Å; F796-A820 HydrophobicContact CG-CB 4.16Å; F796-A820 HydrophobicContact CZ-CB 4.25Å; A820-I831 HydrophobicContact CB-CD1 4.04Å; A820-I831 HydrophobicContact CB-CG2 4.42Å; A820-I831 VanDerWaalsContact O-CD1 3.3Å; A820-I831 WeakPolarHBondContact O-CD1 3.47Å; A820-Y833 HydrophobicContact CB-CE1 3.97Å; A820-Y833 PolarHBondContact N-OH 2.8Å; A820-Y833 PolarHBondContact O-OH 3Å; A820-A875 HydrophobicContact CB-CB 3.67Å
821	Q	95.1	Very high	94.5	Very high	147 Å²	147	57.6 Å²	57.6	69%	0.687	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	143.1	173.1	-66.8	-178.6	-40.4	0	0	108.7	K795 I819	K795-Q821 PolarHBondContact N-O 2.78Å; K795-Q821 PolarHBondContact O-N 3.25Å; I819-Q821 HydrophobicContact CG2-CG 4.3Å
822	D	96	Very high	94.6	Very high	24 Å²	24	55.9 Å²	55.9	13%	0.128	30%	0.303	C	S	.	.			trans	-116.9	155.4	169.9	-140.4	-45.9	0	0	0	109.3	H792 P794 A829 I831	H792-D822 VanDerWaalsContact CB-OD1 3.32Å; H792-D822 WeakPolarHBondContact CB-OD1 3.47Å; P794-D822 VanDerWaalsContact CA-OD2 3.27Å; P794-D822 WeakPolarHBondContact CA-OD2 3.28Å; P794-D822 WeakPolarHBondContact CD-OD2 3.34Å; P794-D822 WeakPolarHBondContact CG-OD2 3.33Å; D822-A829 HydrophobicContact CB-CB 3.85Å; D822-I831 HydrophobicContact CB-CD1 4.19Å; D822-I831 HydrophobicContact CB-CG1 4.33Å
823	D	93.3	Very high	94.6	Very high	76 Å²	76	51.9 Å²	51.9	41%	0.406	28%	0.28	S	S	.	.			trans	-107	-12.4	-171.2	-93.1	-49.2	0	0	0	112.6	K757 H792	K757-D823 WeakPolarHBondContact CE-OD1 3.48Å; K757-D823 VanDerWaalsContact NZ-CG 3.25Å; K757-D823 PolarHBondContact NZ-O 2.78Å; K757-D823 IonicContact NZ-OD1 2.72Å; K757-D823 PolarHBondContact NZ-OD1 3.3Å; H792-D823 HydrophobicContact CB-CB 3.89Å; H792-D823 VanDerWaalsContact CD2-CB 3.5Å; H792-D823 WeakPolarHBondContact CD2-CB 3.49Å
824	D	95.6	Very high	94.5	Very high	10 Å²	10	55.7 Å²	55.7	5%	0.053	29%	0.293	C	S	.	.	S	Bend	trans	-77.7	-170.4	175	-65.3	-13.9	0	0	0	112.8	N790 D791 H792 N828 A829	N790-D824 VanDerWaalsContact C-OD2 3.28Å; N790-D824 VanDerWaalsContact CA-OD2 3.25Å; N790-D824 WeakPolarHBondContact CA-OD2 3.09Å; D791-D824 PolarHBondContact N-OD2 2.04Å; H792-D824 VanDerWaalsContact CB-OD1 3.28Å; H792-D824 WeakPolarHBondContact CB-OD1 3.42Å; H792-D824 IonicContact CE1-OD1 3.45Å; H792-D824 IonicContact CG-OD1 3.11Å; H792-D824 VanDerWaalsContact CG-OD1 3.31Å; H792-D824 PolarHBondContact N-OD1 3.46Å; H792-D824 PolarHBondContact N-OD2 2.9Å; H792-D824 IonicContact ND1-OD1 3Å; H792-D824 PolarHBondContact ND1-OD1 3.31Å; D824-N828 HydrophobicContact CB-CB 3.57Å; D824-A829 VanDerWaalsContact O-CB 3.25Å; D824-A829 WeakPolarHBondContact O-CB 3.36Å
825	F	92.8	Very high	94.3	Very high	94 Å²	94	52.6 Å²	52.6	41%	0.412	28%	0.278	S	S	.	.			trans	-125	149.2	-178.7	-60.6	-109.2	0	0	0	115.3	K756 K757 D788 Q827 N828	K756-F825 HydrophobicContact CD-CD2 3.84Å; K756-F825 HydrophobicContact CD-CE2 4.3Å; K756-F825 HydrophobicContact CD-CG 4.3Å; K756-F825 HydrophobicContact CG-CD2 4.47Å; K756-F825 HydrophobicContact CG-CE2 4.45Å; K757-F825 HydrophobicContact CB-CE2 4.12Å; K757-F825 HydrophobicContact CB-CZ 4.39Å; K757-F825 HydrophobicContact CG-CE2 4.18Å; K757-F825 HydrophobicContact CG-CZ 4.17Å; D788-F825 WeakPolarHBondContact OD1-CB 3.33Å; D788-F825 WeakPolarHBondContact OD1-CD2 3.41Å; D788-F825 PolarHBondContact OD1-N 2.04Å; D788-F825 PolarHBondContact OD2-N 3.35Å; F825-Q827 PolarHBondContact O-N 3.06Å; F825-N828 PolarHBondContact O-N 3.19Å
826	G	92.6	Very high	93.9	Very high	63 Å²	63	54.2 Å²	54.2	65%	0.649	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	-119.9	173.1	0	0	0	0	0	112.5	A829 E830	G826-A829 PolarHBondContact O-N 2.88Å; G826-E830 PolarHBondContact O-N 2.74Å
827	Q	92.9	Very high	93.1	Very high	130 Å²	130	54.5 Å²	54.5	61%	0.607	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-29.9	179.1	-74.3	-176	-22.7	0	0	112.4	F825 A829 E830 H878 G879	F825-Q827 PolarHBondContact O-N 3.06Å; Q827-A829 PolarHBondContact O-N 3.07Å; Q827-E830 PolarHBondContact O-N 3.44Å; Q827-E830 VanDerWaalsContact O-N 3.11Å; Q827-H878 HydrophobicContact CB-CB 3.88Å; Q827-H878 HydrophobicContact CG-CB 4.3Å; Q827-H878 CarbonylContact O-C 3.58Å; Q827-H878 VanDerWaalsContact O-CA 3.23Å; Q827-H878 WeakPolarHBondContact O-CA 3.33Å; Q827-H878 VanDerWaalsContact O-CB 3.24Å; Q827-H878 WeakPolarHBondContact O-CB 3.23Å; Q827-H878 PolarHBondContact O-N 3.06Å; Q827-G879 PolarHBondContact O-N 3.41Å
828	N	94.2	Very high	91.7	Very high	25 Å²	25	57.9 Å²	57.9	13%	0.134	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.6	177.5	-66.8	-6	0	0	0	111.4	D788 N790 D824 F825 D877 G879	D788-N828 VanDerWaalsContact OD2-CB 3.29Å; D788-N828 WeakPolarHBondContact OD2-CB 3.38Å; D788-N828 PolarHBondContact OD2-ND2 3.45Å; N790-N828 HydrophobicContact CB-CB 4.23Å; N790-N828 PolarHBondContact N-ND2 2.85Å; N790-N828 WeakPolarHBondContact OD1-CA 3.22Å; N790-N828 WeakPolarHBondContact OD1-CB 3.37Å; N790-N828 PolarHBondContact OD1-O 3.45Å; N790-N828 PolarHBondContact OD1-OD1 2.93Å; D824-N828 HydrophobicContact CB-CB 3.57Å; F825-N828 PolarHBondContact O-N 3.19Å; N828-D877 WeakPolarHBondContact O-CB 3.02Å; N828-G879 VanDerWaalsContact OD1-CA 3.24Å; N828-G879 WeakPolarHBondContact OD1-CA 3Å
829	A	94.6	Very high	90.4	Very high	31 Å²	31	65.6 Å²	65.6	26%	0.256	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	10.7	172.2	0	0	0	0	0	115.6	D822 D824 G826 Q827 I831	D822-A829 HydrophobicContact CB-CB 3.85Å; D824-A829 VanDerWaalsContact O-CB 3.25Å; D824-A829 WeakPolarHBondContact O-CB 3.36Å; G826-A829 PolarHBondContact O-N 2.88Å; Q827-A829 PolarHBondContact O-N 3.07Å; A829-I831 PolarHBondContact O-N 3.08Å; A829-I831 VanDerWaalsContact O-N 3.14Å
830	E	95.3	Very high	89.3	Confident	97 Å²	97	62.5 Å²	62.5	45%	0.453	33%	0.331	S	S	.	.			trans	-84.4	89.6	178.9	-166.7	179	-174.7	0	0	110.8	G826 Q827 D877 H878	G826-E830 PolarHBondContact O-N 2.74Å; Q827-E830 PolarHBondContact O-N 3.44Å; Q827-E830 VanDerWaalsContact O-N 3.11Å; E830-D877 CarbonylContact O-C 3.34Å; E830-H878 HydrophobicContact CB-CB 4.1Å; E830-H878 PolarHBondContact O-N 2.61Å; E830-H878 IonicContact OE1-CE1 3.15Å; E830-H878 IonicContact OE1-ND1 2.85Å; E830-H878 IonicContact OE2-CE1 3.37Å; E830-H878 IonicContact OE2-CG 2.64Å; E830-H878 IonicContact OE2-ND1 3.32Å; E830-H878 PolarHBondContact OE2-ND1 2.77Å
831	I	95.9	Very high	88.3	Confident	27 Å²	27	67 Å²	67	14%	0.138	35%	0.351	C	S	.	.			trans	-75.7	132.6	-172	-58.1	173.7	0	0	0	112.9	P794 A820 D822 A829 Y833 A875 Y876	P794-I831 HydrophobicContact CB-CD1 4.15Å; P794-I831 HydrophobicContact CB-CG1 4.13Å; P794-I831 HydrophobicContact CB-CG2 4.43Å; P794-I831 HydrophobicContact CG-CG1 4.39Å; A820-I831 HydrophobicContact CB-CD1 4.04Å; A820-I831 HydrophobicContact CB-CG2 4.42Å; A820-I831 VanDerWaalsContact O-CD1 3.3Å; A820-I831 WeakPolarHBondContact O-CD1 3.47Å; D822-I831 HydrophobicContact CB-CD1 4.19Å; D822-I831 HydrophobicContact CB-CG1 4.33Å; A829-I831 PolarHBondContact O-N 3.08Å; A829-I831 VanDerWaalsContact O-N 3.14Å; I831-Y833 HydrophobicContact CB-CE2 4.48Å; I831-Y833 HydrophobicContact CG2-CD2 4.29Å; I831-Y833 HydrophobicContact CG2-CE1 4.05Å; I831-Y833 HydrophobicContact CG2-CE2 3.78Å; I831-A875 HydrophobicContact CG2-CB 3.83Å; I831-Y876 CarbonylContact C-O 3.6Å; I831-Y876 WeakPolarHBondContact CA-O 3.47Å
832	I	95.4	Very high	87.5	Confident	18 Å²	18	60.2 Å²	60.2	9%	0.092	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	131	169.2	-78.3	-156.2	0	0	0	111.8	R850 A875 Y876 H878	I832-R850 HydrophobicContact CD1-CG 4.41Å; I832-R850 HydrophobicContact CG2-CG 3.72Å; I832-A875 WeakPolarHBondContact O-CA 3.31Å; I832-Y876 PolarHBondContact N-O 2.9Å; I832-Y876 PolarHBondContact O-N 2.85Å; I832-H878 WeakPolarHBondContact CD1-NE2 3.36Å; I832-H878 WeakPolarHBondContact CG1-NE2 3.38Å
833	Y	95.9	Very high	86.8	Confident	18 Å²	18	63 Å²	63	7%	0.071	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	141.5	-177.6	-60.2	-87.1	0	0	0	112.1	F796 L818 A820 I831 R850 L874 A875	F796-Y833 HydrophobicContact CE1-CD1 4.13Å; F796-Y833 AromaticContact CE1-CE1 3.87Å; F796-Y833 HydrophobicContact CE1-CE1 3.87Å; F796-Y833 HydrophobicContact CZ-CD1 4.23Å; F796-Y833 HydrophobicContact CZ-CE1 4.26Å; L818-Y833 WeakPolarHBondContact O-CE1 3.02Å; A820-Y833 HydrophobicContact CB-CE1 3.97Å; A820-Y833 PolarHBondContact N-OH 2.8Å; A820-Y833 PolarHBondContact O-OH 3Å; I831-Y833 HydrophobicContact CB-CE2 4.48Å; I831-Y833 HydrophobicContact CG2-CD2 4.29Å; I831-Y833 HydrophobicContact CG2-CE1 4.05Å; I831-Y833 HydrophobicContact CG2-CE2 3.78Å; Y833-R850 PolarHBondContact N-O 3.06Å; Y833-L874 WeakPolarHBondContact CA-O 3.45Å; Y833-A875 HydrophobicContact CD1-CB 4.32Å; Y833-A875 HydrophobicContact CE1-CB 4.27Å
834	K	93.4	Very high	86.4	Confident	106 Å²	106	65.7 Å²	65.7	46%	0.461	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.2	175.9	-175.6	-168.1	171.7	-161.4	0	110.5	V873 L874 Y876	K834-V873 WeakPolarHBondContact O-CA 3.36Å; K834-L874 PolarHBondContact N-O 2.79Å; K834-L874 PolarHBondContact O-N 2.89Å; K834-Y876 HydrophobicContact CB-CE2 4.06Å; K834-Y876 HydrophobicContact CD-CE2 4.19Å
835	L	92.3	Very high	86.3	Confident	23 Å²	23	65.7 Å²	65.7	12%	0.12	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	131.9	170.5	-162.9	150.3	0	0	0	109.5	D837 I843 F846 L848 L855 F871 V873	L835-D837 HydrophobicContact CD2-CB 3.69Å; L835-I843 HydrophobicContact CD2-CG1 3.64Å; L835-F846 HydrophobicContact CD1-CB 4.48Å; L835-L848 HydrophobicContact CB-CB 4.11Å; L835-L848 HydrophobicContact CB-CD2 4.1Å; L835-L848 HydrophobicContact CD1-CB 4.22Å; L835-L855 HydrophobicContact CD1-CD1 3.96Å; L835-F871 HydrophobicContact CD1-CD2 3.82Å; L835-F871 HydrophobicContact CD1-CE2 3.61Å; L835-F871 HydrophobicContact CD1-CZ 4.25Å; L835-F871 HydrophobicContact CD2-CB 4.46Å; L835-F871 HydrophobicContact CD2-CD2 4.06Å; L835-F871 HydrophobicContact CD2-CG 4.36Å; L835-F871 HydrophobicContact CG-CD2 3.74Å; L835-F871 HydrophobicContact CG-CE2 4.03Å; L835-V873 HydrophobicContact CG-CG2 4.49Å
836	D	85.7	Confident	86.4	Confident	49 Å²	49	61.4 Å²	61.4	26%	0.262	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	119.4	179.7	-179.5	50.9	0	0	0	110.3	K872 L874	D836-K872 HydrophobicContact CB-CB 4.26Å; D836-K872 PolarHBondContact N-O 3.39Å; D836-K872 PolarHBondContact O-N 2.65Å; D836-L874 HydrophobicContact CB-CD1 3.46Å; D836-L874 VanDerWaalsContact CB-CD1 3.46Å
837	D	77	Confident	86.4	Confident	14 Å²	14	64 Å²	64	8%	0.075	31%	0.314	C	S	.	.			trans	-145.2	86.6	-161.8	168.6	38.2	0	0	0	108.2	L835 Q839 G840 H841 S842 I843 F871	L835-D837 HydrophobicContact CD2-CB 3.69Å; D837-Q839 PolarHBondContact O-N 3.3Å; D837-G840 PolarHBondContact O-N 2.81Å; D837-G840 PolarHBondContact OD1-N 3.41Å; D837-G840 WeakPolarHBondContact OD2-CA 3.06Å; D837-G840 PolarHBondContact OD2-N 2.61Å; D837-H841 PolarHBondContact OD2-N 3.12Å; D837-S842 PolarHBondContact OD1-OG 2.85Å; D837-S842 WeakPolarHBondContact OD2-CA 3.47Å; D837-S842 WeakPolarHBondContact OD2-CB 3.38Å; D837-S842 PolarHBondContact OD2-N 2.91Å; D837-I843 HydrophobicContact CB-CD1 3.82Å; D837-I843 HydrophobicContact CB-CG1 3.8Å; D837-I843 PolarHBondContact OD2-N 3.41Å; D837-F871 HydrophobicContact CB-CB 4.34Å
838	L	65.2	Low	86.5	Confident	166 Å²	166	59 Å²	59	87%	0.869	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-13.2	-176.4	-61	172.9	0	0	0	113.5
839	Q	67.1	Low	86.5	Confident	162 Å²	162	60.1 Å²	60.1	76%	0.757	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-7	179.4	-57	-168.9	18.2	0	0	113.6	D837 H841	D837-Q839 PolarHBondContact O-N 3.3Å; Q839-H841 PolarHBondContact O-N 2.86Å; Q839-H841 VanDerWaalsContact O-N 3.16Å; Q839-H841 PolarHBondContact O-ND1 3.2Å
840	G	70.3	Confident	86.5	Confident	27 Å²	27	65.9 Å²	65.9	28%	0.278	31%	0.312	S	S	.	.	S	Bend	trans	63.4	18.3	174	0	0	0	0	0	116.3	D837 K844	D837-G840 PolarHBondContact O-N 2.81Å; D837-G840 PolarHBondContact OD1-N 3.41Å; D837-G840 WeakPolarHBondContact OD2-CA 3.06Å; D837-G840 PolarHBondContact OD2-N 2.61Å; G840-K844 WeakPolarHBondContact O-CD 3.13Å; G840-K844 WeakPolarHBondContact O-CE 3.34Å; G840-K844 PolarHBondContact O-NZ 2.69Å
841	H	73.8	Confident	86.4	Confident	100 Å²	100	66.8 Å²	66.8	46%	0.463	32%	0.32	S	S	.	.	S	Bend	trans	-94.2	-44	175.6	-72.5	66.1	0	0	0	110.6	D837 Q839 I843 K844 T845	D837-H841 PolarHBondContact OD2-N 3.12Å; Q839-H841 PolarHBondContact O-N 2.86Å; Q839-H841 VanDerWaalsContact O-N 3.16Å; Q839-H841 PolarHBondContact O-ND1 3.2Å; H841-I843 PolarHBondContact O-N 2.68Å; H841-K844 WeakPolarHBondContact O-CB 3.35Å; H841-K844 PolarHBondContact O-N 3.19Å; H841-K844 VanDerWaalsContact O-N 3.1Å; H841-T845 PolarHBondContact O-N 2.8Å; H841-T845 VanDerWaalsContact O-N 3.12Å; H841-T845 PolarHBondContact O-OG1 2.76Å
842	S	79.1	Confident	86.3	Confident	4 Å²	4	68.9 Å²	68.9	3%	0.028	33%	0.332	C	S	.	.	H	α-helix	trans	-64.9	-35.7	-179.4	-37.9	0	0	0	0	112.8	D837 K844 T845 F846 F871	D837-S842 PolarHBondContact OD1-OG 2.85Å; D837-S842 WeakPolarHBondContact OD2-CA 3.47Å; D837-S842 WeakPolarHBondContact OD2-CB 3.38Å; D837-S842 PolarHBondContact OD2-N 2.91Å; S842-K844 PolarHBondContact O-N 2.94Å; S842-T845 PolarHBondContact O-N 3.35Å; S842-F846 PolarHBondContact O-N 2.91Å; S842-F871 VanDerWaalsContact CB-CD1 3.49Å; S842-F871 WeakPolarHBondContact OG-CD1 3.37Å
843	I	80.8	Confident	86.2	Confident	83 Å²	83	68 Å²	68	43%	0.426	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-23.3	174.7	-72.6	166.8	0	0	0	112.5	L835 D837 H841 R858	L835-I843 HydrophobicContact CD2-CG1 3.64Å; D837-I843 HydrophobicContact CB-CD1 3.82Å; D837-I843 HydrophobicContact CB-CG1 3.8Å; D837-I843 PolarHBondContact OD2-N 3.41Å; H841-I843 PolarHBondContact O-N 2.68Å; I843-R858 PolarHBondContact O-NH1 3.16Å
844	K	85.6	Confident	86.2	Confident	132 Å²	132	67.8 Å²	67.8	57%	0.574	33%	0.328	S	S	*	.	H	α-helix	trans	-84.6	-47.1	175.4	-62.9	170.1	-173.8	157.5	0	110.5	G840 H841 S842 R858	G840-K844 WeakPolarHBondContact O-CD 3.13Å; G840-K844 WeakPolarHBondContact O-CE 3.34Å; G840-K844 PolarHBondContact O-NZ 2.69Å; H841-K844 WeakPolarHBondContact O-CB 3.35Å; H841-K844 PolarHBondContact O-N 3.19Å; H841-K844 VanDerWaalsContact O-N 3.1Å; S842-K844 PolarHBondContact O-N 2.94Å; K844-R858 WeakPolarHBondContact O-CD 3.28Å
845	T	92.2	Very high	86.3	Confident	11 Å²	11	62.8 Å²	62.8	7%	0.067	31%	0.306	C	S	.	.	H	α-helix	trans	-75.3	-32.9	-175.9	-56.8	0	0	0	0	114	H841 S842 L857 R858 T859 L861 Y869	H841-T845 PolarHBondContact O-N 2.8Å; H841-T845 VanDerWaalsContact O-N 3.12Å; H841-T845 PolarHBondContact O-OG1 2.76Å; S842-T845 PolarHBondContact O-N 3.35Å; T845-L857 HydrophobicContact CG2-CD1 4Å; T845-R858 WeakPolarHBondContact O-CA 3.38Å; T845-R858 VanDerWaalsContact O-CB 3.31Å; T845-R858 WeakPolarHBondContact O-CB 3.39Å; T845-R858 PolarHBondContact O-N 2.8Å; T845-T859 WeakPolarHBondContact CA-OG1 3.27Å; T845-T859 PolarHBondContact O-N 2.56Å; T845-L861 HydrophobicContact CG2-CD2 3.64Å; T845-Y869 HydrophobicContact CG2-CE1 3.95Å; T845-Y869 HydrophobicContact CG2-CE2 4.36Å; T845-Y869 WeakPolarHBondContact OG1-CE1 3.49Å; T845-Y869 PolarHBondContact OG1-OH 3.41Å
846	F	94.5	Very high	86.5	Confident	3 Å²	3	64.6 Å²	64.6	1%	0.013	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	155	-177.2	-53.7	-76	0	0	0	112.6	L805 V815 L835 S842 L855 W856 L857 L861 Y869 F871 I891	L805-F846 HydrophobicContact CD1-CE1 4.19Å; V815-F846 HydrophobicContact CG2-CD1 4.19Å; V815-F846 HydrophobicContact CG2-CE1 4.14Å; L835-F846 HydrophobicContact CD1-CB 4.48Å; S842-F846 PolarHBondContact O-N 2.91Å; F846-L855 HydrophobicContact CB-CD1 3.82Å; F846-L855 HydrophobicContact CB-CG 4.48Å; F846-L855 HydrophobicContact CG-CD1 4.45Å; F846-W856 CarbonylContact C-O 3.59Å; F846-W856 WeakPolarHBondContact CA-O 3.36Å; F846-L857 HydrophobicContact CD1-CD1 4.1Å; F846-L857 HydrophobicContact CE1-CD1 3.75Å; F846-L861 HydrophobicContact CZ-CD2 4.29Å; F846-Y869 AromaticContact CE2-CD1 3.71Å; F846-Y869 HydrophobicContact CE2-CD1 3.71Å; F846-Y869 AromaticContact CE2-CD2 3.98Å; F846-Y869 HydrophobicContact CE2-CD2 3.98Å; F846-Y869 HydrophobicContact CE2-CE1 4.14Å; F846-Y869 HydrophobicContact CE2-CE2 4.41Å; F846-Y869 AromaticContact CE2-CG 3.62Å; F846-Y869 HydrophobicContact CE2-CG 3.62Å; F846-Y869 HydrophobicContact CZ-CD2 4.03Å; F846-Y869 HydrophobicContact CZ-CE2 4.34Å; F846-Y869 HydrophobicContact CZ-CG 4.14Å; F846-F871 AromaticContact CD2-CE1 3.84Å; F846-F871 HydrophobicContact CD2-CE1 3.84Å; F846-F871 HydrophobicContact CD2-CZ 4.29Å; F846-F871 HydrophobicContact CE2-CE1 4.04Å; F846-I891 HydrophobicContact CD1-CD1 4.36Å; F846-I891 HydrophobicContact CD2-CD1 4.48Å; F846-I891 HydrophobicContact CE1-CD1 3.69Å; F846-I891 HydrophobicContact CE2-CD1 3.85Å; F846-I891 HydrophobicContact CZ-CD1 3.41Å; F846-I891 VanDerWaalsContact CZ-CD1 3.41Å
847	R	93.6	Very high	87	Confident	117 Å²	117	62.3 Å²	62.3	44%	0.442	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	112.5	171.8	-179.1	-167	70.8	-168.1	-0.6	109	W856 R858	R847-W856 HydrophobicContact CB-CB 4.35Å; R847-W856 PolarHBondContact N-O 3.03Å; R847-W856 VanDerWaalsContact NH2-CD2 3.27Å; R847-W856 WeakPolarHBondContact O-CB 3.48Å; R847-W856 PolarHBondContact O-N 2.87Å; R847-R858 HydrophobicContact CB-CB 4.25Å
848	L	94.6	Very high	87.7	Confident	26 Å²	26	68.3 Å²	68.3	14%	0.136	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	133.4	169.4	-170.7	68.6	0	0	0	110.2	L818 L835 G853 L855 V873	L818-L848 HydrophobicContact CD1-CD1 4.38Å; L835-L848 HydrophobicContact CB-CB 4.11Å; L835-L848 HydrophobicContact CB-CD2 4.1Å; L835-L848 HydrophobicContact CD1-CB 4.22Å; L848-G853 WeakPolarHBondContact CD1-O 3.22Å; L848-L855 HydrophobicContact CB-CD1 4.38Å; L848-L855 HydrophobicContact CD1-CB 4.26Å; L848-L855 HydrophobicContact CD1-CD1 4.2Å; L848-V873 HydrophobicContact CD2-CB 4.44Å; L848-V873 HydrophobicContact CD2-CG1 3.53Å; L848-V873 HydrophobicContact CD2-CG2 4.09Å
849	D	94.4	Very high	89.1	Confident	49 Å²	49	62.9 Å²	62.9	26%	0.262	29%	0.294	S	S	.	.			trans	-75.6	123.5	167.8	-173.2	-47.3	0	0	0	109.9	N851 N852 G853 T854	D849-N851 PolarHBondContact O-N 3.47Å; D849-N851 PolarHBondContact OD1-N 3.47Å; D849-N852 VanDerWaalsContact CB-OD1 3.25Å; D849-N852 WeakPolarHBondContact CB-OD1 3.29Å; D849-N852 VanDerWaalsContact CG-OD1 3.22Å; D849-N852 PolarHBondContact OD1-N 3.48Å; D849-N852 PolarHBondContact OD1-ND2 3.41Å; D849-N852 PolarHBondContact OD2-ND2 3.17Å; D849-N852 PolarHBondContact OD2-OD1 3.05Å; D849-G853 PolarHBondContact O-N 3.04Å; D849-G853 VanDerWaalsContact O-N 3.14Å; D849-T854 PolarHBondContact N-O 2.88Å
850	R	94.4	Very high	90.4	Very high	151 Å²	151	59.4 Å²	59.4	57%	0.57	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.6	-174.8	-172.7	175.4	-172.7	-125.4	-1.7	113.5	I832 Y833	I832-R850 HydrophobicContact CD1-CG 4.41Å; I832-R850 HydrophobicContact CG2-CG 3.72Å; Y833-R850 PolarHBondContact N-O 3.06Å
851	N	92.9	Very high	91.5	Very high	116 Å²	116	58.7 Å²	58.7	62%	0.62	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-20.7	-166	-60.4	2.5	0	0	0	113.1	D849	D849-N851 PolarHBondContact O-N 3.47Å; D849-N851 PolarHBondContact OD1-N 3.47Å
852	N	93.3	Very high	92.5	Very high	72 Å²	72	56.6 Å²	56.6	39%	0.385	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	1.9	-178	63.1	51	0	0	0	114.6	D849 T854	D849-N852 VanDerWaalsContact CB-OD1 3.25Å; D849-N852 WeakPolarHBondContact CB-OD1 3.29Å; D849-N852 VanDerWaalsContact CG-OD1 3.22Å; D849-N852 PolarHBondContact OD1-N 3.48Å; D849-N852 PolarHBondContact OD1-ND2 3.41Å; D849-N852 PolarHBondContact OD2-ND2 3.17Å; D849-N852 PolarHBondContact OD2-OD1 3.05Å; N852-T854 PolarHBondContact O-N 3.5Å; N852-T854 WeakPolarHBondContact OD1-CB 3.42Å; N852-T854 PolarHBondContact OD1-N 3.03Å; N852-T854 PolarHBondContact OD1-OG1 2.91Å
853	G	94.2	Very high	93.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.272	C	S	.	.			trans	70	9.4	175.8	0	0	0	0	0	115.2	L818 L848 D849 L855	L818-G853 PolarHBondContact N-O 3.31Å; L848-G853 WeakPolarHBondContact CD1-O 3.22Å; D849-G853 PolarHBondContact O-N 3.04Å; D849-G853 VanDerWaalsContact O-N 3.14Å; G853-L855 PolarHBondContact O-N 3.08Å
854	T	96.4	Very high	93.9	Very high	13 Å²	13	57 Å²	57	8%	0.08	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	120.9	176	-54.1	0	0	0	0	110.3	I814 A816 I817 D849 N852 W856	I814-T854 HydrophobicContact CB-CG2 4.49Å; I814-T854 HydrophobicContact CD1-CG2 4.18Å; I814-T854 HydrophobicContact CG1-CG2 4.02Å; I814-T854 HydrophobicContact CG2-CG2 3.79Å; A816-T854 WeakPolarHBondContact O-CA 3.48Å; I817-T854 HydrophobicContact CG1-CG2 4.25Å; D849-T854 PolarHBondContact N-O 2.88Å; N852-T854 PolarHBondContact O-N 3.5Å; N852-T854 WeakPolarHBondContact OD1-CB 3.42Å; N852-T854 PolarHBondContact OD1-N 3.03Å; N852-T854 PolarHBondContact OD1-OG1 2.91Å; T854-W856 HydrophobicContact CG2-CD2 4.24Å; T854-W856 HydrophobicContact CG2-CG 4.45Å; T854-W856 HydrophobicContact CG2-CZ2 3.92Å; T854-W856 VanDerWaalsContact O-CD1 3.3Å
855	L	95.6	Very high	94.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	119.4	175.4	-174.2	71.1	0	0	0	109.2	V815 A816 L835 F846 L848 G853 F871 I891	V815-L855 HydrophobicContact CB-CB 4.4Å; V815-L855 HydrophobicContact CB-CD2 4.02Å; V815-L855 HydrophobicContact CB-CG 4.15Å; V815-L855 WeakPolarHBondContact CB-O 3.42Å; V815-L855 HydrophobicContact CG1-CD2 3.7Å; V815-L855 HydrophobicContact CG1-CG 4.38Å; V815-L855 PolarHBondContact N-O 3.44Å; A816-L855 HydrophobicContact CB-CB 4.13Å; A816-L855 HydrophobicContact CB-CD2 4.38Å; A816-L855 PolarHBondContact N-O 3.06Å; A816-L855 PolarHBondContact O-N 3.06Å; L835-L855 HydrophobicContact CD1-CD1 3.96Å; F846-L855 HydrophobicContact CB-CD1 3.82Å; F846-L855 HydrophobicContact CB-CG 4.48Å; F846-L855 HydrophobicContact CG-CD1 4.45Å; L848-L855 HydrophobicContact CB-CD1 4.38Å; L848-L855 HydrophobicContact CD1-CB 4.26Å; L848-L855 HydrophobicContact CD1-CD1 4.2Å; G853-L855 PolarHBondContact O-N 3.08Å; L855-F871 HydrophobicContact CD1-CE2 4.3Å; L855-F871 HydrophobicContact CD1-CZ 4.17Å; L855-F871 HydrophobicContact CD2-CE2 4.43Å; L855-F871 HydrophobicContact CD2-CZ 3.85Å; L855-I891 HydrophobicContact CD2-CD1 4.37Å
856	W	95.5	Very high	94.2	Very high	62 Å²	62	60.3 Å²	60.3	24%	0.235	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	145.6	-179.2	-59.3	83.4	0	0	0	111.3	N812 S813 I814 F846 R847 T854	N812-W856 VanDerWaalsContact O-CE3 3.27Å; N812-W856 WeakPolarHBondContact O-CZ3 3.27Å; S813-W856 WeakPolarHBondContact O-CA 3.41Å; I814-W856 HydrophobicContact CD1-CH2 3.79Å; I814-W856 HydrophobicContact CD1-CZ2 4.21Å; I814-W856 HydrophobicContact CD1-CZ3 4.08Å; I814-W856 HydrophobicContact CG1-CD2 4.15Å; I814-W856 HydrophobicContact CG1-CE3 3.69Å; I814-W856 HydrophobicContact CG1-CH2 3.61Å; I814-W856 HydrophobicContact CG1-CZ2 4.06Å; I814-W856 HydrophobicContact CG1-CZ3 3.42Å; I814-W856 VanDerWaalsContact CG1-CZ3 3.42Å; F846-W856 CarbonylContact C-O 3.59Å; F846-W856 WeakPolarHBondContact CA-O 3.36Å; R847-W856 HydrophobicContact CB-CB 4.35Å; R847-W856 PolarHBondContact N-O 3.03Å; R847-W856 VanDerWaalsContact NH2-CD2 3.27Å; R847-W856 WeakPolarHBondContact O-CB 3.48Å; R847-W856 PolarHBondContact O-N 2.87Å; T854-W856 HydrophobicContact CG2-CD2 4.24Å; T854-W856 HydrophobicContact CG2-CG 4.45Å; T854-W856 HydrophobicContact CG2-CZ2 3.92Å; T854-W856 VanDerWaalsContact O-CD1 3.3Å
857	L	96.1	Very high	94.1	Very high	0 Å²	0	64 Å²	64	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	126.2	167.3	-174.4	63.1	0	0	0	109.9	M809 N812 S813 V815 T845 F846 T859 L861	M809-L857 HydrophobicContact CB-CD2 4.13Å; M809-L857 HydrophobicContact CG-CD2 3.94Å; M809-L857 WeakPolarHBondContact O-CD2 3.22Å; M809-L857 HydrophobicContact SD-CD2 4.5Å; N812-L857 WeakPolarHBondContact CA-O 3.48Å; N812-L857 PolarHBondContact N-O 3.13Å; S813-L857 PolarHBondContact O-N 2.88Å; V815-L857 HydrophobicContact CG2-CB 4.17Å; T845-L857 HydrophobicContact CG2-CD1 4Å; F846-L857 HydrophobicContact CD1-CD1 4.1Å; F846-L857 HydrophobicContact CE1-CD1 3.75Å; L857-T859 VanDerWaalsContact CD1-O 3.24Å; L857-T859 WeakPolarHBondContact CD1-O 3.3Å; L857-T859 VanDerWaalsContact CG-O 3.25Å; L857-T859 WeakPolarHBondContact CG-O 3.1Å; L857-L861 HydrophobicContact CD1-CD1 4.33Å; L857-L861 HydrophobicContact CD1-CD2 3.8Å; L857-L861 HydrophobicContact CD1-CG 3.83Å; L857-L861 HydrophobicContact CD2-CD1 4.39Å; L857-L861 HydrophobicContact CD2-CG 4.2Å
858	R	93.3	Very high	94.1	Very high	140 Å²	140	60.9 Å²	60.9	53%	0.528	30%	0.298	S	S	.	.			trans	-109.9	-30.4	-170.2	-178.6	-177.1	176.2	-167.5	2.4	113.8	V811 I843 K844 T845 R847	V811-R858 VanDerWaalsContact CG1-O 3.28Å; V811-R858 WeakPolarHBondContact CG1-O 3.42Å; I843-R858 PolarHBondContact O-NH1 3.16Å; K844-R858 WeakPolarHBondContact O-CD 3.28Å; T845-R858 WeakPolarHBondContact O-CA 3.38Å; T845-R858 VanDerWaalsContact O-CB 3.31Å; T845-R858 WeakPolarHBondContact O-CB 3.39Å; T845-R858 PolarHBondContact O-N 2.8Å; R847-R858 HydrophobicContact CB-CB 4.25Å
859	T	93.2	Very high	94	Very high	52 Å²	52	60.4 Å²	60.4	32%	0.319	29%	0.294	S	S	.	.	S	Bend	trans	-124.1	165.3	168.8	63	0	0	0	0	108.9	T845 L857	T845-T859 WeakPolarHBondContact CA-OG1 3.27Å; T845-T859 PolarHBondContact O-N 2.56Å; L857-T859 VanDerWaalsContact CD1-O 3.24Å; L857-T859 WeakPolarHBondContact CD1-O 3.3Å; L857-T859 VanDerWaalsContact CG-O 3.25Å; L857-T859 WeakPolarHBondContact CG-O 3.1Å
860	P	94.1	Very high	93.8	Very high	89 Å²	89	61.5 Å²	61.5	58%	0.578	30%	0.303	S	S	*	.			trans	-53.9	154.4	165.1	-23.5	35	0	0	0	111.5	V811	V811-P860 HydrophobicContact CG2-CB 4.48Å; V811-P860 HydrophobicContact CG2-CG 3.85Å
861	L	94.7	Very high	93.7	Very high	12 Å²	12	54.6 Å²	54.6	6%	0.063	28%	0.277	C	S	.	.			trans	-88.6	165.2	162.8	-63.1	175.9	0	0	0	108.8	L805 E807 T845 F846 L857 Y869 V893	L805-L861 HydrophobicContact CB-CD1 3.84Å; L805-L861 HydrophobicContact CD1-CD1 4.14Å; E807-L861 HydrophobicContact CB-CB 3.95Å; T845-L861 HydrophobicContact CG2-CD2 3.64Å; F846-L861 HydrophobicContact CZ-CD2 4.29Å; L857-L861 HydrophobicContact CD1-CD1 4.33Å; L857-L861 HydrophobicContact CD1-CD2 3.8Å; L857-L861 HydrophobicContact CD1-CG 3.83Å; L857-L861 HydrophobicContact CD2-CD1 4.39Å; L857-L861 HydrophobicContact CD2-CG 4.2Å; L861-Y869 HydrophobicContact CD2-CE2 3.84Å; L861-V893 HydrophobicContact CB-CG1 4.24Å; L861-V893 HydrophobicContact CD1-CG1 4.4Å; L861-V893 HydrophobicContact CD1-CG2 4.47Å; L861-V893 HydrophobicContact CD2-CG2 4.4Å
862	D	94.5	Very high	93.7	Very high	56 Å²	56	53.7 Å²	53.7	30%	0.299	27%	0.267	S	S	.	.			trans	-171.3	89.5	-163.8	175.4	-19.8	0	0	0	105	K865 L866	D862-K865 HydrophobicContact CB-CB 4.39Å; D862-K865 HydrophobicContact CB-CD 4.23Å; D862-K865 PolarHBondContact O-N 2.91Å; D862-K865 WeakPolarHBondContact OD1-CB 3.27Å; D862-K865 PolarHBondContact OD1-N 2.92Å; D862-K865 WeakPolarHBondContact OD2-CD 3.49Å; D862-K865 IonicContact OD2-NZ 2.64Å; D862-K865 PolarHBondContact OD2-NZ 3.01Å; D862-L866 PolarHBondContact O-N 3.39Å
863	R	95.1	Very high	93.8	Very high	32 Å²	32	50.2 Å²	50.2	12%	0.121	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-34	-166.3	-176.4	-134	57.5	118.2	-4.4	111.5	E807 K865 L866 D867 V893 D895 S933	E807-R863 WeakPolarHBondContact OE2-CB 3.3Å; E807-R863 PolarHBondContact OE2-N 2.7Å; R863-K865 PolarHBondContact O-N 2.81Å; R863-K865 VanDerWaalsContact O-N 3.14Å; R863-L866 CarbonylContact O-C 3.54Å; R863-L866 PolarHBondContact O-N 3.34Å; R863-D867 HydrophobicContact CG-CB 4.41Å; R863-D867 PolarHBondContact O-N 3.4Å; R863-V893 HydrophobicContact CB-CB 4.23Å; R863-V893 HydrophobicContact CB-CG1 3.76Å; R863-V893 HydrophobicContact CG-CB 4.16Å; R863-V893 HydrophobicContact CG-CG1 4.16Å; R863-D895 VanDerWaalsContact CD-OD1 3.25Å; R863-D895 WeakPolarHBondContact CD-OD1 3.26Å; R863-D895 IonicContact CZ-OD1 2.65Å; R863-D895 IonicContact NE-OD1 2.57Å; R863-D895 PolarHBondContact NE-OD1 3.13Å; R863-D895 IonicContact NH1-OD1 2.61Å; R863-D895 IonicContact NH2-OD1 3.9Å; R863-S933 PolarHBondContact NH2-O 3.14Å
864	E	94.6	Very high	93.8	Very high	64 Å²	64	51.4 Å²	51.4	30%	0.299	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.9	177.2	-65.1	57.6	-110.4	0	0	111.3	S933	E864-S933 VanDerWaalsContact CG-CB 3.41Å
865	K	91.9	Very high	93.9	Very high	161 Å²	161	50.8 Å²	50.8	70%	0.7	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-34.7	178.7	179.2	-175.9	-177.5	178.5	0	113.8	D862 R863	D862-K865 HydrophobicContact CB-CB 4.39Å; D862-K865 HydrophobicContact CB-CD 4.23Å; D862-K865 PolarHBondContact O-N 2.91Å; D862-K865 WeakPolarHBondContact OD1-CB 3.27Å; D862-K865 PolarHBondContact OD1-N 2.92Å; D862-K865 WeakPolarHBondContact OD2-CD 3.49Å; D862-K865 IonicContact OD2-NZ 2.64Å; D862-K865 PolarHBondContact OD2-NZ 3.01Å; R863-K865 PolarHBondContact O-N 2.81Å; R863-K865 VanDerWaalsContact O-N 3.14Å
866	L	91.3	Very high	93.9	Very high	51 Å²	51	54 Å²	54	27%	0.267	26%	0.264	S	S	.	.			trans	-155.4	98.3	174.7	-171.5	51.3	0	0	0	112.7	D862 R863 S868 Y869 V893	D862-L866 PolarHBondContact O-N 3.39Å; R863-L866 CarbonylContact O-C 3.54Å; R863-L866 PolarHBondContact O-N 3.34Å; L866-S868 VanDerWaalsContact CD1-O 3.27Å; L866-S868 WeakPolarHBondContact CD1-O 3.41Å; L866-S868 WeakPolarHBondContact CG-O 3.09Å; L866-S868 PolarHBondContact O-N 3.13Å; L866-Y869 HydrophobicContact CD2-CD1 3.91Å; L866-Y869 HydrophobicContact CD2-CE1 3.45Å; L866-Y869 VanDerWaalsContact CD2-CE1 3.45Å; L866-Y869 HydrophobicContact CD2-CE2 4.34Å; L866-Y869 HydrophobicContact CG-CE1 4.26Å; L866-Y869 HydrophobicContact CG-CE2 4.29Å; L866-V893 WeakPolarHBondContact O-CG2 3.4Å
867	D	92.7	Very high	93.9	Very high	82 Å²	82	51.1 Å²	51.1	44%	0.439	25%	0.253	S	S	.	.	S	Bend	trans	-64.2	-19.7	-179.3	75.4	-18.3	0	0	0	115	R863 V893	R863-D867 HydrophobicContact CG-CB 4.41Å; R863-D867 PolarHBondContact O-N 3.4Å; D867-V893 PolarHBondContact O-N 2.74Å
868	S	93.3	Very high	93.9	Very high	50 Å²	50	53.7 Å²	53.7	35%	0.35	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	145.7	-168.2	60.3	0	0	0	0	113.8	L866 I891	L866-S868 VanDerWaalsContact CD1-O 3.27Å; L866-S868 WeakPolarHBondContact CD1-O 3.41Å; L866-S868 WeakPolarHBondContact CG-O 3.09Å; L866-S868 PolarHBondContact O-N 3.13Å; S868-I891 CarbonylContact C-O 3.19Å; S868-I891 VanDerWaalsContact CA-O 3.24Å; S868-I891 WeakPolarHBondContact CA-O 3.48Å
869	Y	92	Very high	93.8	Very high	16 Å²	16	47.1 Å²	47.1	6%	0.063	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.5	174.3	-61.3	-99.5	0	0	0	110	T845 F846 L861 L866 H890 I891 V893	T845-Y869 HydrophobicContact CG2-CE1 3.95Å; T845-Y869 HydrophobicContact CG2-CE2 4.36Å; T845-Y869 WeakPolarHBondContact OG1-CE1 3.49Å; T845-Y869 PolarHBondContact OG1-OH 3.41Å; F846-Y869 AromaticContact CE2-CD1 3.71Å; F846-Y869 HydrophobicContact CE2-CD1 3.71Å; F846-Y869 AromaticContact CE2-CD2 3.98Å; F846-Y869 HydrophobicContact CE2-CD2 3.98Å; F846-Y869 HydrophobicContact CE2-CE1 4.14Å; F846-Y869 HydrophobicContact CE2-CE2 4.41Å; F846-Y869 AromaticContact CE2-CG 3.62Å; F846-Y869 HydrophobicContact CE2-CG 3.62Å; F846-Y869 HydrophobicContact CZ-CD2 4.03Å; F846-Y869 HydrophobicContact CZ-CE2 4.34Å; F846-Y869 HydrophobicContact CZ-CG 4.14Å; L861-Y869 HydrophobicContact CD2-CE2 3.84Å; L866-Y869 HydrophobicContact CD2-CD1 3.91Å; L866-Y869 HydrophobicContact CD2-CE1 3.45Å; L866-Y869 VanDerWaalsContact CD2-CE1 3.45Å; L866-Y869 HydrophobicContact CD2-CE2 4.34Å; L866-Y869 HydrophobicContact CG-CE1 4.26Å; L866-Y869 HydrophobicContact CG-CE2 4.29Å; Y869-H890 WeakPolarHBondContact O-CA 3.31Å; Y869-I891 PolarHBondContact N-O 3.44Å; Y869-I891 PolarHBondContact O-N 3.15Å; Y869-V893 HydrophobicContact CD2-CG2 4.22Å; Y869-V893 HydrophobicContact CE2-CG2 3.89Å
870	T	91.6	Very high	93.5	Very high	72 Å²	72	52.2 Å²	52.2	44%	0.442	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	117.2	174	-67	0	0	0	0	109.5	Q888 V889 H890	T870-Q888 HydrophobicContact CG2-CG 4.25Å; T870-V889 WeakPolarHBondContact CA-O 3.34Å; T870-H890 WeakPolarHBondContact CG2-ND1 3.47Å; T870-H890 PolarHBondContact OG1-ND1 3.3Å
871	F	92.2	Very high	93.3	Very high	7 Å²	7	53 Å²	53	3%	0.031	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	171.1	-179.8	55.1	-89.9	0	0	0	111.1	L835 D837 S842 F846 L855 V873 V889 I891	L835-F871 HydrophobicContact CD1-CD2 3.82Å; L835-F871 HydrophobicContact CD1-CE2 3.61Å; L835-F871 HydrophobicContact CD1-CZ 4.25Å; L835-F871 HydrophobicContact CD2-CB 4.46Å; L835-F871 HydrophobicContact CD2-CD2 4.06Å; L835-F871 HydrophobicContact CD2-CG 4.36Å; L835-F871 HydrophobicContact CG-CD2 3.74Å; L835-F871 HydrophobicContact CG-CE2 4.03Å; D837-F871 HydrophobicContact CB-CB 4.34Å; S842-F871 VanDerWaalsContact CB-CD1 3.49Å; S842-F871 WeakPolarHBondContact OG-CD1 3.37Å; F846-F871 AromaticContact CD2-CE1 3.84Å; F846-F871 HydrophobicContact CD2-CE1 3.84Å; F846-F871 HydrophobicContact CD2-CZ 4.29Å; F846-F871 HydrophobicContact CE2-CE1 4.04Å; L855-F871 HydrophobicContact CD1-CE2 4.3Å; L855-F871 HydrophobicContact CD1-CZ 4.17Å; L855-F871 HydrophobicContact CD2-CE2 4.43Å; L855-F871 HydrophobicContact CD2-CZ 3.85Å; F871-V873 HydrophobicContact CD2-CG2 4.1Å; F871-V873 HydrophobicContact CE2-CG2 3.9Å; F871-V889 HydrophobicContact CD2-CB 4.16Å; F871-V889 HydrophobicContact CD2-CG2 4.47Å; F871-V889 HydrophobicContact CE1-CB 4.36Å; F871-V889 HydrophobicContact CE1-CG1 4.28Å; F871-V889 HydrophobicContact CE2-CB 3.71Å; F871-V889 HydrophobicContact CE2-CG1 4.1Å; F871-V889 HydrophobicContact CE2-CG2 3.95Å; F871-V889 HydrophobicContact CZ-CB 3.82Å; F871-V889 HydrophobicContact CZ-CG1 3.73Å; F871-V889 HydrophobicContact CZ-CG2 4.43Å; F871-V889 PolarHBondContact N-O 2.94Å; F871-V889 VanDerWaalsContact N-O 3.12Å; F871-V889 PolarHBondContact O-N 3.41Å; F871-I891 HydrophobicContact CE1-CD1 3.93Å; F871-I891 HydrophobicContact CZ-CD1 4.16Å
872	K	93.1	Very high	93.2	Very high	96 Å²	96	58.1 Å²	58.1	42%	0.417	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	151.6	173.1	-72.3	-173.5	176.1	-173.2	0	110.9	D836 C887	D836-K872 HydrophobicContact CB-CB 4.26Å; D836-K872 PolarHBondContact N-O 3.39Å; D836-K872 PolarHBondContact O-N 2.65Å; K872-C887 WeakPolarHBondContact CA-O 3.14Å
873	V	94.4	Very high	93.2	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.7	164.3	174.5	0	0	0	0	107.8	F796 L818 K834 L835 L848 F871 S886 C887 V889	F796-V873 HydrophobicContact CE1-CG1 4.3Å; F796-V873 HydrophobicContact CZ-CG1 4Å; L818-V873 HydrophobicContact CD1-CB 4.18Å; L818-V873 HydrophobicContact CD1-CG1 4.29Å; L818-V873 HydrophobicContact CD1-CG2 3.74Å; K834-V873 WeakPolarHBondContact O-CA 3.36Å; L835-V873 HydrophobicContact CG-CG2 4.49Å; L848-V873 HydrophobicContact CD2-CB 4.44Å; L848-V873 HydrophobicContact CD2-CG1 3.53Å; L848-V873 HydrophobicContact CD2-CG2 4.09Å; F871-V873 HydrophobicContact CD2-CG2 4.1Å; F871-V873 HydrophobicContact CE2-CG2 3.9Å; V873-S886 CarbonylContact O-C 3.59Å; V873-S886 WeakPolarHBondContact O-CA 3.3Å; V873-C887 PolarHBondContact N-O 3.34Å; V873-C887 PolarHBondContact O-N 2.95Å; V873-V889 HydrophobicContact CG2-CG2 4.09Å
874	L	94.9	Very high	93.3	Very high	24 Å²	24	59.8 Å²	59.8	13%	0.126	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	145.8	175.5	-66	132.4	0	0	0	110	Y833 K834 D836 Y876 S885	Y833-L874 WeakPolarHBondContact CA-O 3.45Å; K834-L874 PolarHBondContact N-O 2.79Å; K834-L874 PolarHBondContact O-N 2.89Å; D836-L874 HydrophobicContact CB-CD1 3.46Å; D836-L874 VanDerWaalsContact CB-CD1 3.46Å; L874-Y876 HydrophobicContact CB-CD2 4.2Å; L874-Y876 HydrophobicContact CB-CE2 3.51Å; L874-Y876 HydrophobicContact CD1-CE2 4.35Å; L874-Y876 HydrophobicContact CG-CE2 4.35Å; L874-S885 VanDerWaalsContact CA-O 3.26Å; L874-S885 WeakPolarHBondContact CA-O 3.07Å
875	A	97	Very high	93.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135	165.3	0	0	0	0	0	108.3	P794 F796 A820 I831 I832 Y833 S884 S885	P794-A875 HydrophobicContact CB-CB 3.67Å; F796-A875 HydrophobicContact CE1-CB 4.42Å; F796-A875 HydrophobicContact CE2-CB 3.67Å; F796-A875 HydrophobicContact CZ-CB 3.55Å; A820-A875 HydrophobicContact CB-CB 3.67Å; I831-A875 HydrophobicContact CG2-CB 3.83Å; I832-A875 WeakPolarHBondContact O-CA 3.31Å; Y833-A875 HydrophobicContact CD1-CB 4.32Å; Y833-A875 HydrophobicContact CE1-CB 4.27Å; A875-S884 CarbonylContact O-C 3.41Å; A875-S884 WeakPolarHBondContact O-CA 3.33Å; A875-S884 WeakPolarHBondContact O-CB 3.25Å; A875-S885 PolarHBondContact N-O 2.85Å; A875-S885 PolarHBondContact O-N 2.91Å
876	Y	95.6	Very high	93.5	Very high	68 Å²	68	53.2 Å²	53.2	27%	0.267	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.7	178	-60.4	-92.4	0	0	0	109.2	I831 I832 K834 L874 S884	I831-Y876 CarbonylContact C-O 3.6Å; I831-Y876 WeakPolarHBondContact CA-O 3.47Å; I832-Y876 PolarHBondContact N-O 2.9Å; I832-Y876 PolarHBondContact O-N 2.85Å; K834-Y876 HydrophobicContact CB-CE2 4.06Å; K834-Y876 HydrophobicContact CD-CE2 4.19Å; L874-Y876 HydrophobicContact CB-CD2 4.2Å; L874-Y876 HydrophobicContact CB-CE2 3.51Å; L874-Y876 HydrophobicContact CD1-CE2 4.35Å; L874-Y876 HydrophobicContact CG-CE2 4.35Å; Y876-S884 VanDerWaalsContact CD1-CB 3.41Å
877	D	96.9	Very high	93.7	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	27%	0.274	C	S	.	.			trans	-82	-175.9	170.9	61.1	43.2	0	0	0	113.6	N790 P794 N828 E830 G879 K882 Q883	N790-D877 PolarHBondContact ND2-OD2 3.36Å; N790-D877 PolarHBondContact OD1-OD2 3.14Å; P794-D877 HydrophobicContact CG-CB 4.25Å; N828-D877 WeakPolarHBondContact O-CB 3.02Å; E830-D877 CarbonylContact O-C 3.34Å; D877-G879 PolarHBondContact OD1-N 3.49Å; D877-K882 PolarHBondContact O-NZ 2.84Å; D877-K882 VanDerWaalsContact OD1-CA 3.31Å; D877-K882 WeakPolarHBondContact OD1-CA 3.3Å; D877-K882 WeakPolarHBondContact OD1-CG 3.37Å; D877-K882 IonicContact OD1-NZ 3.56Å; D877-Q883 VanDerWaalsContact OD2-CA 3.3Å; D877-Q883 WeakPolarHBondContact OD2-CA 3.45Å; D877-Q883 VanDerWaalsContact OD2-CB 3.27Å; D877-Q883 WeakPolarHBondContact OD2-CB 3.3Å; D877-Q883 PolarHBondContact OD2-N 2.67Å
878	H	94.7	Very high	93.7	Very high	54 Å²	54	50.1 Å²	50.1	25%	0.25	27%	0.268	C	S	.	.	S	Bend	trans	-98.7	0.1	162	-72.5	170.6	0	0	0	115.5	Q827 E830 I832 K882	Q827-H878 HydrophobicContact CB-CB 3.88Å; Q827-H878 HydrophobicContact CG-CB 4.3Å; Q827-H878 CarbonylContact O-C 3.58Å; Q827-H878 VanDerWaalsContact O-CA 3.23Å; Q827-H878 WeakPolarHBondContact O-CA 3.33Å; Q827-H878 VanDerWaalsContact O-CB 3.24Å; Q827-H878 WeakPolarHBondContact O-CB 3.23Å; Q827-H878 PolarHBondContact O-N 3.06Å; E830-H878 HydrophobicContact CB-CB 4.1Å; E830-H878 PolarHBondContact O-N 2.61Å; E830-H878 IonicContact OE1-CE1 3.15Å; E830-H878 IonicContact OE1-ND1 2.85Å; E830-H878 IonicContact OE2-CE1 3.37Å; E830-H878 IonicContact OE2-CG 2.64Å; E830-H878 IonicContact OE2-ND1 3.32Å; E830-H878 PolarHBondContact OE2-ND1 2.77Å; I832-H878 WeakPolarHBondContact CD1-NE2 3.36Å; I832-H878 WeakPolarHBondContact CG1-NE2 3.38Å; H878-K882 PolarHBondContact O-NZ 2.92Å
879	G	91.4	Very high	93.8	Very high	2 Å²	2	47.7 Å²	47.7	2%	0.021	25%	0.252	C	S	.	.	S	Bend	trans	-66.5	177	-179.3	0	0	0	0	0	116.2	Q827 N828 D877 K882	Q827-G879 PolarHBondContact O-N 3.41Å; N828-G879 VanDerWaalsContact OD1-CA 3.24Å; N828-G879 WeakPolarHBondContact OD1-CA 3Å; D877-G879 PolarHBondContact OD1-N 3.49Å; G879-K882 WeakPolarHBondContact O-CG 3.38Å
880	I	86.7	Confident	93.9	Very high	159 Å²	159	48.9 Å²	48.9	82%	0.815	26%	0.257	S	S	*	.	S	Bend	trans	-140.8	114	-179	-56.2	-179.6	0	0	0	109.1
881	P	90.9	Very high	94	Very high	106 Å²	106	45.6 Å²	45.6	69%	0.688	24%	0.237	S	C	*	.	S	Bend	cis	-68.8	148.9	-5.6	32	-36.1	0	0	0	111.7	N790 Q883	N790-P881 PolarHBondContact ND2-O 2.81Å; P881-Q883 PolarHBondContact O-N 3.37Å
882	K	92.8	Very high	94.1	Very high	119 Å²	119	49.3 Å²	49.3	52%	0.517	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-66.8	124.1	177.8	-65.5	-169.3	167.8	-56.7	0	112.4	D877 H878 G879	D877-K882 PolarHBondContact O-NZ 2.84Å; D877-K882 VanDerWaalsContact OD1-CA 3.31Å; D877-K882 WeakPolarHBondContact OD1-CA 3.3Å; D877-K882 WeakPolarHBondContact OD1-CG 3.37Å; D877-K882 IonicContact OD1-NZ 3.56Å; H878-K882 PolarHBondContact O-NZ 2.92Å; G879-K882 WeakPolarHBondContact O-CG 3.38Å
883	Q	95.2	Very high	94.3	Very high	65 Å²	65	44.7 Å²	44.7	30%	0.304	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-84.5	163.6	162.7	-54.1	-125.3	37.3	0	0	110.3	N790 D791 H792 A793 D877 P881	N790-Q883 WeakPolarHBondContact ND2-CG 3.33Å; N790-Q883 PolarHBondContact O-NE2 2.93Å; D791-Q883 PolarHBondContact O-NE2 3.01Å; D791-Q883 VanDerWaalsContact O-NE2 3.07Å; H792-Q883 WeakPolarHBondContact O-CG 3.05Å; H792-Q883 PolarHBondContact O-NE2 2.85Å; A793-Q883 HydrophobicContact CB-CB 3.77Å; A793-Q883 HydrophobicContact CB-CG 4.43Å; D877-Q883 VanDerWaalsContact OD2-CA 3.3Å; D877-Q883 WeakPolarHBondContact OD2-CA 3.45Å; D877-Q883 VanDerWaalsContact OD2-CB 3.27Å; D877-Q883 WeakPolarHBondContact OD2-CB 3.3Å; D877-Q883 PolarHBondContact OD2-N 2.67Å; P881-Q883 PolarHBondContact O-N 3.37Å
884	S	95.4	Very high	94.2	Very high	58 Å²	58	50.2 Å²	50.2	41%	0.406	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	158.5	176.9	60.7	0	0	0	0	112.4	A875 Y876	A875-S884 CarbonylContact O-C 3.41Å; A875-S884 WeakPolarHBondContact O-CA 3.33Å; A875-S884 WeakPolarHBondContact O-CB 3.25Å; Y876-S884 VanDerWaalsContact CD1-CB 3.41Å
885	S	96.4	Very high	94.2	Very high	36 Å²	36	49.5 Å²	49.5	25%	0.252	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	177	163.3	83.7	0	0	0	0	111.7	P794 F796 L874 A875	P794-S885 WeakPolarHBondContact O-CB 3.46Å; P794-S885 PolarHBondContact O-OG 2.84Å; F796-S885 WeakPolarHBondContact CD2-OG 3.47Å; L874-S885 VanDerWaalsContact CA-O 3.26Å; L874-S885 WeakPolarHBondContact CA-O 3.07Å; A875-S885 PolarHBondContact N-O 2.85Å; A875-S885 PolarHBondContact O-N 2.91Å
886	S	95.3	Very high	94.1	Very high	51 Å²	51	52.4 Å²	52.4	36%	0.357	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	146.8	171.4	63.4	0	0	0	0	111.8	V873	V873-S886 CarbonylContact O-C 3.59Å; V873-S886 WeakPolarHBondContact O-CA 3.3Å
887	C	95.1	Very high	94.1	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.014	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	159.4	161.5	60.4	0	0	0	0	110.2	F796 K798 Q799 F801 K872 V873	F796-C887 HydrophobicContact CB-CB 4.09Å; F796-C887 HydrophobicContact CD1-CB 4.3Å; F796-C887 VanDerWaalsContact CD1-SG 3.54Å; F796-C887 HydrophobicContact CD2-CB 3.84Å; F796-C887 HydrophobicContact CE2-CB 4.36Å; F796-C887 HydrophobicContact CG-CB 3.81Å; K798-C887 WeakPolarHBondContact O-CB 3.31Å; Q799-C887 CarbonylContact O-C 3.45Å; Q799-C887 WeakPolarHBondContact O-CA 3.28Å; F801-C887 HydrophobicContact CD2-CB 4.11Å; F801-C887 HydrophobicContact CE2-CB 3.92Å; K872-C887 WeakPolarHBondContact CA-O 3.14Å; V873-C887 PolarHBondContact N-O 3.34Å; V873-C887 PolarHBondContact O-N 2.95Å
888	Q	94	Very high	94	Very high	66 Å²	66	55 Å²	55	31%	0.308	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136	174.6	-173.1	165.6	3.1	0	0	109.7	Q799 I800 F801 T870 H890	Q799-Q888 PolarHBondContact O-N 3.02Å; I800-Q888 CarbonylContact C-O 3.48Å; I800-Q888 WeakPolarHBondContact CA-O 3.34Å; I800-Q888 HydrophobicContact CG1-CB 4.49Å; F801-Q888 PolarHBondContact N-O 3.02Å; T870-Q888 HydrophobicContact CG2-CG 4.25Å; Q888-H890 PolarHBondContact NE2-CE1 3.18Å; Q888-H890 VanDerWaalsContact NE2-CE1 3.29Å
889	V	94.1	Very high	94	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	121.9	177.5	-175.2	0	0	0	0	108.1	Y803 L818 T870 F871 V873 I891	Y803-V889 HydrophobicContact CD2-CG1 3.98Å; Y803-V889 HydrophobicContact CE2-CG1 4.06Å; L818-V889 HydrophobicContact CD1-CG2 3.77Å; L818-V889 HydrophobicContact CD2-CG2 4.44Å; T870-V889 WeakPolarHBondContact CA-O 3.34Å; F871-V889 HydrophobicContact CD2-CB 4.16Å; F871-V889 HydrophobicContact CD2-CG2 4.47Å; F871-V889 HydrophobicContact CE1-CB 4.36Å; F871-V889 HydrophobicContact CE1-CG1 4.28Å; F871-V889 HydrophobicContact CE2-CB 3.71Å; F871-V889 HydrophobicContact CE2-CG1 4.1Å; F871-V889 HydrophobicContact CE2-CG2 3.95Å; F871-V889 HydrophobicContact CZ-CB 3.82Å; F871-V889 HydrophobicContact CZ-CG1 3.73Å; F871-V889 HydrophobicContact CZ-CG2 4.43Å; F871-V889 PolarHBondContact N-O 2.94Å; F871-V889 VanDerWaalsContact N-O 3.12Å; F871-V889 PolarHBondContact O-N 3.41Å; V873-V889 HydrophobicContact CG2-CG2 4.09Å; V889-I891 HydrophobicContact CG1-CD1 4.41Å; V889-I891 HydrophobicContact CG1-CG1 4.12Å
890	H	93.6	Very high	94.2	Very high	40 Å²	40	55.5 Å²	55.5	19%	0.185	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.2	169.2	-61.3	-78.1	0	0	0	109.6	I800 F801 Y802 Y803 Y869 T870 Q888	I800-H890 VanDerWaalsContact CG2-CD2 3.41Å; I800-H890 WeakPolarHBondContact CG2-CD2 3.45Å; F801-H890 PolarHBondContact O-N 3.1Å; Y802-H890 WeakPolarHBondContact CA-O 3.39Å; Y802-H890 HydrophobicContact CD1-CB 3.63Å; Y802-H890 AromaticContact CD1-CD2 3.98Å; Y802-H890 HydrophobicContact CE1-CB 3.79Å; Y802-H890 AromaticContact CE1-CD2 3.35Å; Y802-H890 WeakPolarHBondContact CE1-CD2 3.34Å; Y802-H890 AromaticContact CE1-CG 3.74Å; Y802-H890 AromaticContact CZ-CD2 3.65Å; Y803-H890 PolarHBondContact N-O 2.95Å; Y869-H890 WeakPolarHBondContact O-CA 3.31Å; T870-H890 WeakPolarHBondContact CG2-ND1 3.47Å; T870-H890 PolarHBondContact OG1-ND1 3.3Å; Q888-H890 PolarHBondContact NE2-CE1 3.18Å; Q888-H890 VanDerWaalsContact NE2-CE1 3.29Å
891	I	94.5	Very high	94.6	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.015	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121.7	174.8	-58.6	178.3	0	0	0	107.3	Y803 L805 V815 F846 L855 S868 Y869 F871 V889	Y803-I891 CarbonylContact O-C 3.49Å; Y803-I891 VanDerWaalsContact O-CA 3.28Å; Y803-I891 WeakPolarHBondContact O-CA 3.43Å; L805-I891 HydrophobicContact CB-CG2 4.41Å; L805-I891 HydrophobicContact CD1-CD1 4.33Å; L805-I891 HydrophobicContact CD1-CG2 3.63Å; L805-I891 HydrophobicContact CG-CG2 3.78Å; V815-I891 HydrophobicContact CG1-CD1 4.11Å; F846-I891 HydrophobicContact CD1-CD1 4.36Å; F846-I891 HydrophobicContact CD2-CD1 4.48Å; F846-I891 HydrophobicContact CE1-CD1 3.69Å; F846-I891 HydrophobicContact CE2-CD1 3.85Å; F846-I891 HydrophobicContact CZ-CD1 3.41Å; F846-I891 VanDerWaalsContact CZ-CD1 3.41Å; L855-I891 HydrophobicContact CD2-CD1 4.37Å; S868-I891 CarbonylContact C-O 3.19Å; S868-I891 VanDerWaalsContact CA-O 3.24Å; S868-I891 WeakPolarHBondContact CA-O 3.48Å; Y869-I891 PolarHBondContact N-O 3.44Å; Y869-I891 PolarHBondContact O-N 3.15Å; F871-I891 HydrophobicContact CE1-CD1 3.93Å; F871-I891 HydrophobicContact CZ-CD1 4.16Å; V889-I891 HydrophobicContact CG1-CD1 4.41Å; V889-I891 HydrophobicContact CG1-CG1 4.12Å
892	K	95.3	Very high	94.7	Very high	85 Å²	85	47.1 Å²	47.1	37%	0.37	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.9	160.4	177.1	168.7	-176.6	-174.4	0	108.3	Y803 N804 L805 E935	Y803-K892 PolarHBondContact O-N 2.84Å; N804-K892 WeakPolarHBondContact CA-O 3.43Å; L805-K892 PolarHBondContact N-O 2.64Å; K892-E935 IonicContact NZ-OE1 3.88Å; K892-E935 PolarHBondContact NZ-OE1 3.04Å; K892-E935 IonicContact NZ-OE2 2.72Å; K892-E935 PolarHBondContact NZ-OE2 3.09Å
893	V	95.8	Very high	94.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	132.9	166.7	-170.4	0	0	0	0	108.5	L805 E807 L861 R863 L866 D867 Y869	L805-V893 CarbonylContact O-C 3.47Å; L805-V893 WeakPolarHBondContact O-CA 3.2Å; E807-V893 HydrophobicContact CB-CG1 3.66Å; L861-V893 HydrophobicContact CB-CG1 4.24Å; L861-V893 HydrophobicContact CD1-CG1 4.4Å; L861-V893 HydrophobicContact CD1-CG2 4.47Å; L861-V893 HydrophobicContact CD2-CG2 4.4Å; R863-V893 HydrophobicContact CB-CB 4.23Å; R863-V893 HydrophobicContact CB-CG1 3.76Å; R863-V893 HydrophobicContact CG-CB 4.16Å; R863-V893 HydrophobicContact CG-CG1 4.16Å; L866-V893 WeakPolarHBondContact O-CG2 3.4Å; D867-V893 PolarHBondContact O-N 2.74Å; Y869-V893 HydrophobicContact CD2-CG2 4.22Å; Y869-V893 HydrophobicContact CE2-CG2 3.89Å
894	H	93.5	Very high	94.2	Very high	116 Å²	116	42.5 Å²	42.5	54%	0.537	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.3	175.9	-169.1	-64.2	0	0	0	109.7	L805 E807	L805-H894 PolarHBondContact O-N 2.73Å; E807-H894 PolarHBondContact N-O 2.76Å
895	D	95	Very high	93.8	Very high	8 Å²	8	45 Å²	45	4%	0.043	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-58.6	138.2	179.4	-162.4	84	0	0	0	113.8	E807 R863 E935 N938	E807-D895 VanDerWaalsContact OE1-CA 3.23Å; E807-D895 WeakPolarHBondContact OE1-CA 3.41Å; R863-D895 VanDerWaalsContact CD-OD1 3.25Å; R863-D895 WeakPolarHBondContact CD-OD1 3.26Å; R863-D895 IonicContact CZ-OD1 2.65Å; R863-D895 IonicContact NE-OD1 2.57Å; R863-D895 PolarHBondContact NE-OD1 3.13Å; R863-D895 IonicContact NH1-OD1 2.61Å; R863-D895 IonicContact NH2-OD1 3.9Å; D895-E935 HydrophobicContact CB-CB 3.73Å; D895-E935 VanDerWaalsContact CG-CB 3.43Å; D895-E935 VanDerWaalsContact OD1-CB 3.27Å; D895-E935 WeakPolarHBondContact OD1-CB 3.5Å; D895-E935 PolarHBondContact OD1-N 3.33Å; D895-E935 PolarHBondContact OD2-N 3.13Å; D895-E935 VanDerWaalsContact OD2-N 3.11Å; D895-N938 WeakPolarHBondContact OD2-CB 3.12Å; D895-N938 PolarHBondContact OD2-ND2 3.38Å
896	I	95	Very high	93	Very high	61 Å²	61	43.7 Å²	43.7	31%	0.313	22%	0.222	S	C	.	.			trans	-130	139.5	169.3	-67.5	-65.3	0	0	0	108.1	S806 E807 D808 D898	S806-I896 WeakPolarHBondContact OG-CD1 3.47Å; S806-I896 VanDerWaalsContact OG-CG1 3.28Å; S806-I896 WeakPolarHBondContact OG-CG1 3.46Å; E807-I896 HydrophobicContact CG-CB 4.04Å; E807-I896 HydrophobicContact CG-CG1 4.18Å; E807-I896 PolarHBondContact OE1-N 2.75Å; D808-I896 HydrophobicContact CB-CG1 4.37Å; I896-D898 WeakPolarHBondContact O-CB 3.2Å; I896-D898 PolarHBondContact O-N 2.89Å
897	N	95.4	Very high	91.8	Very high	16 Å²	16	44.1 Å²	44.1	9%	0.086	22%	0.223	C	C	.	.	S	Bend	trans	-69.2	90.4	-178.8	-154.3	65.3	0	0	0	110.3	D934 N938 D987 P991 L993	N897-D934 WeakPolarHBondContact CA-OD2 3.38Å; N897-N938 HydrophobicContact CB-CB 4.22Å; N897-N938 PolarHBondContact N-ND2 2.75Å; N897-N938 WeakPolarHBondContact OD1-CA 3.41Å; N897-N938 WeakPolarHBondContact OD1-CB 3.15Å; N897-N938 VanDerWaalsContact OD1-CG 3.28Å; N897-N938 PolarHBondContact OD1-O 2.72Å; N897-N938 PolarHBondContact OD1-OD1 3.48Å; N897-D987 VanDerWaalsContact ND2-CG 3.3Å; N897-D987 PolarHBondContact ND2-OD2 2.67Å; N897-D987 PolarHBondContact OD1-OD2 3.27Å; N897-P991 PolarHBondContact ND2-O 2.88Å; N897-L993 WeakPolarHBondContact ND2-CG 3.08Å
898	D	94	Very high	90.2	Very high	107 Å²	107	50.7 Å²	50.7	57%	0.572	25%	0.253	S	S	*	.			trans	-115.9	-36.1	-169.7	158.5	-79.5	0	0	0	110.3	I896 D934	I896-D898 WeakPolarHBondContact O-CB 3.2Å; I896-D898 PolarHBondContact O-N 2.89Å; D898-D934 PolarHBondContact N-OD2 3.08Å
899	N	94.8	Very high	88.9	Confident	29 Å²	29	52.7 Å²	52.7	16%	0.155	27%	0.274	C	S	.	.	S	Bend	trans	-87.6	123.6	177.1	-75.5	-88.1	0	0	0	110.9	K902 D932 S933 D934	N899-K902 PolarHBondContact OD1-NZ 2.89Å; N899-D932 WeakPolarHBondContact CB-OD1 3.46Å; N899-S933 PolarHBondContact OD1-OG 3.13Å; N899-D934 VanDerWaalsContact CB-OD1 3.24Å; N899-D934 WeakPolarHBondContact CB-OD1 3.14Å; N899-D934 PolarHBondContact N-OD2 2.91Å; N899-D934 PolarHBondContact ND2-OD1 3.41Å
900	A	95	Very high	87.4	Confident	38 Å²	38	56.7 Å²	56.7	31%	0.314	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-74.8	140.1	165.1	0	0	0	0	0	110.4	K902 D932 L993	A900-K902 VanDerWaalsContact O-CD 3.24Å; A900-K902 WeakPolarHBondContact O-CD 3.14Å; A900-K902 WeakPolarHBondContact O-CE 3.31Å; A900-K902 PolarHBondContact O-NZ 2.84Å; A900-D932 VanDerWaalsContact C-OD2 3.3Å; A900-L993 HydrophobicContact CB-CB 4Å; A900-L993 HydrophobicContact CB-CD1 4.48Å
901	P	95.8	Very high	86.6	Confident	4 Å²	4	57.7 Å²	57.7	3%	0.026	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-55.9	137.3	177.6	-31.5	35.5	0	0	0	113.7	D932 L941 V985 D987 G995	P901-D932 WeakPolarHBondContact CA-OD2 3.48Å; P901-D932 WeakPolarHBondContact CD-OD2 3.26Å; P901-D932 VanDerWaalsContact CG-OD2 3.23Å; P901-D932 WeakPolarHBondContact CG-OD2 3.32Å; P901-L941 HydrophobicContact CB-CD2 3.76Å; P901-L941 HydrophobicContact CG-CD2 3.79Å; P901-V985 HydrophobicContact CB-CG1 3.86Å; P901-V985 HydrophobicContact CB-CG2 4.18Å; P901-D987 HydrophobicContact CG-CB 4.18Å; P901-G995 WeakPolarHBondContact O-CA 3.46Å
902	K	92	Very high	86	Confident	85 Å²	85	59 Å²	59	37%	0.37	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.5	-179.3	-63	109.2	-176.8	161.2	0	111.7	N899 A900 V904 A930 T931	N899-K902 PolarHBondContact OD1-NZ 2.89Å; A900-K902 VanDerWaalsContact O-CD 3.24Å; A900-K902 WeakPolarHBondContact O-CD 3.14Å; A900-K902 WeakPolarHBondContact O-CE 3.31Å; A900-K902 PolarHBondContact O-NZ 2.84Å; K902-V904 PolarHBondContact O-N 2.85Å; K902-A930 CarbonylContact O-C 3.51Å; K902-A930 WeakPolarHBondContact O-CA 3.08Å; K902-A930 VanDerWaalsContact O-CB 3.32Å; K902-A930 WeakPolarHBondContact O-CB 3.45Å; K902-T931 PolarHBondContact N-O 2.9Å; K902-T931 PolarHBondContact O-N 2.92Å
903	F	89.8	Confident	85.5	Confident	12 Å²	12	55.2 Å²	55.2	5%	0.053	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	122.5	171.9	-78.6	-80.5	0	0	0	111	L928 A930 F943 F983 V985 A997	F903-L928 HydrophobicContact CE1-CB 4.38Å; F903-L928 HydrophobicContact CE1-CD1 4.35Å; F903-A930 HydrophobicContact CD1-CB 4.16Å; F903-A930 HydrophobicContact CG-CB 4.43Å; F903-F943 AromaticContact CE1-CD1 3.99Å; F903-F943 HydrophobicContact CE1-CD1 3.99Å; F903-F943 AromaticContact CE1-CE1 3.86Å; F903-F943 HydrophobicContact CE1-CE1 3.86Å; F903-F943 HydrophobicContact CZ-CD1 4.36Å; F903-F983 HydrophobicContact CE2-CB 4.46Å; F903-F983 HydrophobicContact CZ-CB 3.8Å; F903-V985 HydrophobicContact CD2-CG1 3.87Å; F903-V985 HydrophobicContact CE1-CB 4.39Å; F903-V985 HydrophobicContact CE1-CG1 4.2Å; F903-V985 HydrophobicContact CE2-CB 4.14Å; F903-V985 HydrophobicContact CE2-CG1 3.42Å; F903-V985 VanDerWaalsContact CE2-CG1 3.42Å; F903-V985 HydrophobicContact CG-CG1 4.45Å; F903-V985 HydrophobicContact CZ-CB 3.83Å; F903-V985 HydrophobicContact CZ-CG1 3.6Å; F903-A997 HydrophobicContact CB-CB 4.33Å; F903-A997 HydrophobicContact CD1-CB 4.43Å; F903-A997 HydrophobicContact CD2-CB 3.36Å; F903-A997 HydrophobicContact CE2-CB 3.61Å; F903-A997 HydrophobicContact CG-CB 3.81Å; F903-A997 HydrophobicContact CZ-CB 4.27Å
904	V	88.8	Confident	84.9	Confident	75 Å²	75	61.6 Å²	61.6	46%	0.455	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-33	176.8	-179.9	0	0	0	0	111.1	K902 T929 T931	K902-V904 PolarHBondContact O-N 2.85Å; V904-T929 PolarHBondContact N-O 2.69Å; V904-T931 HydrophobicContact CG2-CG2 3.78Å; V904-T931 VanDerWaalsContact CG2-OG1 3.27Å; V904-T931 WeakPolarHBondContact CG2-OG1 3.38Å
905	Y	86.7	Confident	84.4	Confident	112 Å²	112	56.3 Å²	56.3	44%	0.439	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	132.7	177.4	-179	-95.7	0	0	0	111.8	V926 K927 T929	Y905-V926 HydrophobicContact CE1-CG2 3.64Å; Y905-K927 WeakPolarHBondContact CD1-O 2.98Å; Y905-T929 PolarHBondContact N-O 2.82Å; Y905-T929 PolarHBondContact O-N 3.24Å
906	P	78.8	Confident	83.7	Confident	7 Å²	7	56.1 Å²	56.1	5%	0.045	29%	0.293	C	S	.	.	S	Bend	cis	-64.4	149.9	-5.9	28.7	-35.1	0	0	0	112.3	V913 I999	P906-V913 HydrophobicContact CB-CG2 4.25Å; P906-V913 HydrophobicContact CG-CG2 4.06Å; P906-I999 HydrophobicContact CG-CB 4.47Å; P906-I999 HydrophobicContact CG-CD1 3.64Å; P906-I999 HydrophobicContact CG-CG1 3.88Å; P906-I999 HydrophobicContact CG-CG2 3.81Å
907	T	70.7	Confident	82.8	Confident	61 Å²	61	54.1 Å²	54.1	37%	0.374	28%	0.284	S	S	.	.			trans	-71.5	151.7	-168.3	58.3	0	0	0	0	112.6	S909 N910 H911	T907-S909 PolarHBondContact O-N 2.85Å; T907-S909 PolarHBondContact OG1-OG 2.04Å; T907-N910 CarbonylContact O-C 3.56Å; T907-N910 PolarHBondContact O-N 2.96Å; T907-H911 PolarHBondContact O-N 2.81Å
908	H	61.4	Low	82	Confident	139 Å²	139	60.2 Å²	60.2	64%	0.644	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-24.8	173.9	-72.4	-64.7	0	0	0	115	H911	H908-H911 PolarHBondContact O-CD2 2.94Å; H908-H911 PolarHBondContact O-NE2 3.04Å
909	S	66.8	Low	81.1	Confident	109 Å²	109	55.5 Å²	55.5	76%	0.762	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-19.7	176.6	52.6	0	0	0	0	114.4	T907	T907-S909 PolarHBondContact O-N 2.85Å; T907-S909 PolarHBondContact OG1-OG 2.04Å
910	N	63.4	Low	80.4	Confident	83 Å²	83	59.1 Å²	59.1	44%	0.444	30%	0.301	S	S	.	.			trans	-148.2	76.9	-176.6	-173.5	22.1	0	0	0	110.8	T907 T912	T907-N910 CarbonylContact O-C 3.56Å; T907-N910 PolarHBondContact O-N 2.96Å; N910-T912 PolarHBondContact O-N 3.04Å; N910-T912 WeakPolarHBondContact OD1-CB 3.35Å; N910-T912 PolarHBondContact OD1-OG1 3.16Å
911	H	75.9	Confident	79.7	Confident	61 Å²	61	59.4 Å²	59.4	28%	0.282	30%	0.299	S	S	.	.			trans	-67.1	40.7	172	-69.8	-83.6	0	0	0	113.3	T907 H908 N998 N1000	T907-H911 PolarHBondContact O-N 2.81Å; H908-H911 PolarHBondContact O-CD2 2.94Å; H908-H911 PolarHBondContact O-NE2 3.04Å; H911-N998 WeakPolarHBondContact CB-O 3.45Å; H911-N998 PolarHBondContact ND1-O 3.48Å; H911-N1000 WeakPolarHBondContact O-CB 2.92Å; H911-N1000 PolarHBondContact O-N 2.96Å; H911-N1000 PolarHBondContact O-ND2 2.92Å
912	T	83.2	Confident	78.7	Confident	31 Å²	31	61.4 Å²	61.4	19%	0.19	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	120.8	-175.8	-42	0	0	0	0	111	N910 Y914 N1000 I1002	N910-T912 PolarHBondContact O-N 3.04Å; N910-T912 WeakPolarHBondContact OD1-CB 3.35Å; N910-T912 PolarHBondContact OD1-OG1 3.16Å; T912-Y914 HydrophobicContact CG2-CD2 4.19Å; T912-Y914 HydrophobicContact CG2-CE2 3.62Å; T912-N1000 CarbonylContact C-O 3.5Å; T912-N1000 WeakPolarHBondContact CA-O 3.18Å; T912-N1000 HydrophobicContact CG2-CB 4.22Å; T912-I1002 HydrophobicContact CG2-CD1 3.58Å; T912-I1002 HydrophobicContact CG2-CG1 3.84Å
913	V	84.5	Confident	78.2	Confident	6 Å²	6	60.4 Å²	60.4	4%	0.036	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	134.1	171.4	178.4	0	0	0	0	108.4	P906 V926 I999 N1000 I1001 I1002	P906-V913 HydrophobicContact CB-CG2 4.25Å; P906-V913 HydrophobicContact CG-CG2 4.06Å; V913-V926 HydrophobicContact CG1-CB 3.75Å; V913-V926 HydrophobicContact CG1-CG1 3.92Å; V913-V926 HydrophobicContact CG1-CG2 3.88Å; V913-V926 HydrophobicContact CG2-CG1 4.37Å; V913-V926 HydrophobicContact CG2-CG2 4.13Å; V913-I999 HydrophobicContact CG2-CG2 3.89Å; V913-N1000 PolarHBondContact N-O 3.01Å; V913-I1001 HydrophobicContact CB-CD1 3.83Å; V913-I1001 HydrophobicContact CG1-CD1 4.4Å; V913-I1001 HydrophobicContact CG2-CD1 4.16Å; V913-I1002 PolarHBondContact O-N 3.13Å
914	Y	83.2	Confident	77.9	Confident	133 Å²	133	61.3 Å²	61.3	52%	0.522	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125	174	-70.6	-94.6	0	0	0	108.6	T912 I1002	T912-Y914 HydrophobicContact CG2-CD2 4.19Å; T912-Y914 HydrophobicContact CG2-CE2 3.62Å; Y914-I1002 HydrophobicContact CD1-CB 4.01Å; Y914-I1002 HydrophobicContact CD1-CD1 4.5Å; Y914-I1002 HydrophobicContact CD1-CG2 4.1Å; Y914-I1002 HydrophobicContact CE1-CB 4.17Å; Y914-I1002 HydrophobicContact CE1-CD1 3.81Å; Y914-I1002 HydrophobicContact CE1-CG1 4.47Å; Y914-I1002 HydrophobicContact CE1-CG2 4.13Å
915	A	82	Confident	77.7	Confident	5 Å²	5	58.1 Å²	58.1	4%	0.041	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	154.7	178.6	0	0	0	0	0	111.1	L925 I1002 L1003 D1004 S1007	A915-L925 HydrophobicContact CB-CB 4.08Å; A915-L925 HydrophobicContact CB-CD2 3.92Å; A915-I1002 PolarHBondContact N-O 3.27Å; A915-L1003 HydrophobicContact CB-CD2 3.83Å; A915-L1003 WeakPolarHBondContact O-CA 3.32Å; A915-D1004 PolarHBondContact O-N 2.99Å; A915-S1007 VanDerWaalsContact C-CB 3.45Å; A915-S1007 WeakPolarHBondContact O-CB 3.47Å
916	S	80.5	Confident	77.6	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.028	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	133.9	-172.1	-155.7	0	0	0	0	112.2	Y918 T919 D1004 S1007	S916-Y918 PolarHBondContact O-N 2.99Å; S916-Y918 VanDerWaalsContact O-N 3.15Å; S916-T919 WeakPolarHBondContact O-CB 3.11Å; S916-T919 PolarHBondContact O-N 2.87Å; S916-T919 PolarHBondContact O-OG1 3.13Å; S916-D1004 WeakPolarHBondContact CA-O 3.44Å; S916-S1007 VanDerWaalsContact CB-O 3.25Å; S916-S1007 WeakPolarHBondContact CB-O 3.24Å; S916-S1007 PolarHBondContact OG-O 2.9Å; S916-S1007 VanDerWaalsContact OG-O 3.08Å
917	V	76.6	Confident	78.2	Confident	20 Å²	20	56.2 Å²	56.2	12%	0.121	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.8	168	-66.9	0	0	0	0	112.8	T919 L1003 D1004	V917-T919 PolarHBondContact O-N 2.93Å; V917-L1003 HydrophobicContact CG1-CB 3.93Å; V917-D1004 PolarHBondContact N-O 3.46Å
918	Y	77.5	Confident	79.1	Confident	144 Å²	144	53.4 Å²	53.4	57%	0.565	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	11.8	177.1	-52.8	-61.6	0	0	0	113.4	S916 Q1009	S916-Y918 PolarHBondContact O-N 2.99Å; S916-Y918 VanDerWaalsContact O-N 3.15Å; Y918-Q1009 PolarHBondContact O-NE2 3.4Å
919	T	76.8	Confident	80.5	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.043	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-78.3	125.2	176.3	-49.9	0	0	0	0	109.5	S916 V917 I923 L925	S916-T919 WeakPolarHBondContact O-CB 3.11Å; S916-T919 PolarHBondContact O-N 2.87Å; S916-T919 PolarHBondContact O-OG1 3.13Å; V917-T919 PolarHBondContact O-N 2.93Å; T919-I923 HydrophobicContact CG2-CB 3.92Å; T919-I923 HydrophobicContact CG2-CG2 3.99Å; T919-L925 HydrophobicContact CG2-CD2 3.89Å
920	N	78.7	Confident	81.8	Confident	106 Å²	106	45 Å²	45	57%	0.567	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-64.1	141.5	-179.4	-65.1	-32.1	0	0	0	110.9	G922 I923	N920-G922 PolarHBondContact O-N 2.89Å; N920-I923 HydrophobicContact CB-CD1 3.81Å; N920-I923 HydrophobicContact CB-CG1 4.19Å; N920-I923 WeakPolarHBondContact O-CB 3.1Å; N920-I923 PolarHBondContact O-N 3.34Å; N920-I923 VanDerWaalsContact O-N 3.11Å
921	P	79.7	Confident	83.2	Confident	43 Å²	43	44.5 Å²	44.5	28%	0.279	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	138	170	-29.8	37	0	0	0	113	I923 P972	P921-I923 VanDerWaalsContact C-N 3.34Å; P921-P972 HydrophobicContact CG-CG 4.05Å
922	G	76.1	Confident	84.2	Confident	46 Å²	46	42.9 Å²	42.9	47%	0.474	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	-0.7	-174.2	0	0	0	0	0	116.4	N920 L966	N920-G922 PolarHBondContact O-N 2.89Å; G922-L966 PolarHBondContact N-O 3.33Å
923	I	82	Confident	84.7	Confident	65 Å²	65	44 Å²	44	33%	0.333	24%	0.24	S	C	.	.	S	Bend	trans	-91.8	137	168.8	-60.4	-175.4	0	0	0	109.9	T919 N920 P921 L925	T919-I923 HydrophobicContact CG2-CB 3.92Å; T919-I923 HydrophobicContact CG2-CG2 3.99Å; N920-I923 HydrophobicContact CB-CD1 3.81Å; N920-I923 HydrophobicContact CB-CG1 4.19Å; N920-I923 WeakPolarHBondContact O-CB 3.1Å; N920-I923 PolarHBondContact O-N 3.34Å; N920-I923 VanDerWaalsContact O-N 3.11Å; P921-I923 VanDerWaalsContact C-N 3.34Å; I923-L925 PolarHBondContact O-N 3.29Å
924	P	83.1	Confident	85.3	Confident	31 Å²	31	44 Å²	44	20%	0.201	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	121.8	171	-27.9	36.3	0	0	0	113.1	E963 S965 L1010	P924-E963 HydrophobicContact CB-CB 4.15Å; P924-E963 HydrophobicContact CB-CG 4.44Å; P924-E963 HydrophobicContact CG-CB 4.16Å; P924-E963 WeakPolarHBondContact CG-OE2 3.3Å; P924-S965 WeakPolarHBondContact CA-OG 3.45Å; P924-L1010 WeakPolarHBondContact O-CD2 3.34Å
925	L	84.3	Confident	85.8	Confident	7 Å²	7	41.9 Å²	41.9	4%	0.037	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	-40.6	168.9	-61.5	169.2	0	0	0	110.9	A915 T919 I923 F955 L964 L966 L1003	A915-L925 HydrophobicContact CB-CB 4.08Å; A915-L925 HydrophobicContact CB-CD2 3.92Å; T919-L925 HydrophobicContact CG2-CD2 3.89Å; I923-L925 PolarHBondContact O-N 3.29Å; L925-F955 HydrophobicContact CD1-CD1 3.93Å; L925-F955 HydrophobicContact CD1-CE1 3.64Å; L925-L964 WeakPolarHBondContact CB-O 3.45Å; L925-L964 PolarHBondContact N-O 3.38Å; L925-L966 HydrophobicContact CD1-CD2 4.21Å; L925-L966 HydrophobicContact CD1-CG 4.05Å; L925-L966 HydrophobicContact CD2-CD1 4.26Å; L925-L966 HydrophobicContact CD2-CG 4.23Å; L925-L966 HydrophobicContact CG-CG 4.38Å; L925-L1003 HydrophobicContact CD1-CD2 4.36Å; L925-L1003 HydrophobicContact CD2-CD2 4.18Å
926	V	85.4	Confident	86.4	Confident	7 Å²	7	44.1 Å²	44.1	4%	0.042	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	149.3	-175.6	64.6	0	0	0	0	110.1	Y905 V913 L928 L964	Y905-V926 HydrophobicContact CE1-CG2 3.64Å; V913-V926 HydrophobicContact CG1-CB 3.75Å; V913-V926 HydrophobicContact CG1-CG1 3.92Å; V913-V926 HydrophobicContact CG1-CG2 3.88Å; V913-V926 HydrophobicContact CG2-CG1 4.37Å; V913-V926 HydrophobicContact CG2-CG2 4.13Å; V926-L928 HydrophobicContact CG1-CD2 4.44Å; V926-L964 HydrophobicContact CG1-CB 3.8Å; V926-L964 HydrophobicContact CG1-CD2 3.82Å; V926-L964 HydrophobicContact CG1-CG 4.34Å; V926-L964 PolarHBondContact N-O 2.86Å; V926-L964 PolarHBondContact O-N 3.14Å
927	K	89.6	Confident	87	Confident	73 Å²	73	47.7 Å²	47.7	32%	0.317	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	119	167.8	-171	177.8	-166.7	69.8	0	108.8	Y905 T961 E963 F1013	Y905-K927 WeakPolarHBondContact CD1-O 2.98Å; K927-T961 WeakPolarHBondContact CE-O 3.4Å; K927-T961 PolarHBondContact NZ-O 3.26Å; K927-E963 HydrophobicContact CB-CG 4.03Å; K927-E963 HydrophobicContact CD-CG 4.38Å; K927-E963 HydrophobicContact CG-CG 3.85Å; K927-E963 IonicContact NZ-OE1 3.76Å; K927-E963 PolarHBondContact NZ-OE1 3.25Å; K927-F1013 HydrophobicContact CB-CZ 4.46Å
928	L	90.2	Very high	87.9	Confident	2 Å²	2	48 Å²	48	1%	0.01	28%	0.281	C	S	.	.			trans	-73.9	141.4	169.2	-58.1	-175.5	0	0	0	109.1	F903 V926 F943 V957 G962 F983 I999	F903-L928 HydrophobicContact CE1-CB 4.38Å; F903-L928 HydrophobicContact CE1-CD1 4.35Å; V926-L928 HydrophobicContact CG1-CD2 4.44Å; L928-F943 HydrophobicContact CB-CD1 4.3Å; L928-F943 HydrophobicContact CB-CE1 4.27Å; L928-V957 HydrophobicContact CD1-CG2 4.49Å; L928-G962 WeakPolarHBondContact CB-O 3.35Å; L928-G962 PolarHBondContact N-O 2.73Å; L928-F983 HydrophobicContact CD1-CB 4.33Å; L928-F983 HydrophobicContact CD1-CD1 3.54Å; L928-F983 HydrophobicContact CD1-CD2 3.92Å; L928-F983 HydrophobicContact CD1-CE1 3.69Å; L928-F983 HydrophobicContact CD1-CE2 4.02Å; L928-F983 HydrophobicContact CD1-CG 3.65Å; L928-F983 HydrophobicContact CD1-CZ 3.92Å; L928-I999 HydrophobicContact CD1-CD1 4.32Å; L928-I999 HydrophobicContact CD2-CD1 3.55Å
929	T	91.8	Very high	88.7	Confident	61 Å²	61	43 Å²	43	37%	0.374	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.5	179.4	-37.1	0	0	0	0	109.6	V904 Y905	V904-T929 PolarHBondContact N-O 2.69Å; Y905-T929 PolarHBondContact N-O 2.82Å; Y905-T929 PolarHBondContact O-N 3.24Å
930	A	92.3	Very high	89.6	Confident	10 Å²	10	47.8 Å²	47.8	8%	0.083	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	165	170	0	0	0	0	0	109.5	K902 F903 L941 F943 V985	K902-A930 CarbonylContact O-C 3.51Å; K902-A930 WeakPolarHBondContact O-CA 3.08Å; K902-A930 VanDerWaalsContact O-CB 3.32Å; K902-A930 WeakPolarHBondContact O-CB 3.45Å; F903-A930 HydrophobicContact CD1-CB 4.16Å; F903-A930 HydrophobicContact CG-CB 4.43Å; A930-L941 HydrophobicContact CB-CD1 3.91Å; A930-L941 VanDerWaalsContact O-CD1 3.24Å; A930-L941 WeakPolarHBondContact O-CD1 3.42Å; A930-F943 HydrophobicContact CB-CE1 3.87Å; A930-F943 HydrophobicContact CB-CZ 4.04Å; A930-V985 HydrophobicContact CB-CB 4.46Å; A930-V985 HydrophobicContact CB-CG1 3.99Å; A930-V985 HydrophobicContact CB-CG2 4.1Å
931	T	94.2	Very high	90.4	Very high	73 Å²	73	44.3 Å²	44.3	45%	0.448	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	140.7	175.3	51.2	0	0	0	0	109.2	K902 V904	K902-T931 PolarHBondContact N-O 2.9Å; K902-T931 PolarHBondContact O-N 2.92Å; V904-T931 HydrophobicContact CG2-CG2 3.78Å; V904-T931 VanDerWaalsContact CG2-OG1 3.27Å; V904-T931 WeakPolarHBondContact CG2-OG1 3.38Å
932	D	95.9	Very high	91.1	Very high	27 Å²	27	43.7 Å²	43.7	14%	0.144	27%	0.265	C	S	.	.			trans	-107	165.7	160.4	-145	-75.1	0	0	0	110.9	N899 A900 P901 D934 L941	N899-D932 WeakPolarHBondContact CB-OD1 3.46Å; A900-D932 VanDerWaalsContact C-OD2 3.3Å; P901-D932 WeakPolarHBondContact CA-OD2 3.48Å; P901-D932 WeakPolarHBondContact CD-OD2 3.26Å; P901-D932 VanDerWaalsContact CG-OD2 3.23Å; P901-D932 WeakPolarHBondContact CG-OD2 3.32Å; D932-D934 PolarHBondContact OD1-N 3.23Å; D932-D934 VanDerWaalsContact OD1-N 3.14Å; D932-L941 HydrophobicContact CB-CD2 4.21Å
933	S	95.1	Very high	92	Very high	54 Å²	54	42 Å²	42	38%	0.378	25%	0.245	S	C	.	.			trans	-91.9	-30.4	174	-46.9	0	0	0	0	112.4	R863 E864 N899	R863-S933 PolarHBondContact NH2-O 3.14Å; E864-S933 VanDerWaalsContact CG-CB 3.41Å; N899-S933 PolarHBondContact OD1-OG 3.13Å
934	D	96.6	Very high	92.4	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.032	24%	0.242	C	C	.	.	S	Bend	trans	-77.9	176.4	-159.9	-62.5	2.2	0	0	0	113.2	N897 D898 N899 D932 N938 S939	N897-D934 WeakPolarHBondContact CA-OD2 3.38Å; D898-D934 PolarHBondContact N-OD2 3.08Å; N899-D934 VanDerWaalsContact CB-OD1 3.24Å; N899-D934 WeakPolarHBondContact CB-OD1 3.14Å; N899-D934 PolarHBondContact N-OD2 2.91Å; N899-D934 PolarHBondContact ND2-OD1 3.41Å; D932-D934 PolarHBondContact OD1-N 3.23Å; D932-D934 VanDerWaalsContact OD1-N 3.14Å; D934-N938 HydrophobicContact CB-CB 3.64Å; D934-S939 WeakPolarHBondContact O-CB 3.16Å; D934-S939 PolarHBondContact O-OG 2.72Å
935	E	94.2	Very high	92.8	Very high	89 Å²	89	41.1 Å²	41.1	42%	0.416	24%	0.237	S	C	.	.	S	Bend	trans	-94.9	121.9	-171.4	-155.2	-179.9	157.4	0	0	113.1	K892 D895 V937 N938	K892-E935 IonicContact NZ-OE1 3.88Å; K892-E935 PolarHBondContact NZ-OE1 3.04Å; K892-E935 IonicContact NZ-OE2 2.72Å; K892-E935 PolarHBondContact NZ-OE2 3.09Å; D895-E935 HydrophobicContact CB-CB 3.73Å; D895-E935 VanDerWaalsContact CG-CB 3.43Å; D895-E935 VanDerWaalsContact OD1-CB 3.27Å; D895-E935 WeakPolarHBondContact OD1-CB 3.5Å; D895-E935 PolarHBondContact OD1-N 3.33Å; D895-E935 PolarHBondContact OD2-N 3.13Å; D895-E935 VanDerWaalsContact OD2-N 3.11Å; E935-V937 PolarHBondContact O-N 3.43Å; E935-N938 PolarHBondContact O-N 2.85Å
936	G	93.2	Very high	92.8	Very high	52 Å²	52	43 Å²	43	54%	0.536	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	-100.9	163.8	0	0	0	0	0	114.4	S939 Q940	G936-S939 PolarHBondContact N-OG 2.68Å; G936-Q940 PolarHBondContact O-N 2.78Å
937	V	94.6	Very high	91.9	Very high	78 Å²	78	48.7 Å²	48.7	47%	0.473	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-32	-177.5	178.3	0	0	0	0	111	E935 S939 Q940 G988	E935-V937 PolarHBondContact O-N 3.43Å; V937-S939 PolarHBondContact O-N 2.72Å; V937-Q940 WeakPolarHBondContact O-CB 3.43Å; V937-Q940 PolarHBondContact O-N 3.1Å; V937-G988 VanDerWaalsContact CG1-O 3.27Å; V937-G988 WeakPolarHBondContact CG1-O 3.29Å; V937-G988 WeakPolarHBondContact O-CA 3.41Å; V937-G988 PolarHBondContact O-N 3.48Å; V937-G988 VanDerWaalsContact O-N 3.09Å
938	N	94.7	Very high	90.4	Very high	26 Å²	26	51 Å²	51	14%	0.139	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-23.2	175.6	-69.3	-6.7	0	0	0	111.9	D895 N897 D934 E935 D987 G989	D895-N938 WeakPolarHBondContact OD2-CB 3.12Å; D895-N938 PolarHBondContact OD2-ND2 3.38Å; N897-N938 HydrophobicContact CB-CB 4.22Å; N897-N938 PolarHBondContact N-ND2 2.75Å; N897-N938 WeakPolarHBondContact OD1-CA 3.41Å; N897-N938 WeakPolarHBondContact OD1-CB 3.15Å; N897-N938 VanDerWaalsContact OD1-CG 3.28Å; N897-N938 PolarHBondContact OD1-O 2.72Å; N897-N938 PolarHBondContact OD1-OD1 3.48Å; D934-N938 HydrophobicContact CB-CB 3.64Å; E935-N938 PolarHBondContact O-N 2.85Å; N938-D987 WeakPolarHBondContact O-CB 3.39Å; N938-G989 VanDerWaalsContact OD1-CA 3.28Å; N938-G989 WeakPolarHBondContact OD1-CA 3.36Å
939	S	94.5	Very high	88.5	Confident	39 Å²	39	55.6 Å²	55.6	27%	0.273	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	10.8	167.2	48.9	0	0	0	0	115.1	D934 G936 V937 L941	D934-S939 WeakPolarHBondContact O-CB 3.16Å; D934-S939 PolarHBondContact O-OG 2.72Å; G936-S939 PolarHBondContact N-OG 2.68Å; V937-S939 PolarHBondContact O-N 2.72Å; S939-L941 PolarHBondContact O-N 2.78Å; S939-L941 VanDerWaalsContact O-N 3.1Å
940	Q	95.1	Very high	87	Confident	109 Å²	109	61 Å²	61	51%	0.509	34%	0.34	S	S	.	.			trans	-81.9	91.6	179.4	-172.4	176	-11.1	0	0	111.6	G936 V937 D987 G988	G936-Q940 PolarHBondContact O-N 2.78Å; V937-Q940 WeakPolarHBondContact O-CB 3.43Å; V937-Q940 PolarHBondContact O-N 3.1Å; Q940-D987 CarbonylContact O-C 3.45Å; Q940-D987 VanDerWaalsContact O-C 3.26Å; Q940-D987 WeakPolarHBondContact O-CA 3.25Å; Q940-G988 PolarHBondContact O-N 2.95Å
941	L	95.4	Very high	85.9	Confident	32 Å²	32	62.8 Å²	62.8	17%	0.168	35%	0.346	C	S	.	.			trans	-69.8	141.2	-174.3	-55.6	-177.8	0	0	0	114.4	P901 A930 D932 S939 F943 V985 R986	P901-L941 HydrophobicContact CB-CD2 3.76Å; P901-L941 HydrophobicContact CG-CD2 3.79Å; A930-L941 HydrophobicContact CB-CD1 3.91Å; A930-L941 VanDerWaalsContact O-CD1 3.24Å; A930-L941 WeakPolarHBondContact O-CD1 3.42Å; D932-L941 HydrophobicContact CB-CD2 4.21Å; S939-L941 PolarHBondContact O-N 2.78Å; S939-L941 VanDerWaalsContact O-N 3.1Å; L941-F943 HydrophobicContact CB-CE2 4.26Å; L941-F943 HydrophobicContact CB-CZ 4.49Å; L941-F943 HydrophobicContact CD1-CZ 4.35Å; L941-V985 HydrophobicContact CB-CG2 4.05Å; L941-V985 HydrophobicContact CD1-CG2 4.46Å; L941-V985 HydrophobicContact CD2-CG2 4Å; L941-V985 HydrophobicContact CG-CG2 4.4Å; L941-R986 CarbonylContact C-O 3.49Å; L941-R986 WeakPolarHBondContact CA-O 3.33Å
942	T	95.6	Very high	84.7	Confident	30 Å²	30	63.4 Å²	63.4	18%	0.184	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.6	165.8	64.1	0	0	0	0	112	H944 P959 V985 R986	T942-H944 PolarHBondContact O-CD2 3.26Å; T942-H944 PolarHBondContact OG1-NE2 2.84Å; T942-P959 CarbonylContact C-O 3.46Å; T942-P959 WeakPolarHBondContact CA-O 3.18Å; T942-V985 CarbonylContact O-C 3.47Å; T942-V985 VanDerWaalsContact O-CA 3.3Å; T942-V985 WeakPolarHBondContact O-CA 3.37Å; T942-R986 PolarHBondContact N-O 3.07Å; T942-R986 PolarHBondContact O-N 3.32Å; T942-R986 PolarHBondContact OG1-O 3.11Å
943	F	93.7	Very high	83.6	Confident	12 Å²	12	67.7 Å²	67.7	5%	0.053	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.8	-174	-63.1	-89.6	0	0	0	112.5	F903 L928 A930 L941 V957 P959 V985	F903-F943 AromaticContact CE1-CD1 3.99Å; F903-F943 HydrophobicContact CE1-CD1 3.99Å; F903-F943 AromaticContact CE1-CE1 3.86Å; F903-F943 HydrophobicContact CE1-CE1 3.86Å; F903-F943 HydrophobicContact CZ-CD1 4.36Å; L928-F943 HydrophobicContact CB-CD1 4.3Å; L928-F943 HydrophobicContact CB-CE1 4.27Å; A930-F943 HydrophobicContact CB-CE1 3.87Å; A930-F943 HydrophobicContact CB-CZ 4.04Å; L941-F943 HydrophobicContact CB-CE2 4.26Å; L941-F943 HydrophobicContact CB-CZ 4.49Å; L941-F943 HydrophobicContact CD1-CZ 4.35Å; F943-V957 HydrophobicContact CB-CG2 4.17Å; F943-P959 PolarHBondContact N-O 2.84Å; F943-P959 WeakPolarHBondContact O-CA 3.36Å; F943-V985 HydrophobicContact CD1-CB 3.88Å; F943-V985 HydrophobicContact CD1-CG2 3.94Å; F943-V985 HydrophobicContact CE1-CB 3.97Å; F943-V985 HydrophobicContact CE1-CG2 3.75Å; F943-V985 HydrophobicContact CG-CG2 4.46Å; F943-V985 HydrophobicContact CZ-CG2 4.12Å
944	H	91.6	Very high	83	Confident	58 Å²	58	66.9 Å²	66.9	27%	0.269	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	140.9	-174.8	-54.8	-86.4	0	0	0	111.2	T942 F983 E984	T942-H944 PolarHBondContact O-CD2 3.26Å; T942-H944 PolarHBondContact OG1-NE2 2.84Å; H944-F983 WeakPolarHBondContact O-CA 3.37Å; H944-E984 HydrophobicContact CB-CB 4.41Å; H944-E984 PolarHBondContact N-O 2.67Å; H944-E984 PolarHBondContact O-N 2.8Å
945	L	90	Very high	82.5	Confident	19 Å²	19	66.7 Å²	66.7	10%	0.099	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.5	172.3	177.1	60.4	0	0	0	109.5	K952 F955 V957 L981 F983	L945-K952 HydrophobicContact CD2-CG 3.98Å; L945-K952 HydrophobicContact CG-CG 4.32Å; L945-K952 WeakPolarHBondContact O-CE 3.47Å; L945-K952 PolarHBondContact O-NZ 3.32Å; L945-F955 HydrophobicContact CD2-CB 4.2Å; L945-V957 HydrophobicContact CB-CG1 4.1Å; L945-L981 HydrophobicContact CD1-CB 3.91Å; L945-L981 HydrophobicContact CD1-CD2 3.9Å; L945-L981 HydrophobicContact CD1-CG 4.37Å; L945-L981 HydrophobicContact CD2-CD2 4.23Å; L945-F983 HydrophobicContact CB-CD1 4.35Å; L945-F983 HydrophobicContact CB-CE1 4.13Å; L945-F983 HydrophobicContact CD1-CD1 4.24Å; L945-F983 HydrophobicContact CD1-CE1 3.92Å; L945-F983 HydrophobicContact CD1-CZ 4.1Å
946	L	85.3	Confident	82.2	Confident	47 Å²	47	65.3 Å²	65.3	25%	0.246	35%	0.353	C	S	.	.			trans	-79.6	148.4	-173.9	-70.6	177.4	0	0	0	113.3	E948 K982 E984 Y996	L946-E948 PolarHBondContact O-N 3.19Å; L946-K982 HydrophobicContact CB-CG 4.4Å; L946-K982 WeakPolarHBondContact CB-O 3.11Å; L946-K982 HydrophobicContact CD1-CD 4.19Å; L946-K982 HydrophobicContact CD1-CG 4.08Å; L946-K982 PolarHBondContact N-O 3.04Å; L946-E984 HydrophobicContact CD1-CB 4.05Å; L946-E984 HydrophobicContact CD2-CB 4.24Å; L946-E984 HydrophobicContact CG-CB 4.04Å; L946-Y996 HydrophobicContact CD1-CD1 3.96Å; L946-Y996 HydrophobicContact CD1-CE1 3.96Å
947	D	67.5	Low	82.1	Confident	126 Å²	126	63.5 Å²	63.5	67%	0.674	33%	0.332	S	S	*	.			trans	-78.7	70.1	-173.5	-78.8	-58.8	0	0	0	114.1	K952	D947-K952 VanDerWaalsContact OD1-CD 3.23Å; D947-K952 WeakPolarHBondContact OD1-CD 3.31Å; D947-K952 WeakPolarHBondContact OD1-CE 3.22Å; D947-K952 IonicContact OD1-NZ 2.7Å; D947-K952 PolarHBondContact OD1-NZ 2.71Å; D947-K952 IonicContact OD2-NZ 2.66Å; D947-K952 PolarHBondContact OD2-NZ 2.89Å
948	E	58.1	Low	82	Confident	122 Å²	122	63 Å²	63	57%	0.57	33%	0.327	S	S	*	.	S	Bend	trans	-114.4	55.4	172.4	-77.5	172.6	-137.3	0	0	112.6	L946 K982	L946-E948 PolarHBondContact O-N 3.19Å; E948-K982 WeakPolarHBondContact OE1-CD 3.25Å; E948-K982 IonicContact OE1-NZ 3.85Å; E948-K982 PolarHBondContact OE1-NZ 2.66Å; E948-K982 IonicContact OE2-NZ 2.64Å; E948-K982 PolarHBondContact OE2-NZ 3.2Å
949	S	50	Low	81.9	Confident	97 Å²	97	64.5 Å²	64.5	68%	0.678	34%	0.337	S	S	*	.	S	Bend	trans	77.1	128.2	163.6	78.9	0	0	0	0	119.3	E951	S949-E951 PolarHBondContact O-N 3.12Å
950	K	59.6	Low	81.7	Confident	175 Å²	175	69.4 Å²	69.4	76%	0.761	36%	0.356	S	S	*	.	S	Bend	trans	54.4	-29.2	169.6	-70.3	-169.2	174.4	-172.4	0	119.6	K952 D953	K950-K952 PolarHBondContact O-N 2.65Å; K950-D953 WeakPolarHBondContact O-CB 3.03Å; K950-D953 PolarHBondContact O-N 3.01Å
951	E	69.8	Low	81.5	Confident	47 Å²	47	66.5 Å²	66.5	22%	0.22	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-73.2	-17.6	-172.3	-60.3	-174.9	153.8	0	0	112.5	S949 D953 I954 F955 Y979 Q980 L981	S949-E951 PolarHBondContact O-N 3.12Å; E951-D953 PolarHBondContact O-N 2.8Å; E951-I954 PolarHBondContact O-N 3.18Å; E951-F955 HydrophobicContact CB-CD2 4.35Å; E951-F955 PolarHBondContact O-N 3.4Å; E951-Y979 HydrophobicContact CG-CD1 4.13Å; E951-Y979 VanDerWaalsContact OE1-CA 3.3Å; E951-Y979 WeakPolarHBondContact OE1-CA 3.09Å; E951-Y979 WeakPolarHBondContact OE1-CB 3.43Å; E951-Y979 WeakPolarHBondContact OE1-CD1 3.29Å; E951-Q980 PolarHBondContact OE1-N 3.1Å; E951-Q980 PolarHBondContact OE2-N 2.98Å; E951-L981 HydrophobicContact CB-CD2 3.64Å; E951-L981 HydrophobicContact CG-CD2 4.46Å; E951-L981 VanDerWaalsContact OE2-CD2 3.31Å; E951-L981 WeakPolarHBondContact OE2-CD2 3.41Å
952	K	67.5	Low	81.3	Confident	87 Å²	87	65 Å²	65	38%	0.378	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-65.5	-18.5	167	-90.3	-163.9	-171.7	170.9	0	114.9	L945 D947 K950 I954 L967	L945-K952 HydrophobicContact CD2-CG 3.98Å; L945-K952 HydrophobicContact CG-CG 4.32Å; L945-K952 WeakPolarHBondContact O-CE 3.47Å; L945-K952 PolarHBondContact O-NZ 3.32Å; D947-K952 VanDerWaalsContact OD1-CD 3.23Å; D947-K952 WeakPolarHBondContact OD1-CD 3.31Å; D947-K952 WeakPolarHBondContact OD1-CE 3.22Å; D947-K952 IonicContact OD1-NZ 2.7Å; D947-K952 PolarHBondContact OD1-NZ 2.71Å; D947-K952 IonicContact OD2-NZ 2.66Å; D947-K952 PolarHBondContact OD2-NZ 2.89Å; K950-K952 PolarHBondContact O-N 2.65Å; K952-I954 PolarHBondContact O-N 2.82Å; K952-L967 WeakPolarHBondContact O-CD1 3.16Å
953	D	74.6	Confident	81.1	Confident	117 Å²	117	65.9 Å²	65.9	63%	0.626	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-77.2	-8.8	171.6	-59.7	-43.6	0	0	0	111.6	K950 E951 V970	K950-D953 WeakPolarHBondContact O-CB 3.03Å; K950-D953 PolarHBondContact O-N 3.01Å; E951-D953 PolarHBondContact O-N 2.8Å; D953-V970 WeakPolarHBondContact O-CG2 3.32Å
954	I	80.8	Confident	80.9	Confident	36 Å²	36	65.3 Å²	65.3	19%	0.185	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-43.4	-173.9	-55.6	176.5	0	0	0	111.4	E951 K952 L966 L967 V970 I975 Y979	E951-I954 PolarHBondContact O-N 3.18Å; K952-I954 PolarHBondContact O-N 2.82Å; I954-L966 HydrophobicContact CG2-CD2 4.03Å; I954-L966 WeakPolarHBondContact O-CA 3.41Å; I954-L967 PolarHBondContact O-N 2.79Å; I954-V970 HydrophobicContact CG2-CG1 4.36Å; I954-I975 HydrophobicContact CG2-CG2 4.21Å; I954-Y979 HydrophobicContact CD1-CD1 4.42Å; I954-Y979 HydrophobicContact CD1-CE1 3.65Å
955	F	87.4	Confident	80.7	Confident	3 Å²	3	63.3 Å²	63.3	1%	0.013	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	145.6	-172	-62	-83.2	0	0	0	113.1	L925 L945 E951 L964 S965 L966 Y979 L981 I1001 L1003	L925-F955 HydrophobicContact CD1-CD1 3.93Å; L925-F955 HydrophobicContact CD1-CE1 3.64Å; L945-F955 HydrophobicContact CD2-CB 4.2Å; E951-F955 HydrophobicContact CB-CD2 4.35Å; E951-F955 PolarHBondContact O-N 3.4Å; F955-L964 HydrophobicContact CB-CD1 3.97Å; F955-L964 HydrophobicContact CD1-CD1 4.2Å; F955-L964 HydrophobicContact CD1-CG 4.42Å; F955-L964 HydrophobicContact CG-CD1 4.45Å; F955-S965 WeakPolarHBondContact CA-O 3.22Å; F955-L966 HydrophobicContact CD1-CD2 4.15Å; F955-L966 HydrophobicContact CE1-CD2 3.85Å; F955-L966 HydrophobicContact CZ-CD2 4.42Å; F955-Y979 AromaticContact CE2-CD1 3.75Å; F955-Y979 HydrophobicContact CE2-CD1 3.75Å; F955-Y979 AromaticContact CE2-CD2 3.83Å; F955-Y979 HydrophobicContact CE2-CD2 3.83Å; F955-Y979 HydrophobicContact CE2-CE1 4.24Å; F955-Y979 HydrophobicContact CE2-CE2 4.33Å; F955-Y979 AromaticContact CE2-CG 3.5Å; F955-Y979 HydrophobicContact CE2-CG 3.5Å; F955-Y979 HydrophobicContact CZ-CD1 4.39Å; F955-Y979 AromaticContact CZ-CD2 3.62Å; F955-Y979 HydrophobicContact CZ-CD2 3.62Å; F955-Y979 HydrophobicContact CZ-CE2 4.08Å; F955-Y979 AromaticContact CZ-CG 3.79Å; F955-Y979 HydrophobicContact CZ-CG 3.79Å; F955-L981 HydrophobicContact CB-CD1 4.16Å; F955-L981 HydrophobicContact CB-CD2 4.37Å; F955-L981 HydrophobicContact CD1-CD1 4.11Å; F955-L981 HydrophobicContact CD2-CD1 4.03Å; F955-L981 HydrophobicContact CD2-CD2 3.74Å; F955-L981 HydrophobicContact CD2-CG 4.38Å; F955-L981 HydrophobicContact CE2-CD1 4.47Å; F955-L981 HydrophobicContact CE2-CD2 4.33Å; F955-L981 HydrophobicContact CG-CD1 3.84Å; F955-L981 HydrophobicContact CG-CD2 4.21Å; F955-I1001 HydrophobicContact CE1-CG2 4.17Å; F955-I1001 HydrophobicContact CZ-CB 4.48Å; F955-I1001 HydrophobicContact CZ-CG2 4.33Å; F955-L1003 HydrophobicContact CE1-CD1 4.11Å; F955-L1003 HydrophobicContact CZ-CD1 3.86Å
956	T	88.4	Confident	80.5	Confident	60 Å²	60	62.4 Å²	62.4	37%	0.368	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.8	170.3	-169.8	0	0	0	0	109.9	L964 S965 L967	T956-L964 WeakPolarHBondContact O-CA 3.42Å; T956-L964 WeakPolarHBondContact O-CD1 3.42Å; T956-S965 PolarHBondContact N-O 2.87Å; T956-S965 PolarHBondContact O-N 2.86Å; T956-L967 HydrophobicContact CG2-CD2 3.91Å; T956-L967 HydrophobicContact CG2-CG 4.33Å
957	V	90.3	Very high	80.4	Confident	14 Å²	14	62.3 Å²	62.3	9%	0.085	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.9	176.3	62.7	0	0	0	0	109	L928 F943 L945 P959 E963 L964 F983	L928-V957 HydrophobicContact CD1-CG2 4.49Å; F943-V957 HydrophobicContact CB-CG2 4.17Å; L945-V957 HydrophobicContact CB-CG1 4.1Å; V957-P959 WeakPolarHBondContact O-CD 3.44Å; V957-E963 WeakPolarHBondContact CA-O 3.36Å; V957-L964 HydrophobicContact CB-CD1 4.43Å; V957-F983 HydrophobicContact CB-CE1 4.1Å; V957-F983 HydrophobicContact CG1-CD1 4.47Å; V957-F983 HydrophobicContact CG1-CE1 4.15Å; V957-F983 HydrophobicContact CG2-CE1 4.35Å
958	D	91.6	Very high	80.8	Confident	68 Å²	68	61.3 Å²	61.3	36%	0.364	33%	0.325	S	S	.	.			trans	-68.9	120.8	171.3	-179.2	-65	0	0	0	109.5	H960 T961 G962 E963	D958-H960 PolarHBondContact O-N 2.87Å; D958-H960 PolarHBondContact OD1-N 3.29Å; D958-T961 VanDerWaalsContact CB-OG1 3.25Å; D958-T961 WeakPolarHBondContact CB-OG1 3.43Å; D958-T961 PolarHBondContact OD1-N 3.4Å; D958-T961 PolarHBondContact OD1-OG1 2.86Å; D958-G962 WeakPolarHBondContact O-CA 3.05Å; D958-G962 PolarHBondContact O-N 3.49Å; D958-E963 HydrophobicContact CB-CB 4.48Å; D958-E963 PolarHBondContact N-O 3Å
959	P	92.2	Very high	81.5	Confident	56 Å²	56	61.3 Å²	61.3	36%	0.364	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-18.9	-173.7	-24.2	35.5	0	0	0	115.2	T942 F943 V957	T942-P959 CarbonylContact C-O 3.46Å; T942-P959 WeakPolarHBondContact CA-O 3.18Å; F943-P959 PolarHBondContact N-O 2.84Å; F943-P959 WeakPolarHBondContact O-CA 3.36Å; V957-P959 WeakPolarHBondContact O-CD 3.44Å
960	H	91.6	Very high	82.7	Confident	142 Å²	142	57.8 Å²	57.8	66%	0.657	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-27.9	-175.7	-61.5	-52.8	0	0	0	113.2	D958	D958-H960 PolarHBondContact O-N 2.87Å; D958-H960 PolarHBondContact OD1-N 3.29Å
961	T	91.4	Very high	83.3	Confident	49 Å²	49	53 Å²	53	30%	0.301	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-15.7	179.7	73.2	0	0	0	0	113.3	K927 D958 E963	K927-T961 WeakPolarHBondContact CE-O 3.4Å; K927-T961 PolarHBondContact NZ-O 3.26Å; D958-T961 VanDerWaalsContact CB-OG1 3.25Å; D958-T961 WeakPolarHBondContact CB-OG1 3.43Å; D958-T961 PolarHBondContact OD1-N 3.4Å; D958-T961 PolarHBondContact OD1-OG1 2.86Å; T961-E963 PolarHBondContact O-N 2.94Å; T961-E963 WeakPolarHBondContact OG1-CB 3.35Å; T961-E963 WeakPolarHBondContact OG1-CG 3.12Å; T961-E963 PolarHBondContact OG1-N 3.34Å
962	G	90.2	Very high	83.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.296	C	S	.	.			trans	71.5	12.3	-174.8	0	0	0	0	0	113.8	L928 D958 L964	L928-G962 WeakPolarHBondContact CB-O 3.35Å; L928-G962 PolarHBondContact N-O 2.73Å; D958-G962 WeakPolarHBondContact O-CA 3.05Å; D958-G962 PolarHBondContact O-N 3.49Å; G962-L964 PolarHBondContact O-N 3.24Å
963	E	91.3	Very high	83	Confident	49 Å²	49	57 Å²	57	23%	0.229	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	111.8	-175	-72	172.2	-155	0	0	111.4	P924 K927 V957 D958 T961	P924-E963 HydrophobicContact CB-CB 4.15Å; P924-E963 HydrophobicContact CB-CG 4.44Å; P924-E963 HydrophobicContact CG-CB 4.16Å; P924-E963 WeakPolarHBondContact CG-OE2 3.3Å; K927-E963 HydrophobicContact CB-CG 4.03Å; K927-E963 HydrophobicContact CD-CG 4.38Å; K927-E963 HydrophobicContact CG-CG 3.85Å; K927-E963 IonicContact NZ-OE1 3.76Å; K927-E963 PolarHBondContact NZ-OE1 3.25Å; V957-E963 WeakPolarHBondContact CA-O 3.36Å; D958-E963 HydrophobicContact CB-CB 4.48Å; D958-E963 PolarHBondContact N-O 3Å; T961-E963 PolarHBondContact O-N 2.94Å; T961-E963 WeakPolarHBondContact OG1-CB 3.35Å; T961-E963 WeakPolarHBondContact OG1-CG 3.12Å; T961-E963 PolarHBondContact OG1-N 3.34Å
964	L	89.2	Confident	82.8	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	122.4	177.4	177.9	65.3	0	0	0	109.6	L925 V926 F955 T956 V957 G962 L981 F983 I1001	L925-L964 WeakPolarHBondContact CB-O 3.45Å; L925-L964 PolarHBondContact N-O 3.38Å; V926-L964 HydrophobicContact CG1-CB 3.8Å; V926-L964 HydrophobicContact CG1-CD2 3.82Å; V926-L964 HydrophobicContact CG1-CG 4.34Å; V926-L964 PolarHBondContact N-O 2.86Å; V926-L964 PolarHBondContact O-N 3.14Å; F955-L964 HydrophobicContact CB-CD1 3.97Å; F955-L964 HydrophobicContact CD1-CD1 4.2Å; F955-L964 HydrophobicContact CD1-CG 4.42Å; F955-L964 HydrophobicContact CG-CD1 4.45Å; T956-L964 WeakPolarHBondContact O-CA 3.42Å; T956-L964 WeakPolarHBondContact O-CD1 3.42Å; V957-L964 HydrophobicContact CB-CD1 4.43Å; G962-L964 PolarHBondContact O-N 3.24Å; L964-L981 HydrophobicContact CD1-CD1 4.01Å; L964-L981 HydrophobicContact CD2-CD1 3.75Å; L964-F983 HydrophobicContact CD1-CE1 4.14Å; L964-F983 HydrophobicContact CD1-CZ 3.73Å; L964-F983 HydrophobicContact CD2-CE2 4.45Å; L964-F983 HydrophobicContact CD2-CZ 3.88Å; L964-F983 HydrophobicContact CG-CZ 4.33Å; L964-I1001 HydrophobicContact CD2-CD1 3.52Å; L964-I1001 HydrophobicContact CD2-CG1 3.91Å
965	S	88.4	Confident	82.5	Confident	15 Å²	15	56.1 Å²	56.1	11%	0.105	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	161	-178.5	-57.5	0	0	0	0	111.4	P924 F955 T956	P924-S965 WeakPolarHBondContact CA-OG 3.45Å; F955-S965 WeakPolarHBondContact CA-O 3.22Å; T956-S965 PolarHBondContact N-O 2.87Å; T956-S965 PolarHBondContact O-N 2.86Å
966	L	85.1	Confident	82	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	139.9	165.8	-66.1	167.4	0	0	0	110.2	G922 L925 I954 F955 I975 L1003	G922-L966 PolarHBondContact N-O 3.33Å; L925-L966 HydrophobicContact CD1-CD2 4.21Å; L925-L966 HydrophobicContact CD1-CG 4.05Å; L925-L966 HydrophobicContact CD2-CD1 4.26Å; L925-L966 HydrophobicContact CD2-CG 4.23Å; L925-L966 HydrophobicContact CG-CG 4.38Å; I954-L966 HydrophobicContact CG2-CD2 4.03Å; I954-L966 WeakPolarHBondContact O-CA 3.41Å; F955-L966 HydrophobicContact CD1-CD2 4.15Å; F955-L966 HydrophobicContact CE1-CD2 3.85Å; F955-L966 HydrophobicContact CZ-CD2 4.42Å; L966-I975 HydrophobicContact CD1-CD1 3.46Å; L966-I975 VanDerWaalsContact CD1-CD1 3.46Å; L966-I975 HydrophobicContact CD2-CD1 4.21Å; L966-I975 HydrophobicContact CG-CD1 4.48Å; L966-L1003 HydrophobicContact CD2-CD1 4.09Å
967	L	83.1	Confident	81.7	Confident	45 Å²	45	57.2 Å²	57.2	24%	0.236	33%	0.332	C	S	.	.			trans	-65.6	141	175.9	-88.6	178.4	0	0	0	111.8	K952 I954 T956 T969 V970	K952-L967 WeakPolarHBondContact O-CD1 3.16Å; I954-L967 PolarHBondContact O-N 2.79Å; T956-L967 HydrophobicContact CG2-CD2 3.91Å; T956-L967 HydrophobicContact CG2-CG 4.33Å; L967-T969 PolarHBondContact O-N 3Å; L967-V970 HydrophobicContact CB-CG2 3.73Å; L967-V970 WeakPolarHBondContact O-CB 3.3Å; L967-V970 WeakPolarHBondContact O-CG2 3.42Å; L967-V970 PolarHBondContact O-N 3.25Å; L967-V970 VanDerWaalsContact O-N 3.11Å
968	P	76.6	Confident	81.4	Confident	104 Å²	104	66.2 Å²	66.2	68%	0.675	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-17.2	-180	-27.8	36.3	0	0	0	116.1	V970	P968-V970 VanDerWaalsContact C-N 3.35Å
969	T	73.1	Confident	81.2	Confident	123 Å²	123	64.5 Å²	64.5	76%	0.755	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.4	-179.6	47	0	0	0	0	114.2	L967	L967-T969 PolarHBondContact O-N 3Å
970	V	73.9	Confident	80.8	Confident	22 Å²	22	67.6 Å²	67.6	13%	0.133	36%	0.363	C	S	.	.			trans	-93	133.2	-169.3	-178.4	0	0	0	0	111.5	D953 I954 L967 P968 P972 I975	D953-V970 WeakPolarHBondContact O-CG2 3.32Å; I954-V970 HydrophobicContact CG2-CG1 4.36Å; L967-V970 HydrophobicContact CB-CG2 3.73Å; L967-V970 WeakPolarHBondContact O-CB 3.3Å; L967-V970 WeakPolarHBondContact O-CG2 3.42Å; L967-V970 PolarHBondContact O-N 3.25Å; L967-V970 VanDerWaalsContact O-N 3.11Å; P968-V970 VanDerWaalsContact C-N 3.35Å; V970-P972 VanDerWaalsContact O-CD 3.29Å; V970-P972 WeakPolarHBondContact O-CD 3.44Å; V970-I975 HydrophobicContact CG1-CG2 3.27Å
971	D	72.4	Confident	80.6	Confident	74 Å²	74	60.9 Å²	60.9	40%	0.396	33%	0.332	S	S	.	.			trans	-73.5	113.8	173.4	174.2	16.9	0	0	0	111.4	F973 N974	D971-F973 PolarHBondContact O-N 2.77Å; D971-F973 VanDerWaalsContact O-N 3.07Å; D971-F973 WeakPolarHBondContact OD1-CD2 3.44Å; D971-F973 PolarHBondContact OD1-N 2.73Å; D971-N974 PolarHBondContact O-N 3.45Å; D971-N974 PolarHBondContact OD2-ND2 2.79Å
972	P	65.4	Low	80.4	Confident	52 Å²	52	61.3 Å²	61.3	34%	0.338	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-16.1	-179.1	-21.9	35	0	0	0	114.3	P921 V970 I975	P921-P972 HydrophobicContact CG-CG 4.05Å; V970-P972 VanDerWaalsContact O-CD 3.29Å; V970-P972 WeakPolarHBondContact O-CD 3.44Å; P972-I975 WeakPolarHBondContact O-CG1 3.39Å
973	F	66.2	Low	80.4	Confident	167 Å²	167	61.3 Å²	61.3	73%	0.732	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-9	-179.3	-64.9	-79.8	0	0	0	113.9	D971	D971-F973 PolarHBondContact O-N 2.77Å; D971-F973 VanDerWaalsContact O-N 3.07Å; D971-F973 WeakPolarHBondContact OD1-CD2 3.44Å; D971-F973 PolarHBondContact OD1-N 2.73Å
974	N	69.7	Low	80.5	Confident	131 Å²	131	59.3 Å²	59.3	70%	0.701	32%	0.321	S	S	*	.	S	Bend	trans	-122.2	13.4	-175.9	-78.8	-70.9	0	0	0	114.8	D971	D971-N974 PolarHBondContact O-N 3.45Å; D971-N974 PolarHBondContact OD2-ND2 2.79Å
975	I	75.6	Confident	80.7	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.021	32%	0.321	C	S	.	.			trans	-99.1	7	-179.1	56.3	173	0	0	0	115.4	I954 L966 V970 P972 G977 Y979 L1003	I954-I975 HydrophobicContact CG2-CG2 4.21Å; L966-I975 HydrophobicContact CD1-CD1 3.46Å; L966-I975 VanDerWaalsContact CD1-CD1 3.46Å; L966-I975 HydrophobicContact CD2-CD1 4.21Å; L966-I975 HydrophobicContact CG-CD1 4.48Å; V970-I975 HydrophobicContact CG1-CG2 3.27Å; P972-I975 WeakPolarHBondContact O-CG1 3.39Å; I975-G977 PolarHBondContact O-N 3.31Å; I975-Y979 WeakPolarHBondContact CA-OH 3.37Å; I975-Y979 PolarHBondContact O-OH 2.58Å; I975-L1003 HydrophobicContact CB-CD1 4.12Å; I975-L1003 HydrophobicContact CD1-CD1 4.35Å; I975-L1003 HydrophobicContact CG1-CD1 4.48Å; I975-L1003 VanDerWaalsContact O-CB 3.32Å; I975-L1003 WeakPolarHBondContact O-CB 3.09Å; I975-L1003 WeakPolarHBondContact O-CD1 3.14Å
976	G	75.5	Confident	81	Confident	58 Å²	58	63.4 Å²	63.4	60%	0.598	33%	0.334	S	S	*	.			trans	-70	116.3	176.4	0	0	0	0	0	111.2
977	G	83.2	Confident	81.6	Confident	28 Å²	28	63.6 Å²	63.6	29%	0.289	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	175.9	-173.3	-171.8	0	0	0	0	0	116.2	I975 L1003	I975-G977 PolarHBondContact O-N 3.31Å; G977-L1003 PolarHBondContact N-O 2.82Å; G977-L1003 PolarHBondContact O-N 2.91Å
978	R	84.8	Confident	82	Confident	203 Å²	203	63.2 Å²	63.2	77%	0.766	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.5	169.4	-59.6	-171.6	178.2	179.1	-2	108	I1001 I1002	R978-I1001 WeakPolarHBondContact CA-O 3.43Å; R978-I1002 HydrophobicContact CG-CD1 4.39Å; R978-I1002 HydrophobicContact CG-CG1 4.09Å; R978-I1002 HydrophobicContact CG-CG2 4.44Å
979	Y	85.4	Confident	82.8	Confident	31 Å²	31	58.6 Å²	58.6	12%	0.122	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	143.4	-177.9	-56.9	-86.6	0	0	0	108.5	E951 I954 F955 I975 N1000 I1001 L1003	E951-Y979 HydrophobicContact CG-CD1 4.13Å; E951-Y979 VanDerWaalsContact OE1-CA 3.3Å; E951-Y979 WeakPolarHBondContact OE1-CA 3.09Å; E951-Y979 WeakPolarHBondContact OE1-CB 3.43Å; E951-Y979 WeakPolarHBondContact OE1-CD1 3.29Å; I954-Y979 HydrophobicContact CD1-CD1 4.42Å; I954-Y979 HydrophobicContact CD1-CE1 3.65Å; F955-Y979 AromaticContact CE2-CD1 3.75Å; F955-Y979 HydrophobicContact CE2-CD1 3.75Å; F955-Y979 AromaticContact CE2-CD2 3.83Å; F955-Y979 HydrophobicContact CE2-CD2 3.83Å; F955-Y979 HydrophobicContact CE2-CE1 4.24Å; F955-Y979 HydrophobicContact CE2-CE2 4.33Å; F955-Y979 AromaticContact CE2-CG 3.5Å; F955-Y979 HydrophobicContact CE2-CG 3.5Å; F955-Y979 HydrophobicContact CZ-CD1 4.39Å; F955-Y979 AromaticContact CZ-CD2 3.62Å; F955-Y979 HydrophobicContact CZ-CD2 3.62Å; F955-Y979 HydrophobicContact CZ-CE2 4.08Å; F955-Y979 AromaticContact CZ-CG 3.79Å; F955-Y979 HydrophobicContact CZ-CG 3.79Å; I975-Y979 WeakPolarHBondContact CA-OH 3.37Å; I975-Y979 PolarHBondContact O-OH 2.58Å; Y979-N1000 CarbonylContact O-C 3.56Å; Y979-N1000 VanDerWaalsContact O-CA 3.28Å; Y979-N1000 WeakPolarHBondContact O-CA 3.2Å; Y979-I1001 PolarHBondContact N-O 3.49Å; Y979-I1001 PolarHBondContact O-N 3.02Å; Y979-L1003 HydrophobicContact CD2-CD1 4.35Å; Y979-L1003 HydrophobicContact CD2-CG 4.43Å; Y979-L1003 HydrophobicContact CE2-CB 4.42Å; Y979-L1003 HydrophobicContact CE2-CD1 3.9Å; Y979-L1003 HydrophobicContact CE2-CG 4.24Å
980	Q	85.3	Confident	83.6	Confident	121 Å²	121	59 Å²	59	57%	0.565	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	69	-175.5	-167.3	179.7	-35.3	0	0	110.3	E951	E951-Q980 PolarHBondContact OE1-N 3.1Å; E951-Q980 PolarHBondContact OE2-N 2.98Å
981	L	86.9	Confident	84.4	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	132.7	-176.3	-60.6	178.5	0	0	0	111.1	L945 E951 F955 L964 F983 I999 I1001	L945-L981 HydrophobicContact CD1-CB 3.91Å; L945-L981 HydrophobicContact CD1-CD2 3.9Å; L945-L981 HydrophobicContact CD1-CG 4.37Å; L945-L981 HydrophobicContact CD2-CD2 4.23Å; E951-L981 HydrophobicContact CB-CD2 3.64Å; E951-L981 HydrophobicContact CG-CD2 4.46Å; E951-L981 VanDerWaalsContact OE2-CD2 3.31Å; E951-L981 WeakPolarHBondContact OE2-CD2 3.41Å; F955-L981 HydrophobicContact CB-CD1 4.16Å; F955-L981 HydrophobicContact CB-CD2 4.37Å; F955-L981 HydrophobicContact CD1-CD1 4.11Å; F955-L981 HydrophobicContact CD2-CD1 4.03Å; F955-L981 HydrophobicContact CD2-CD2 3.74Å; F955-L981 HydrophobicContact CD2-CG 4.38Å; F955-L981 HydrophobicContact CE2-CD1 4.47Å; F955-L981 HydrophobicContact CE2-CD2 4.33Å; F955-L981 HydrophobicContact CG-CD1 3.84Å; F955-L981 HydrophobicContact CG-CD2 4.21Å; L964-L981 HydrophobicContact CD1-CD1 4.01Å; L964-L981 HydrophobicContact CD2-CD1 3.75Å; L981-F983 HydrophobicContact CB-CD2 4.09Å; L981-F983 HydrophobicContact CB-CE2 3.38Å; L981-F983 HydrophobicContact CB-CZ 3.83Å; L981-F983 HydrophobicContact CD1-CE2 3.9Å; L981-F983 HydrophobicContact CD1-CZ 3.66Å; L981-F983 HydrophobicContact CG-CE2 4.3Å; L981-F983 HydrophobicContact CG-CZ 4.39Å; L981-I999 PolarHBondContact N-O 2.87Å; L981-I999 PolarHBondContact O-N 2.94Å; L981-I1001 HydrophobicContact CD1-CD1 4.29Å; L981-I1001 HydrophobicContact CD1-CG1 3.48Å; L981-I1001 VanDerWaalsContact CD1-CG1 3.48Å; L981-I1001 HydrophobicContact CG-CG1 4.07Å
982	K	88.2	Confident	85.5	Confident	58 Å²	58	62 Å²	62	25%	0.252	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	109.7	177	-176.6	-179.8	178.9	179.6	0	109.4	L946 E948 N998	L946-K982 HydrophobicContact CB-CG 4.4Å; L946-K982 WeakPolarHBondContact CB-O 3.11Å; L946-K982 HydrophobicContact CD1-CD 4.19Å; L946-K982 HydrophobicContact CD1-CG 4.08Å; L946-K982 PolarHBondContact N-O 3.04Å; E948-K982 WeakPolarHBondContact OE1-CD 3.25Å; E948-K982 IonicContact OE1-NZ 3.85Å; E948-K982 PolarHBondContact OE1-NZ 2.66Å; E948-K982 IonicContact OE2-NZ 2.64Å; E948-K982 PolarHBondContact OE2-NZ 3.2Å; K982-N998 WeakPolarHBondContact CG-OD1 3.28Å
983	F	89.8	Confident	86.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	143.9	-179.6	-67	-83.5	0	0	0	111.7	F903 L928 H944 L945 V957 L964 L981 Y996 A997 I999	F903-F983 HydrophobicContact CE2-CB 4.46Å; F903-F983 HydrophobicContact CZ-CB 3.8Å; L928-F983 HydrophobicContact CD1-CB 4.33Å; L928-F983 HydrophobicContact CD1-CD1 3.54Å; L928-F983 HydrophobicContact CD1-CD2 3.92Å; L928-F983 HydrophobicContact CD1-CE1 3.69Å; L928-F983 HydrophobicContact CD1-CE2 4.02Å; L928-F983 HydrophobicContact CD1-CG 3.65Å; L928-F983 HydrophobicContact CD1-CZ 3.92Å; H944-F983 WeakPolarHBondContact O-CA 3.37Å; L945-F983 HydrophobicContact CB-CD1 4.35Å; L945-F983 HydrophobicContact CB-CE1 4.13Å; L945-F983 HydrophobicContact CD1-CD1 4.24Å; L945-F983 HydrophobicContact CD1-CE1 3.92Å; L945-F983 HydrophobicContact CD1-CZ 4.1Å; V957-F983 HydrophobicContact CB-CE1 4.1Å; V957-F983 HydrophobicContact CG1-CD1 4.47Å; V957-F983 HydrophobicContact CG1-CE1 4.15Å; V957-F983 HydrophobicContact CG2-CE1 4.35Å; L964-F983 HydrophobicContact CD1-CE1 4.14Å; L964-F983 HydrophobicContact CD1-CZ 3.73Å; L964-F983 HydrophobicContact CD2-CE2 4.45Å; L964-F983 HydrophobicContact CD2-CZ 3.88Å; L964-F983 HydrophobicContact CG-CZ 4.33Å; L981-F983 HydrophobicContact CB-CD2 4.09Å; L981-F983 HydrophobicContact CB-CE2 3.38Å; L981-F983 HydrophobicContact CB-CZ 3.83Å; L981-F983 HydrophobicContact CD1-CE2 3.9Å; L981-F983 HydrophobicContact CD1-CZ 3.66Å; L981-F983 HydrophobicContact CG-CE2 4.3Å; L981-F983 HydrophobicContact CG-CZ 4.39Å; F983-Y996 WeakPolarHBondContact O-CA 3.48Å; F983-A997 PolarHBondContact N-O 3.18Å; F983-A997 PolarHBondContact O-N 3.34Å; F983-I999 HydrophobicContact CD2-CB 4.1Å; F983-I999 HydrophobicContact CD2-CD1 3.66Å; F983-I999 HydrophobicContact CD2-CG1 4.03Å; F983-I999 HydrophobicContact CE2-CB 4.11Å; F983-I999 HydrophobicContact CE2-CD1 4.1Å; F983-I999 HydrophobicContact CE2-CG1 4.48Å; F983-I999 HydrophobicContact CG-CD1 4.49Å
984	E	92.6	Very high	88.3	Confident	7 Å²	7	55.3 Å²	55.3	3%	0.033	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	141.1	163.3	-174.1	-179.3	-173	0	0	108.1	H944 L946 R986 S994 G995 Y996	H944-E984 HydrophobicContact CB-CB 4.41Å; H944-E984 PolarHBondContact N-O 2.67Å; H944-E984 PolarHBondContact O-N 2.8Å; L946-E984 HydrophobicContact CD1-CB 4.05Å; L946-E984 HydrophobicContact CD2-CB 4.24Å; L946-E984 HydrophobicContact CG-CB 4.04Å; E984-R986 HydrophobicContact CG-CG 4.06Å; E984-R986 WeakPolarHBondContact OE1-CG 3.23Å; E984-R986 IonicContact OE1-CZ 3.28Å; E984-R986 IonicContact OE1-NE 2.81Å; E984-R986 PolarHBondContact OE1-NE 2.78Å; E984-R986 IonicContact OE1-NH2 3.39Å; E984-R986 PolarHBondContact OE1-NH2 2.8Å; E984-R986 IonicContact OE2-CZ 3.52Å; E984-R986 IonicContact OE2-NE 2.77Å; E984-R986 PolarHBondContact OE2-NE 3.07Å; E984-R986 IonicContact OE2-NH2 3.41Å; E984-R986 PolarHBondContact OE2-NH2 3.36Å; E984-S994 VanDerWaalsContact OE1-CB 3.25Å; E984-S994 WeakPolarHBondContact OE1-CB 3.32Å; E984-S994 PolarHBondContact OE1-OG 2.97Å; E984-G995 CarbonylContact C-O 3.26Å; E984-G995 WeakPolarHBondContact CA-O 3.27Å; E984-Y996 HydrophobicContact CB-CD1 4.12Å; E984-Y996 HydrophobicContact CB-CE1 4.08Å; E984-Y996 HydrophobicContact CG-CD1 4.09Å; E984-Y996 HydrophobicContact CG-CE1 3.7Å; E984-Y996 PolarHBondContact OE1-OH 2.56Å
985	V	94	Very high	89.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.3	163.3	53.9	0	0	0	0	107.5	P901 F903 A930 L941 T942 F943 S994 G995	P901-V985 HydrophobicContact CB-CG1 3.86Å; P901-V985 HydrophobicContact CB-CG2 4.18Å; F903-V985 HydrophobicContact CD2-CG1 3.87Å; F903-V985 HydrophobicContact CE1-CB 4.39Å; F903-V985 HydrophobicContact CE1-CG1 4.2Å; F903-V985 HydrophobicContact CE2-CB 4.14Å; F903-V985 HydrophobicContact CE2-CG1 3.42Å; F903-V985 VanDerWaalsContact CE2-CG1 3.42Å; F903-V985 HydrophobicContact CG-CG1 4.45Å; F903-V985 HydrophobicContact CZ-CB 3.83Å; F903-V985 HydrophobicContact CZ-CG1 3.6Å; A930-V985 HydrophobicContact CB-CB 4.46Å; A930-V985 HydrophobicContact CB-CG1 3.99Å; A930-V985 HydrophobicContact CB-CG2 4.1Å; L941-V985 HydrophobicContact CB-CG2 4.05Å; L941-V985 HydrophobicContact CD1-CG2 4.46Å; L941-V985 HydrophobicContact CD2-CG2 4Å; L941-V985 HydrophobicContact CG-CG2 4.4Å; T942-V985 CarbonylContact O-C 3.47Å; T942-V985 VanDerWaalsContact O-CA 3.3Å; T942-V985 WeakPolarHBondContact O-CA 3.37Å; F943-V985 HydrophobicContact CD1-CB 3.88Å; F943-V985 HydrophobicContact CD1-CG2 3.94Å; F943-V985 HydrophobicContact CE1-CB 3.97Å; F943-V985 HydrophobicContact CE1-CG2 3.75Å; F943-V985 HydrophobicContact CG-CG2 4.46Å; F943-V985 HydrophobicContact CZ-CG2 4.12Å; V985-S994 CarbonylContact O-C 3.59Å; V985-S994 WeakPolarHBondContact O-CA 3.25Å; V985-G995 PolarHBondContact N-O 2.96Å; V985-G995 PolarHBondContact O-N 3.34Å
986	R	95.2	Very high	90.2	Very high	101 Å²	101	56 Å²	56	38%	0.381	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	148.1	176.6	-59.9	-174.2	-175.4	151.7	11.8	109.8	L941 T942 E984 L993	L941-R986 CarbonylContact C-O 3.49Å; L941-R986 WeakPolarHBondContact CA-O 3.33Å; T942-R986 PolarHBondContact N-O 3.07Å; T942-R986 PolarHBondContact O-N 3.32Å; T942-R986 PolarHBondContact OG1-O 3.11Å; E984-R986 HydrophobicContact CG-CG 4.06Å; E984-R986 WeakPolarHBondContact OE1-CG 3.23Å; E984-R986 IonicContact OE1-CZ 3.28Å; E984-R986 IonicContact OE1-NE 2.81Å; E984-R986 PolarHBondContact OE1-NE 2.78Å; E984-R986 IonicContact OE1-NH2 3.39Å; E984-R986 PolarHBondContact OE1-NH2 2.8Å; E984-R986 IonicContact OE2-CZ 3.52Å; E984-R986 IonicContact OE2-NE 2.77Å; E984-R986 PolarHBondContact OE2-NE 3.07Å; E984-R986 IonicContact OE2-NH2 3.41Å; E984-R986 PolarHBondContact OE2-NH2 3.36Å; R986-L993 WeakPolarHBondContact CA-O 3.38Å
987	D	95.9	Very high	90.8	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.027	28%	0.282	C	S	.	.			trans	-72	-169.5	160	56.1	49.7	0	0	0	111.7	N897 P901 N938 Q940 G989 S992 L993	N897-D987 VanDerWaalsContact ND2-CG 3.3Å; N897-D987 PolarHBondContact ND2-OD2 2.67Å; N897-D987 PolarHBondContact OD1-OD2 3.27Å; P901-D987 HydrophobicContact CG-CB 4.18Å; N938-D987 WeakPolarHBondContact O-CB 3.39Å; Q940-D987 CarbonylContact O-C 3.45Å; Q940-D987 VanDerWaalsContact O-C 3.26Å; Q940-D987 WeakPolarHBondContact O-CA 3.25Å; D987-G989 PolarHBondContact OD1-N 2.85Å; D987-S992 PolarHBondContact O-OG 2.86Å; D987-S992 WeakPolarHBondContact OD1-CA 3.13Å; D987-S992 WeakPolarHBondContact OD1-CB 3.4Å; D987-S992 PolarHBondContact OD1-OG 2.83Å; D987-L993 PolarHBondContact N-O 2.98Å; D987-L993 PolarHBondContact OD1-N 2.77Å; D987-L993 VanDerWaalsContact OD2-CA 3.32Å; D987-L993 WeakPolarHBondContact OD2-CA 3.49Å; D987-L993 VanDerWaalsContact OD2-CB 3.29Å; D987-L993 WeakPolarHBondContact OD2-CB 3.2Å; D987-L993 PolarHBondContact OD2-N 2.78Å
988	G	93.3	Very high	91	Very high	37 Å²	37	56.1 Å²	56.1	38%	0.381	29%	0.289	S	S	.	.	S	Bend	trans	-105	9.6	166.5	0	0	0	0	0	114.2	V937 Q940	V937-G988 VanDerWaalsContact CG1-O 3.27Å; V937-G988 WeakPolarHBondContact CG1-O 3.29Å; V937-G988 WeakPolarHBondContact O-CA 3.41Å; V937-G988 PolarHBondContact O-N 3.48Å; V937-G988 VanDerWaalsContact O-N 3.09Å; Q940-G988 PolarHBondContact O-N 2.95Å
989	G	91.7	Very high	91.1	Very high	6 Å²	6	46.4 Å²	46.4	6%	0.062	25%	0.253	C	S	.	.			trans	-73.3	174.6	-167.2	0	0	0	0	0	115.1	N938 D987 P991 S992	N938-G989 VanDerWaalsContact OD1-CA 3.28Å; N938-G989 WeakPolarHBondContact OD1-CA 3.36Å; D987-G989 PolarHBondContact OD1-N 2.85Å; G989-P991 CarbonylContact O-C 3.53Å; G989-S992 WeakPolarHBondContact O-CA 3.28Å; G989-S992 WeakPolarHBondContact O-CB 3.3Å; G989-S992 PolarHBondContact O-N 2.9Å; G989-S992 VanDerWaalsContact O-N 3.11Å
990	T	89.7	Confident	91.1	Very high	133 Å²	133	47.5 Å²	47.5	82%	0.816	26%	0.26	S	S	*	.	S	Bend	trans	-135.4	103.8	177.1	58.7	0	0	0	0	111.3
991	P	92.1	Very high	91.1	Very high	101 Å²	101	41.7 Å²	41.7	66%	0.656	23%	0.233	S	C	*	.	S	Bend	cis	-67.4	147	-2.1	31.6	-36.2	0	0	0	112	N897 G989	N897-P991 PolarHBondContact ND2-O 2.88Å; G989-P991 CarbonylContact O-C 3.53Å
992	S	94.7	Very high	91.1	Very high	57 Å²	57	42.3 Å²	42.3	40%	0.399	24%	0.236	S	C	.	.			trans	-78	138.5	174.3	-179.9	0	0	0	0	110.7	D987 G989	D987-S992 PolarHBondContact O-OG 2.86Å; D987-S992 WeakPolarHBondContact OD1-CA 3.13Å; D987-S992 WeakPolarHBondContact OD1-CB 3.4Å; D987-S992 PolarHBondContact OD1-OG 2.83Å; G989-S992 WeakPolarHBondContact O-CA 3.28Å; G989-S992 WeakPolarHBondContact O-CB 3.3Å; G989-S992 PolarHBondContact O-N 2.9Å; G989-S992 VanDerWaalsContact O-N 3.11Å
993	L	96.2	Very high	90.9	Very high	48 Å²	48	39.7 Å²	39.7	25%	0.251	23%	0.225	S	C	.	.			trans	-108.2	154.4	177.8	-58.3	174.8	0	0	0	110.4	N897 A900 R986 D987	N897-L993 WeakPolarHBondContact ND2-CG 3.08Å; A900-L993 HydrophobicContact CB-CB 4Å; A900-L993 HydrophobicContact CB-CD1 4.48Å; R986-L993 WeakPolarHBondContact CA-O 3.38Å; D987-L993 PolarHBondContact N-O 2.98Å; D987-L993 PolarHBondContact OD1-N 2.77Å; D987-L993 VanDerWaalsContact OD2-CA 3.32Å; D987-L993 WeakPolarHBondContact OD2-CA 3.49Å; D987-L993 VanDerWaalsContact OD2-CB 3.29Å; D987-L993 WeakPolarHBondContact OD2-CB 3.2Å; D987-L993 PolarHBondContact OD2-N 2.78Å
994	S	95.5	Very high	90.5	Very high	31 Å²	31	42 Å²	42	22%	0.217	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	124.8	-172.2	-57.5	0	0	0	0	112.5	E984 V985 Y996	E984-S994 VanDerWaalsContact OE1-CB 3.25Å; E984-S994 WeakPolarHBondContact OE1-CB 3.32Å; E984-S994 PolarHBondContact OE1-OG 2.97Å; V985-S994 CarbonylContact O-C 3.59Å; V985-S994 WeakPolarHBondContact O-CA 3.25Å; S994-Y996 VanDerWaalsContact CB-CE2 3.47Å; S994-Y996 WeakPolarHBondContact CB-OH 3.33Å; S994-Y996 WeakPolarHBondContact O-CE2 3.21Å
995	G	92.7	Very high	89.7	Confident	8 Å²	8	44.6 Å²	44.6	8%	0.082	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	144.1	160.9	0	0	0	0	0	111.6	P901 E984 V985	P901-G995 WeakPolarHBondContact O-CA 3.46Å; E984-G995 CarbonylContact C-O 3.26Å; E984-G995 WeakPolarHBondContact CA-O 3.27Å; V985-G995 PolarHBondContact N-O 2.96Å; V985-G995 PolarHBondContact O-N 3.34Å
996	Y	90.8	Very high	88.7	Confident	140 Å²	140	51.4 Å²	51.4	55%	0.549	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	138.7	179	-60.3	-90.1	0	0	0	111.6	L946 F983 E984 S994	L946-Y996 HydrophobicContact CD1-CD1 3.96Å; L946-Y996 HydrophobicContact CD1-CE1 3.96Å; F983-Y996 WeakPolarHBondContact O-CA 3.48Å; E984-Y996 HydrophobicContact CB-CD1 4.12Å; E984-Y996 HydrophobicContact CB-CE1 4.08Å; E984-Y996 HydrophobicContact CG-CD1 4.09Å; E984-Y996 HydrophobicContact CG-CE1 3.7Å; E984-Y996 PolarHBondContact OE1-OH 2.56Å; S994-Y996 VanDerWaalsContact CB-CE2 3.47Å; S994-Y996 WeakPolarHBondContact CB-OH 3.33Å; S994-Y996 WeakPolarHBondContact O-CE2 3.21Å
997	A	87.8	Confident	87.5	Confident	8 Å²	8	47 Å²	47	7%	0.066	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	130.8	172.3	0	0	0	0	0	111.9	F903 F983 I999	F903-A997 HydrophobicContact CB-CB 4.33Å; F903-A997 HydrophobicContact CD1-CB 4.43Å; F903-A997 HydrophobicContact CD2-CB 3.36Å; F903-A997 HydrophobicContact CE2-CB 3.61Å; F903-A997 HydrophobicContact CG-CB 3.81Å; F903-A997 HydrophobicContact CZ-CB 4.27Å; F983-A997 PolarHBondContact N-O 3.18Å; F983-A997 PolarHBondContact O-N 3.34Å; A997-I999 HydrophobicContact CB-CD1 4.26Å; A997-I999 HydrophobicContact CB-CG1 4.08Å
998	N	87.3	Confident	85.9	Confident	81 Å²	81	52 Å²	52	43%	0.433	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.8	161.1	-63.3	-25.5	0	0	0	107.7	H911 K982	H911-N998 WeakPolarHBondContact CB-O 3.45Å; H911-N998 PolarHBondContact ND1-O 3.48Å; K982-N998 WeakPolarHBondContact CG-OD1 3.28Å
999	I	87.1	Confident	84.2	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	117.5	-176.8	-59.6	180	0	0	0	108.8	P906 V913 L928 L981 F983 A997 I1001	P906-I999 HydrophobicContact CG-CB 4.47Å; P906-I999 HydrophobicContact CG-CD1 3.64Å; P906-I999 HydrophobicContact CG-CG1 3.88Å; P906-I999 HydrophobicContact CG-CG2 3.81Å; V913-I999 HydrophobicContact CG2-CG2 3.89Å; L928-I999 HydrophobicContact CD1-CD1 4.32Å; L928-I999 HydrophobicContact CD2-CD1 3.55Å; L981-I999 PolarHBondContact N-O 2.87Å; L981-I999 PolarHBondContact O-N 2.94Å; F983-I999 HydrophobicContact CD2-CB 4.1Å; F983-I999 HydrophobicContact CD2-CD1 3.66Å; F983-I999 HydrophobicContact CD2-CG1 4.03Å; F983-I999 HydrophobicContact CE2-CB 4.11Å; F983-I999 HydrophobicContact CE2-CD1 4.1Å; F983-I999 HydrophobicContact CE2-CG1 4.48Å; F983-I999 HydrophobicContact CG-CD1 4.49Å; A997-I999 HydrophobicContact CB-CD1 4.26Å; A997-I999 HydrophobicContact CB-CG1 4.08Å; I999-I1001 HydrophobicContact CG2-CD1 3.77Å; I999-I1001 PolarHBondContact O-N 2.91Å
1000	N	86.2	Confident	82.3	Confident	53 Å²	53	59.2 Å²	59.2	28%	0.283	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	117	173.7	-54.2	-71.2	0	0	0	109.1	H911 T912 V913 Y979	H911-N1000 WeakPolarHBondContact O-CB 2.92Å; H911-N1000 PolarHBondContact O-N 2.96Å; H911-N1000 PolarHBondContact O-ND2 2.92Å; T912-N1000 CarbonylContact C-O 3.5Å; T912-N1000 WeakPolarHBondContact CA-O 3.18Å; T912-N1000 HydrophobicContact CG2-CB 4.22Å; V913-N1000 PolarHBondContact N-O 3.01Å; Y979-N1000 CarbonylContact O-C 3.56Å; Y979-N1000 VanDerWaalsContact O-CA 3.28Å; Y979-N1000 WeakPolarHBondContact O-CA 3.2Å
1001	I	86.2	Confident	79.8	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	120.6	167.8	-48.4	-57.2	0	0	0	107.9	V913 F955 L964 R978 Y979 L981 I999 L1003	V913-I1001 HydrophobicContact CB-CD1 3.83Å; V913-I1001 HydrophobicContact CG1-CD1 4.4Å; V913-I1001 HydrophobicContact CG2-CD1 4.16Å; F955-I1001 HydrophobicContact CE1-CG2 4.17Å; F955-I1001 HydrophobicContact CZ-CB 4.48Å; F955-I1001 HydrophobicContact CZ-CG2 4.33Å; L964-I1001 HydrophobicContact CD2-CD1 3.52Å; L964-I1001 HydrophobicContact CD2-CG1 3.91Å; R978-I1001 WeakPolarHBondContact CA-O 3.43Å; Y979-I1001 PolarHBondContact N-O 3.49Å; Y979-I1001 PolarHBondContact O-N 3.02Å; L981-I1001 HydrophobicContact CD1-CD1 4.29Å; L981-I1001 HydrophobicContact CD1-CG1 3.48Å; L981-I1001 VanDerWaalsContact CD1-CG1 3.48Å; L981-I1001 HydrophobicContact CG-CG1 4.07Å; I999-I1001 HydrophobicContact CG2-CD1 3.77Å; I999-I1001 PolarHBondContact O-N 2.91Å; I1001-L1003 HydrophobicContact CG2-CD2 3.91Å; I1001-L1003 HydrophobicContact CG2-CG 4.06Å
1002	I	85.3	Confident	77.2	Confident	15 Å²	15	57.9 Å²	57.9	8%	0.077	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	110.4	172.5	-56.4	-169.6	0	0	0	107.5	T912 V913 Y914 A915 R978	T912-I1002 HydrophobicContact CG2-CD1 3.58Å; T912-I1002 HydrophobicContact CG2-CG1 3.84Å; V913-I1002 PolarHBondContact O-N 3.13Å; Y914-I1002 HydrophobicContact CD1-CB 4.01Å; Y914-I1002 HydrophobicContact CD1-CD1 4.5Å; Y914-I1002 HydrophobicContact CD1-CG2 4.1Å; Y914-I1002 HydrophobicContact CE1-CB 4.17Å; Y914-I1002 HydrophobicContact CE1-CD1 3.81Å; Y914-I1002 HydrophobicContact CE1-CG1 4.47Å; Y914-I1002 HydrophobicContact CE1-CG2 4.13Å; A915-I1002 PolarHBondContact N-O 3.27Å; R978-I1002 HydrophobicContact CG-CD1 4.39Å; R978-I1002 HydrophobicContact CG-CG1 4.09Å; R978-I1002 HydrophobicContact CG-CG2 4.44Å
1003	L	84.3	Confident	74.4	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	107	172.9	-64.3	-175.5	0	0	0	108.6	A915 V917 L925 F955 L966 I975 G977 Y979 I1001	A915-L1003 HydrophobicContact CB-CD2 3.83Å; A915-L1003 WeakPolarHBondContact O-CA 3.32Å; V917-L1003 HydrophobicContact CG1-CB 3.93Å; L925-L1003 HydrophobicContact CD1-CD2 4.36Å; L925-L1003 HydrophobicContact CD2-CD2 4.18Å; F955-L1003 HydrophobicContact CE1-CD1 4.11Å; F955-L1003 HydrophobicContact CZ-CD1 3.86Å; L966-L1003 HydrophobicContact CD2-CD1 4.09Å; I975-L1003 HydrophobicContact CB-CD1 4.12Å; I975-L1003 HydrophobicContact CD1-CD1 4.35Å; I975-L1003 HydrophobicContact CG1-CD1 4.48Å; I975-L1003 VanDerWaalsContact O-CB 3.32Å; I975-L1003 WeakPolarHBondContact O-CB 3.09Å; I975-L1003 WeakPolarHBondContact O-CD1 3.14Å; G977-L1003 PolarHBondContact N-O 2.82Å; G977-L1003 PolarHBondContact O-N 2.91Å; Y979-L1003 HydrophobicContact CD2-CD1 4.35Å; Y979-L1003 HydrophobicContact CD2-CG 4.43Å; Y979-L1003 HydrophobicContact CE2-CB 4.42Å; Y979-L1003 HydrophobicContact CE2-CD1 3.9Å; Y979-L1003 HydrophobicContact CE2-CG 4.24Å; I1001-L1003 HydrophobicContact CG2-CD2 3.91Å; I1001-L1003 HydrophobicContact CG2-CG 4.06Å
1004	D	82	Confident	71.1	Confident	48 Å²	48	66.3 Å²	66.3	26%	0.257	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	173.2	174.6	74.3	28.9	0	0	0	113.1	A915 S916 V917 N1006 S1007	A915-D1004 PolarHBondContact O-N 2.99Å; S916-D1004 WeakPolarHBondContact CA-O 3.44Å; V917-D1004 PolarHBondContact N-O 3.46Å; D1004-N1006 VanDerWaalsContact C-N 3.3Å; D1004-N1006 PolarHBondContact OD1-N 3.48Å; D1004-S1007 WeakPolarHBondContact OD1-CB 3.35Å; D1004-S1007 PolarHBondContact OD1-N 2.89Å; D1004-S1007 PolarHBondContact OD1-OG 2.89Å
1005	S	76.5	Confident	67.8	Low	62 Å²	62	73.1 Å²	73.1	43%	0.434	40%	0.401	S	S	.	.	S	Bend	trans	-79.2	-8.3	-179	58	0	0	0	0	114.5
1006	N	71.3	Confident	64.6	Low	142 Å²	142	75.2 Å²	75.2	76%	0.759	42%	0.423	S	S	*	.	S	Bend	trans	-108.4	-20.4	-168.7	-58.8	-15.3	0	0	0	111.7	D1004	D1004-N1006 VanDerWaalsContact C-N 3.3Å; D1004-N1006 PolarHBondContact OD1-N 3.48Å
1007	S	71	Confident	61.6	Low	10 Å²	10	78.6 Å²	78.6	7%	0.07	44%	0.441	C	S	.	.	S	Bend	trans	-65.1	134.9	171.9	-60.6	0	0	0	0	110.3	A915 S916 D1004	A915-S1007 VanDerWaalsContact C-CB 3.45Å; A915-S1007 WeakPolarHBondContact O-CB 3.47Å; S916-S1007 VanDerWaalsContact CB-O 3.25Å; S916-S1007 WeakPolarHBondContact CB-O 3.24Å; S916-S1007 PolarHBondContact OG-O 2.9Å; S916-S1007 VanDerWaalsContact OG-O 3.08Å; D1004-S1007 WeakPolarHBondContact OD1-CB 3.35Å; D1004-S1007 PolarHBondContact OD1-N 2.89Å; D1004-S1007 PolarHBondContact OD1-OG 2.89Å
1008	P	61.6	Low	58.8	Low	109 Å²	109	88.1 Å²	88.1	71%	0.708	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-62.7	140.9	-179.5	26.7	-34.2	0	0	0	110.9
1009	Q	57.7	Low	55.7	Low	123 Å²	123	93.4 Å²	93.4	58%	0.575	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-63.3	135.9	164.6	-81.3	-179.3	-22.2	0	0	109.1	Y918 S1011	Y918-Q1009 PolarHBondContact O-NE2 3.4Å; Q1009-S1011 PolarHBondContact O-N 3.33Å; Q1009-S1011 VanDerWaalsContact O-N 3.1Å
1010	L	52.9	Low	52.9	Low	72 Å²	72	100.9 Å²	100.9	38%	0.377	54%	0.538	S	S	.	.			trans	-74.4	101.4	173	-154.8	76.3	0	0	0	108.7	P924 F1013	P924-L1010 WeakPolarHBondContact O-CD2 3.34Å; L1010-F1013 HydrophobicContact CD2-CD2 4.17Å; L1010-F1013 HydrophobicContact CD2-CE2 3.6Å; L1010-F1013 HydrophobicContact CD2-CZ 4.17Å
1011	S	37.4	Very low	50	Low	107 Å²	107	104.3 Å²	104.3	75%	0.748	56%	0.561	S	S	*	*			trans	-65.6	135.3	170.5	50.3	0	0	0	0	109.3	Q1009 F1013	Q1009-S1011 PolarHBondContact O-N 3.33Å; Q1009-S1011 VanDerWaalsContact O-N 3.1Å; S1011-F1013 PolarHBondContact O-N 2.66Å
1012	S	36	Very low	47.1	Very low	99 Å²	99	112.3 Å²	112.3	69%	0.692	60%	0.603	S	S	*	*			trans	-40.1	126.3	-172.3	55.1	0	0	0	0	113.6	N1014	S1012-N1014 PolarHBondContact O-N 3.5Å
1013	F	35.9	Very low	44.3	Very low	134 Å²	134	118.3 Å²	118.3	59%	0.588	63%	0.634	S	S	*	*			trans	-54.5	92.4	177.6	-85.5	-73.4	0	0	0	112	K927 L1010 S1011	K927-F1013 HydrophobicContact CB-CZ 4.46Å; L1010-F1013 HydrophobicContact CD2-CD2 4.17Å; L1010-F1013 HydrophobicContact CD2-CE2 3.6Å; L1010-F1013 HydrophobicContact CD2-CZ 4.17Å; S1011-F1013 PolarHBondContact O-N 2.66Å
1014	N	28	Very low	41.5	Very low	147 Å²	147	126.2 Å²	126.2	79%	0.786	67%	0.671	S	S	*	*			trans	-86.4	130.5	165	-106.4	-36.3	0	0	0	108.5	S1012 G1016	S1012-N1014 PolarHBondContact O-N 3.5Å; N1014-G1016 PolarHBondContact O-N 2.91Å; N1014-G1016 VanDerWaalsContact O-N 3.1Å
1015	N	26.3	Very low	38.9	Very low	174 Å²	174	128.3 Å²	128.3	93%	0.93	69%	0.689	S	S	*	*			trans	-53.7	113.3	-171.3	-73.4	-51	0	0	0	113
1016	G	25.5	Very low	36.4	Very low	52 Å²	52	130.2 Å²	130.2	54%	0.536	70%	0.703	S	S	.	*			trans	-140.5	113.4	178.6	0	0	0	0	0	112.4	N1014 Y1018	N1014-G1016 PolarHBondContact O-N 2.91Å; N1014-G1016 VanDerWaalsContact O-N 3.1Å; G1016-Y1018 PolarHBondContact O-N 2.84Å
1017	K	26.5	Very low	34.3	Very low	212 Å²	212	130.2 Å²	130.2	92%	0.922	70%	0.703	S	S	*	*			trans	-63.9	110.8	165.5	-83.4	-176	172.1	-176.6	0	109.4
1018	Y	28.9	Very low	32.2	Very low	207 Å²	207	134.6 Å²	134.6	81%	0.812	73%	0.733	S	S	*	*			trans	-135.3	96.2	163.9	-73.8	-73.6	0	0	0	111.4	G1016	G1016-Y1018 PolarHBondContact O-N 2.84Å
1019	Q	23.9	Very low	30.5	Very low	193 Å²	193	140.2 Å²	140.2	90%	0.902	74%	0.74	S	S	*	*			trans	-72.6	131.8	153.5	-69.4	175.1	-45.9	0	0	107.7
1020	L	28	Very low	29.1	Very low	157 Å²	157	141.1 Å²	141.1	82%	0.822	75%	0.749	S	S	*	*			trans	-132.7	121.2	165.6	-91.1	168.8	0	0	0	109.4
1021	T	24.9	Very low	27.8	Very low	124 Å²	124	142.5 Å²	142.5	76%	0.761	77%	0.765	S	S	*	*			trans	-88.4	132.6	-177.4	47.7	0	0	0	0	111
1022	N	25	Very low	27.2	Very low	168 Å²	168	147.2 Å²	147.2	90%	0.898	77%	0.768	S	S	*	*			trans	-90.3	118.2	178.6	-86.4	-21.3	0	0	0	113.1
1023	I	27.7	Very low	26.8	Very low	141 Å²	141	153 Å²	153	72%	0.723	77%	0.774	S	S	*	*			trans	-147	128.5	171.5	-67.5	-179.9	0	0	0	103.4
1024	E	25.5	Very low	26.3	Very low	169 Å²	169	151.1 Å²	151.1	79%	0.79	78%	0.778	S	S	*	*			cis	-158	162.3	11.9	-136.4	163.2	-148	0	0	113.6
1025	S	25.9	Very low	26.2	Very low	92 Å²	92	148.8 Å²	148.8	64%	0.643	77%	0.773	S	S	*	*			trans	45.3	114.4	146.2	68.1	0	0	0	0	125.4
1026	S	25.4	Very low	26.3	Very low	102 Å²	102	147.8 Å²	147.8	71%	0.713	77%	0.766	S	S	*	*				96.4	143.7	115.3	80.3	0	0	0	0	125.3
1027	N	27.1	Very low	26.3	Very low	143 Å²	143	152.2 Å²	152.2	77%	0.765	78%	0.776	S	S	*	*			trans	78.9	83.4	145	-65.7	-14.9	0	0	0	125
1028	S	25.4	Very low	26.4	Very low	101 Å²	101	150.4 Å²	150.4	71%	0.706	77%	0.769	S	S	*	*				68	128.6	114.8	73.6	0	0	0	0	125.4
1029	R	26.7	Very low	26.3	Very low	227 Å²	227	144.7 Å²	144.7	86%	0.857	76%	0.759	S	S	*	*			trans	83.5	119.2	141.3	-75.9	177.8	177.8	161.3	0.9	123.4
1030	N	27.3	Very low	26.6	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	75%	0.75	S	S	*	*			trans	80.5	91.9	131.2	-63.9	7.3	0	0	0	123.9
1031	S	25.8	Very low	26.6	Very low	100 Å²	100	140.4 Å²	140.4	70%	0.699	74%	0.743	S	S	*	*				71.6	145.7	110.3	-151.4	0	0	0	0	124.9
1032	Y	25.4	Very low	26.8	Very low	206 Å²	206	142.5 Å²	142.5	81%	0.808	74%	0.744	S	S	*	*			trans	97.6	128.4	152.8	-84.9	-65	0	0	0	123.6
1033	R	27.2	Very low	27.1	Very low	221 Å²	221	140.7 Å²	140.7	83%	0.834	74%	0.739	S	S	*	*			trans	70	127.5	159.1	-67.9	-168.8	165	139.7	-1.4	117.6
1034	S	25.1	Very low	27	Very low	95 Å²	95	139.5 Å²	139.5	66%	0.664	74%	0.738	S	S	*	*			cis	82.5	136.5	40.6	84.4	0	0	0	0	113.4
1035	S	27.4	Very low	27	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	74%	0.741	S	S	*	*			cis	-173.6	-168.1	9.1	33.4	0	0	0	0	111
1036	I	28.3	Very low	27.3	Very low	154 Å²	154	140.7 Å²	140.7	79%	0.79	75%	0.751	S	S	*	*			trans	91.8	140.3	161.2	-57	170.4	0	0	0	115.9
1037	L	24.6	Very low	27.2	Very low	144 Å²	144	139.8 Å²	139.8	75%	0.754	75%	0.749	S	S	*	*			cis	-180	157.5	-38.6	-119.8	168.4	0	0	0	110.3
1038	K	28.9	Very low	27.3	Very low	175 Å²	175	140.1 Å²	140.1	76%	0.761	75%	0.751	S	S	*	*			trans	73.7	136.8	171.6	-56.4	177.4	-177.4	-175.9	0	116.1
1039	S	27	Very low	27.5	Very low	87 Å²	87	144.4 Å²	144.4	61%	0.608	76%	0.757	S	S	*	*			cis	82.5	139.7	21.3	98.4	0	0	0	0	114.3
1040	D	29.7	Very low	27.7	Very low	131 Å²	131	141.8 Å²	141.8	70%	0.701	75%	0.754	S	S	*	*			cis	-146.5	157.2	13.6	-77.2	-73	0	0	0	114.3
1041	N	29.3	Very low	27.6	Very low	128 Å²	128	144 Å²	144	68%	0.684	76%	0.758	S	S	*	*			trans	62.6	131.7	141.6	-68.8	5.6	0	0	0	126.9
1042	E	28	Very low	27.8	Very low	169 Å²	169	146.1 Å²	146.1	79%	0.79	76%	0.761	S	S	*	*			trans	66.2	123.2	137.2	-66.2	176.5	173.4	0	0	122.6
1043	V	30.6	Very low	28	Very low	129 Å²	129	148 Å²	148	78%	0.782	77%	0.766	S	S	*	*				177.7	113.4	108.7	153.3	0	0	0	0	112.9
1044	V	26.4	Very low	28.2	Very low	116 Å²	116	145.4 Å²	145.4	70%	0.703	77%	0.768	S	S	*	*			trans	55.2	127.9	137.3	-173.3	0	0	0	0	123.4
1045	H	26.3	Very low	28.2	Very low	184 Å²	184	149.4 Å²	149.4	85%	0.852	78%	0.776	S	S	*	*			trans	59.2	113.4	154.4	-70.7	-14.3	0	0	0	121.7
1046	A	30.4	Very low	28.2	Very low	103 Å²	103	149.8 Å²	149.8	85%	0.851	78%	0.778	S	S	*	*				-165	106.3	99.6	0	0	0	0	0	111.3
1047	A	25.1	Very low	28.3	Very low	82 Å²	82	153 Å²	153	68%	0.678	78%	0.78	S	S	*	*			trans	-152.5	157.5	176.8	0	0	0	0	0	112.3
1048	N	27.7	Very low	28.6	Very low	151 Å²	151	155.6 Å²	155.6	81%	0.807	78%	0.782	S	S	*	*			trans	55	102.1	165.7	-63.3	-4.2	0	0	0	118.6
1049	K	30.4	Very low	28.5	Very low	190 Å²	190	153.1 Å²	153.1	83%	0.826	78%	0.777	S	S	*	*			trans	-157.7	98.2	138.3	-163.3	174.1	-176.4	179.7	0	112.5
1050	E	30.1	Very low	28.7	Very low	173 Å²	173	155.3 Å²	155.3	81%	0.808	78%	0.781	S	S	*	*	S	Bend		-166.5	77.9	128.9	-156.3	70.4	163.1	0	0	110.8
1051	F	26.1	Very low	28.6	Very low	190 Å²	190	159 Å²	159	83%	0.833	79%	0.785	S	S	*	*			trans	-145.3	165.6	162.9	-137.4	-100.6	0	0	0	108.7
1052	D	29.8	Very low	28.6	Very low	143 Å²	143	158.9 Å²	158.9	77%	0.765	78%	0.784	S	S	*	*			trans	66.5	73.7	177.2	-65.3	-23.6	0	0	0	119.2
1053	R	29.9	Very low	28.5	Very low	245 Å²	245	155.4 Å²	155.4	93%	0.925	78%	0.778	S	S	*	*				-156.7	128	126.4	-105.4	165.7	176.7	164.5	0.2	106.6
1054	I	30.8	Very low	28.4	Very low	168 Å²	168	157.4 Å²	157.4	86%	0.862	78%	0.778	S	S	*	*			cis	-139	154.9	44	-73.2	166.3	0	0	0	111.8
1055	Q	26.3	Very low	28.5	Very low	178 Å²	178	158.3 Å²	158.3	83%	0.832	78%	0.778	S	S	*	*			trans	-121.8	158.9	177.9	-167.7	-174.6	17.8	0	0	111.9
1056	S	25.9	Very low	28.5	Very low	105 Å²	105	159 Å²	159	73%	0.734	78%	0.775	S	S	*	*			trans	76.9	131.2	171.3	79.1	0	0	0	0	116.7
1057	R	30.6	Very low	28.3	Very low	221 Å²	221	162.1 Å²	162.1	83%	0.834	77%	0.772	S	S	*	*				-153.7	145.5	71.6	-77.9	-168	-171.1	-168	4.3	113.7
1058	Y	30.8	Very low	29.1	Very low	200 Å²	200	163.1 Å²	163.1	78%	0.784	77%	0.771	S	S	*	*			trans	32.9	148.8	139.7	-61.5	-102.4	0	0	0	120.4
1059	D	28.1	Very low	29	Very low	123 Å²	123	162.4 Å²	162.4	66%	0.658	77%	0.772	S	S	*	*			cis	-178.2	169.5	-5.2	-108.9	21.3	0	0	0	107.4
1060	I	30.3	Very low	28.9	Very low	133 Å²	133	164.8 Å²	164.8	68%	0.682	78%	0.778	S	S	*	*			cis	-175.5	167.4	-26.4	-162.1	169.9	0	0	0	109.8
1061	R	28	Very low	28.9	Very low	209 Å²	209	160.9 Å²	160.9	79%	0.789	78%	0.775	S	S	*	*			trans	85.3	120.3	159	-80.7	-171.7	172.4	152.6	5.4	123.8
1062	D	28.8	Very low	28.9	Very low	125 Å²	125	160.9 Å²	160.9	67%	0.668	78%	0.778	S	S	*	*				81.7	98	123	-56.5	-9	0	0	0	124.2
1063	S	25.3	Very low	28.8	Very low	95 Å²	95	159.6 Å²	159.6	66%	0.664	78%	0.775	S	S	*	*				109.8	133	109.8	75.7	0	0	0	0	121.7
1064	H	29.4	Very low	28.8	Very low	171 Å²	171	155.2 Å²	155.2	79%	0.792	77%	0.769	S	S	*	*			trans	62.7	154.5	152.5	-59.2	-41.4	0	0	0	120.3
1065	I	28.2	Very low	28.6	Very low	136 Å²	136	155.2 Å²	155.2	70%	0.697	77%	0.77	S	S	*	*			cis	-164.4	142.7	-40	-124.9	172	0	0	0	107.2
1066	Y	26.4	Very low	28.8	Very low	198 Å²	198	151.5 Å²	151.5	78%	0.776	76%	0.761	S	S	*	*			trans	42.6	103.7	169.1	-82.1	-88.3	0	0	0	121.9
1067	E	25.7	Very low	29	Very low	169 Å²	169	154.5 Å²	154.5	79%	0.79	77%	0.767	S	S	*	*				55.8	169.3	105.4	-112.2	-170.2	-151.6	0	0	122.3
1068	P	42.8	Very low	28.8	Very low	102 Å²	102	149.7 Å²	149.7	66%	0.662	77%	0.767	S	S	*	*				-126.6	-173.9	-108.1	43.8	-27.9	0	0	0	114.6
1069	T	26	Very low	28.7	Very low	137 Å²	137	145.5 Å²	145.5	84%	0.84	77%	0.767	S	S	*	*			trans	-163.6	139.5	150.9	-2.5	0	0	0	0	113.5
1070	Y	27.7	Very low	28.8	Very low	239 Å²	239	149.3 Å²	149.3	94%	0.937	78%	0.781	S	S	*	*			trans	-90.2	144	151.7	-123.5	-95.7	0	0	0	107.6
1071	A	29.4	Very low	28.8	Very low	92 Å²	92	147.7 Å²	147.7	76%	0.76	78%	0.781	S	S	*	*			trans	-152.4	113.5	177.4	0	0	0	0	0	114.5
1072	Q	26.1	Very low	28.8	Very low	189 Å²	189	144.5 Å²	144.5	88%	0.883	78%	0.779	S	S	*	*			trans	-129.9	146.5	150.5	-85.5	-163.8	19.2	0	0	105.9
1073	T	29.1	Very low	28.9	Very low	116 Å²	116	145 Å²	145	71%	0.712	78%	0.778	S	S	*	*			cis	-153.7	139.1	-13.1	-75.4	0	0	0	0	105.6
1074	I	29.2	Very low	29.1	Very low	153 Å²	153	147.9 Å²	147.9	79%	0.785	78%	0.778	S	S	*	*			trans	-130.2	115.5	-178.4	-61.8	-178.1	0	0	0	112
1075	L	26.5	Very low	29.2	Very low	169 Å²	169	149 Å²	149	89%	0.885	78%	0.777	S	S	*	*			trans	-81.2	130.5	148.5	-85.6	169.2	0	0	0	108
1076	P	30.1	Very low	29.4	Very low	99 Å²	99	151.5 Å²	151.5	64%	0.643	78%	0.778	S	S	*	*			trans	-83.8	145.9	-173.7	33.1	-35.2	0	0	0	112.5
1077	I	29.5	Very low	29.5	Very low	169 Å²	169	151.6 Å²	151.6	87%	0.867	78%	0.777	S	S	*	*				-168	128.7	121.4	-94.8	149.5	0	0	0	107.9
1078	S	26.7	Very low	29.7	Very low	119 Å²	119	150.9 Å²	150.9	83%	0.832	77%	0.771	S	S	*	*			trans	-94.2	146.3	179.4	53.1	0	0	0	0	111.7
1079	S	29	Very low	29.1	Very low	112 Å²	112	152.3 Å²	152.3	78%	0.783	77%	0.769	S	S	*	*			trans	-138.8	135.6	161.5	66	0	0	0	0	111.2
1080	H	30.9	Very low	29.3	Very low	204 Å²	204	156.4 Å²	156.4	94%	0.944	77%	0.769	S	S	*	*			trans	-138.7	140.3	166.8	-97.9	36.4	0	0	0	107.2
1081	S	29.4	Very low	29.5	Very low	98 Å²	98	151.1 Å²	151.1	69%	0.685	76%	0.761	S	S	*	*			trans	-123.8	127.3	-177.5	54.5	0	0	0	0	108.5
1082	N	29.5	Very low	29.3	Very low	142 Å²	142	150.5 Å²	150.5	76%	0.759	75%	0.751	S	S	*	*				174.8	163.2	86	-81.5	-51.6	0	0	0	107.2
1083	E	30.9	Very low	29.5	Very low	137 Å²	137	147.7 Å²	147.7	64%	0.64	75%	0.747	S	S	*	*			cis	-155	162.1	1.3	-129.2	-171	142.8	0	0	112.1
1084	K	29.6	Very low	29.3	Very low	155 Å²	155	148.8 Å²	148.8	67%	0.674	75%	0.746	S	S	*	*			trans	4.3	136.8	162	-57	155.9	-175.2	158.5	0	119.2
1085	Y	29.9	Very low	29.4	Very low	194 Å²	194	147 Å²	147	76%	0.761	74%	0.742	S	S	*	*				-165.8	118.9	70.9	-123.4	-92	0	0	0	117
1086	R	32.3	Very low	29.4	Very low	189 Å²	189	145.9 Å²	145.9	71%	0.713	74%	0.737	S	S	*	*			trans	39.9	139.4	144.2	-83.3	179.9	168.8	165.2	-1.4	126.9
1087	R	30	Very low	29.3	Very low	200 Å²	200	149.9 Å²	149.9	76%	0.755	75%	0.747	S	S	*	*			trans	84.8	112.1	141.5	-79.4	-178.8	172.6	174.8	-2.3	118.7
1088	K	28.7	Very low	29.1	Very low	154 Å²	154	151.4 Å²	151.4	67%	0.67	75%	0.747	S	S	*	*				97.1	146.3	92.6	-90	-177.1	156.3	-130.5	0	111.5
1089	E	30.1	Very low	29.6	Very low	131 Å²	131	150.9 Å²	150.9	61%	0.612	74%	0.741	S	S	*	*			cis	-153.1	176.3	3	-141.5	148.3	-168.9	0	0	113.8
1090	R	30.5	Very low	29.8	Very low	223 Å²	223	151.1 Å²	151.1	84%	0.842	74%	0.743	S	S	*	*			trans	-47	172.2	170.5	-63.5	172.2	168.7	162.9	-5.2	116.1
1091	V	31.3	Very low	29.8	Very low	128 Å²	128	147.9 Å²	147.9	78%	0.776	74%	0.738	S	S	*	*			cis	-157.6	167.3	9	100.2	0	0	0	0	114
1092	S	26.3	Very low	30.4	Very low	79 Å²	79	147.9 Å²	147.9	55%	0.552	74%	0.736	S	S	*	*			trans	-49	161.1	170.4	52	0	0	0	0	117.9
1093	T	29.6	Very low	30.6	Very low	130 Å²	130	150.1 Å²	150.1	80%	0.798	74%	0.739	S	S	*	*				-175	175.6	92.9	38.4	0	0	0	0	112.1
1094	M	26.2	Very low	30.8	Very low	140 Å²	140	148.3 Å²	148.3	69%	0.69	74%	0.741	S	S	*	*				-173.5	141.9	-53.4	-112.7	169.6	67.3	0	0	112.8
1095	T	30.2	Very low	30.8	Very low	116 Å²	116	149.1 Å²	149.1	71%	0.712	75%	0.752	S	S	*	*			trans	70.8	157.3	155.2	68.9	0	0	0	0	119.7
1096	N	27.5	Very low	30.8	Very low	144 Å²	144	148.1 Å²	148.1	77%	0.77	75%	0.754	S	S	*	*			cis	-158.9	176.7	2	-135.2	-24.1	0	0	0	116.6
1097	Q	27.8	Very low	30.8	Very low	184 Å²	184	148.5 Å²	148.5	86%	0.86	76%	0.761	S	S	*	*			trans	91.8	168.2	158	-75.5	179.2	4.3	0	0	121.4
1098	K	25.5	Very low	31.3	Very low	200 Å²	200	145.1 Å²	145.1	87%	0.87	76%	0.757	S	S	*	*			trans	-146.3	-172.3	-140	-124.6	-179.2	-178.6	179.6	0	109.3
1099	P	36.7	Very low	31.7	Very low	108 Å²	108	147.6 Å²	147.6	70%	0.701	76%	0.762	S	S	*	*			cis	-137.3	168.8	-15.4	39.5	-22.8	0	0	0	116.1
1100	S	32.8	Very low	32.4	Very low	117 Å²	117	147 Å²	147	82%	0.818	76%	0.762	S	S	*	*			trans	-178.3	159.7	134.1	49.8	0	0	0	0	113.3
1101	T	30.4	Very low	33.1	Very low	137 Å²	137	139.9 Å²	139.9	84%	0.84	75%	0.746	S	S	*	*			trans	-138.4	-171.1	179.4	54	0	0	0	0	107.6
1102	P	41.9	Very low	34.1	Very low	98 Å²	98	137.4 Å²	137.4	64%	0.636	73%	0.731	S	S	*	*			cis	-147.7	-161.7	14.5	35.7	-8.5	0	0	0	117.4
1103	F	33.9	Very low	35.7	Very low	189 Å²	189	138.5 Å²	138.5	83%	0.829	73%	0.73	S	S	*	*			trans	79.4	138	170.9	-61.5	-74.2	0	0	0	119.1
1104	S	35.2	Very low	36.9	Very low	99 Å²	99	135.3 Å²	135.3	69%	0.692	71%	0.712	S	S	*	*			cis	-170.9	134.1	-37.3	45.2	0	0	0	0	108.9
1105	L	30	Very low	38.6	Very low	171 Å²	171	134 Å²	134	90%	0.895	71%	0.707	S	S	*	*			trans	-134.5	55	177.1	-126.2	175	0	0	0	112.8
1106	E	29.7	Very low	40.5	Very low	174 Å²	174	133.5 Å²	133.5	81%	0.813	70%	0.699	S	S	*	*			trans	-108.9	99	172	-71.6	-168.4	128.7	0	0	111.2
1107	K	33.1	Very low	42.3	Very low	197 Å²	197	128.7 Å²	128.7	86%	0.857	68%	0.679	S	S	*	*	S	Bend	trans	-165.6	11.6	156.7	-118	162.7	-172	176.2	0	119.1
1108	I	39.2	Very low	44.5	Very low	128 Å²	128	124.7 Å²	124.7	66%	0.656	66%	0.663	S	S	*	*	S	Bend	trans	-112.5	-40.8	-179.9	-64.2	-179.4	0	0	0	113.1	I1110 S1111	I1108-I1110 PolarHBondContact O-N 2.93Å; I1108-S1111 PolarHBondContact O-N 2.58Å
1109	W	38.8	Very low	46.8	Very low	206 Å²	206	118.9 Å²	118.9	78%	0.78	65%	0.647	S	S	*	*	H	α-helix	trans	-69.5	-29.2	-173.4	-86.4	85.7	0	0	0	115.6	S1111 I1113	W1109-S1111 VanDerWaalsContact C-N 3.35Å; W1109-S1111 PolarHBondContact O-N 2.73Å; W1109-I1113 WeakPolarHBondContact O-CG1 3.26Å; W1109-I1113 PolarHBondContact O-N 2.81Å
1110	I	43.2	Very low	48.7	Very low	118 Å²	118	117.8 Å²	117.8	61%	0.605	64%	0.639	S	S	*	*	H	α-helix	trans	-67.9	-35.5	178.8	-62.5	176	0	0	0	111.2	I1108 V1112 I1113 C1114	I1108-I1110 PolarHBondContact O-N 2.93Å; I1110-V1112 PolarHBondContact O-N 2.67Å; I1110-I1113 PolarHBondContact O-N 3.41Å; I1110-C1114 WeakPolarHBondContact O-CB 3.39Å; I1110-C1114 PolarHBondContact O-N 3.21Å; I1110-C1114 PolarHBondContact O-SG 3.08Å; I1110-C1114 VanDerWaalsContact O-SG 3.33Å
1111	S	45.6	Very low	50.8	Low	74 Å²	74	117.9 Å²	117.9	52%	0.517	63%	0.629	S	S	.	*	H	α-helix	trans	-64.8	-40.9	-178.6	-164.9	0	0	0	0	112.4	I1108 W1109 L1115	I1108-S1111 PolarHBondContact O-N 2.58Å; W1109-S1111 VanDerWaalsContact C-N 3.35Å; W1109-S1111 PolarHBondContact O-N 2.73Å; S1111-L1115 WeakPolarHBondContact O-CB 3.15Å; S1111-L1115 WeakPolarHBondContact O-CG 3.2Å; S1111-L1115 PolarHBondContact O-N 3.28Å
1112	V	52.9	Low	53	Low	76 Å²	76	115.7 Å²	115.7	46%	0.461	62%	0.616	S	S	.	*	H	α-helix	trans	-68.1	-44.2	179.1	-177.7	0	0	0	0	111.1	I1110 L1115 I1116	I1110-V1112 PolarHBondContact O-N 2.67Å; V1112-L1115 PolarHBondContact O-N 3.34Å; V1112-I1116 HydrophobicContact CG1-CD1 4.07Å; V1112-I1116 WeakPolarHBondContact O-CG1 3.41Å; V1112-I1116 PolarHBondContact O-N 3.36Å
1113	I	60	Low	54.6	Low	103 Å²	103	113.5 Å²	113.5	53%	0.528	61%	0.606	S	S	.	*	H	α-helix	trans	-66.4	-40.6	178.5	-64.6	172.3	0	0	0	110.8	W1109 I1110 I1116 A1117	W1109-I1113 WeakPolarHBondContact O-CG1 3.26Å; W1109-I1113 PolarHBondContact O-N 2.81Å; I1110-I1113 PolarHBondContact O-N 3.41Å; I1113-I1116 PolarHBondContact O-N 2.89Å; I1113-A1117 WeakPolarHBondContact O-CB 3.39Å; I1113-A1117 PolarHBondContact O-N 2.81Å
1114	C	55.5	Low	56.7	Low	62 Å²	62	111.2 Å²	111.2	42%	0.419	60%	0.596	S	S	.	*	H	α-helix	trans	-63.9	-40.5	174.1	-73.7	0	0	0	0	112.8	I1110 A1117 I1118	I1110-C1114 WeakPolarHBondContact O-CB 3.39Å; I1110-C1114 PolarHBondContact O-N 3.21Å; I1110-C1114 PolarHBondContact O-SG 3.08Å; I1110-C1114 VanDerWaalsContact O-SG 3.33Å; C1114-A1117 PolarHBondContact O-N 3.11Å; C1114-I1118 WeakPolarHBondContact O-CB 3.47Å; C1114-I1118 WeakPolarHBondContact O-CD1 3.38Å; C1114-I1118 WeakPolarHBondContact O-CG1 3.26Å; C1114-I1118 PolarHBondContact O-N 2.8Å
1115	L	61.4	Low	58.5	Low	113 Å²	113	109.3 Å²	109.3	59%	0.592	59%	0.586	S	S	*	*	H	α-helix	trans	-65.3	-39.3	176.9	-77	167.4	0	0	0	112.4	S1111 V1112 S1119	S1111-L1115 WeakPolarHBondContact O-CB 3.15Å; S1111-L1115 WeakPolarHBondContact O-CG 3.2Å; S1111-L1115 PolarHBondContact O-N 3.28Å; V1112-L1115 PolarHBondContact O-N 3.34Å; L1115-S1119 WeakPolarHBondContact O-CB 3.27Å; L1115-S1119 PolarHBondContact O-N 3.29Å
1116	I	69.3	Low	60.8	Low	106 Å²	106	107.9 Å²	107.9	54%	0.544	57%	0.573	S	S	.	*	H	α-helix	trans	-66.8	-43.9	174.5	-66.1	168.2	0	0	0	110.7	V1112 I1113 S1119 T1120	V1112-I1116 HydrophobicContact CG1-CD1 4.07Å; V1112-I1116 WeakPolarHBondContact O-CG1 3.41Å; V1112-I1116 PolarHBondContact O-N 3.36Å; I1113-I1116 PolarHBondContact O-N 2.89Å; I1116-S1119 WeakPolarHBondContact O-CB 3.26Å; I1116-S1119 PolarHBondContact O-N 3.16Å; I1116-T1120 PolarHBondContact O-N 2.93Å; I1116-T1120 PolarHBondContact O-OG1 3.4Å
1117	A	65.8	Low	62.9	Low	42 Å²	42	104.9 Å²	104.9	35%	0.347	56%	0.562	S	S	.	*	H	α-helix	trans	-66.3	-35.7	178.1	0	0	0	0	0	113.3	I1113 C1114 T1120 L1121	I1113-A1117 WeakPolarHBondContact O-CB 3.39Å; I1113-A1117 PolarHBondContact O-N 2.81Å; C1114-A1117 PolarHBondContact O-N 3.11Å; A1117-T1120 PolarHBondContact O-OG1 3.26Å; A1117-L1121 VanDerWaalsContact O-CB 3.31Å; A1117-L1121 WeakPolarHBondContact O-CB 3.16Å; A1117-L1121 WeakPolarHBondContact O-CG 3.24Å; A1117-L1121 PolarHBondContact O-N 3.36Å
1118	I	74.4	Confident	64.9	Low	100 Å²	100	98.1 Å²	98.1	51%	0.513	54%	0.537	S	S	.	.	H	α-helix	trans	-69.8	-40.3	173.7	-69.9	164.6	0	0	0	110.1	C1114 L1121 V1122	C1114-I1118 WeakPolarHBondContact O-CB 3.47Å; C1114-I1118 WeakPolarHBondContact O-CD1 3.38Å; C1114-I1118 WeakPolarHBondContact O-CG1 3.26Å; C1114-I1118 PolarHBondContact O-N 2.8Å; I1118-L1121 PolarHBondContact O-N 3.26Å; I1118-V1122 HydrophobicContact CG2-CG2 4.32Å; I1118-V1122 WeakPolarHBondContact O-CB 3.43Å; I1118-V1122 VanDerWaalsContact O-CG2 3.28Å; I1118-V1122 WeakPolarHBondContact O-CG2 3.26Å; I1118-V1122 PolarHBondContact O-N 2.77Å
1119	S	74	Confident	66.4	Low	78 Å²	78	94.6 Å²	94.6	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-58.9	-48.3	174.6	-175.9	0	0	0	0	112	L1115 I1116 V1122 A1123	L1115-S1119 WeakPolarHBondContact O-CB 3.27Å; L1115-S1119 PolarHBondContact O-N 3.29Å; I1116-S1119 WeakPolarHBondContact O-CB 3.26Å; I1116-S1119 PolarHBondContact O-N 3.16Å; S1119-V1122 PolarHBondContact O-N 3.08Å; S1119-A1123 WeakPolarHBondContact O-CB 3.49Å; S1119-A1123 PolarHBondContact O-N 3.26Å
1120	T	75	Confident	68.1	Low	86 Å²	86	88.1 Å²	88.1	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-69.1	-36.4	178.4	55.3	0	0	0	0	112.8	I1116 A1117 A1123 F1124	I1116-T1120 PolarHBondContact O-N 2.93Å; I1116-T1120 PolarHBondContact O-OG1 3.4Å; A1117-T1120 PolarHBondContact O-OG1 3.26Å; T1120-A1123 PolarHBondContact O-N 2.97Å; T1120-F1124 VanDerWaalsContact O-CB 3.3Å; T1120-F1124 WeakPolarHBondContact O-CB 3.36Å; T1120-F1124 PolarHBondContact O-N 2.84Å
1121	L	76.7	Confident	69.2	Low	118 Å²	118	86.2 Å²	86.2	62%	0.618	50%	0.501	S	S	*	.	H	α-helix	trans	-65.3	-40.3	173.2	-82.7	166.4	0	0	0	112.7	A1117 I1118 F1124 A1125	A1117-L1121 VanDerWaalsContact O-CB 3.31Å; A1117-L1121 WeakPolarHBondContact O-CB 3.16Å; A1117-L1121 WeakPolarHBondContact O-CG 3.24Å; A1117-L1121 PolarHBondContact O-N 3.36Å; I1118-L1121 PolarHBondContact O-N 3.26Å; L1121-F1124 PolarHBondContact O-N 2.62Å; L1121-A1125 VanDerWaalsContact O-CB 3.25Å; L1121-A1125 WeakPolarHBondContact O-CB 3.29Å; L1121-A1125 PolarHBondContact O-N 3.29Å
1122	V	78.6	Confident	70.1	Confident	92 Å²	92	87 Å²	87	56%	0.558	50%	0.499	S	S	*	.	H	α-helix	trans	-66.9	-43.3	175.5	169.7	0	0	0	0	110.7	I1118 S1119 F1124 A1125 F1126	I1118-V1122 HydrophobicContact CG2-CG2 4.32Å; I1118-V1122 WeakPolarHBondContact O-CB 3.43Å; I1118-V1122 VanDerWaalsContact O-CG2 3.28Å; I1118-V1122 WeakPolarHBondContact O-CG2 3.26Å; I1118-V1122 PolarHBondContact O-N 2.77Å; S1119-V1122 PolarHBondContact O-N 3.08Å; V1122-F1124 PolarHBondContact O-N 3.17Å; V1122-A1125 PolarHBondContact O-N 2.98Å; V1122-F1126 WeakPolarHBondContact O-CB 3.47Å; V1122-F1126 PolarHBondContact O-N 2.99Å
1123	A	73.5	Confident	70.2	Confident	51 Å²	51	85.9 Å²	85.9	42%	0.421	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-42.7	175.3	0	0	0	0	0	112.3	S1119 T1120 F1126 L1127	S1119-A1123 WeakPolarHBondContact O-CB 3.49Å; S1119-A1123 PolarHBondContact O-N 3.26Å; T1120-A1123 PolarHBondContact O-N 2.97Å; A1123-F1126 PolarHBondContact O-N 2.98Å; A1123-L1127 WeakPolarHBondContact O-CG 3.25Å; A1123-L1127 PolarHBondContact O-N 3.1Å
1124	F	78.1	Confident	69.6	Low	141 Å²	141	89.9 Å²	89.9	62%	0.618	51%	0.506	S	S	*	.	H	α-helix	trans	-66.3	-42.4	176.5	-165.1	-94.3	0	0	0	111.7	T1120 L1121 V1122 F1126 L1127 V1128	T1120-F1124 VanDerWaalsContact O-CB 3.3Å; T1120-F1124 WeakPolarHBondContact O-CB 3.36Å; T1120-F1124 PolarHBondContact O-N 2.84Å; L1121-F1124 PolarHBondContact O-N 2.62Å; V1122-F1124 PolarHBondContact O-N 3.17Å; F1124-F1126 VanDerWaalsContact C-N 3.3Å; F1124-F1126 PolarHBondContact O-N 3.06Å; F1124-L1127 PolarHBondContact O-N 2.85Å; F1124-V1128 HydrophobicContact CD1-CG2 3.94Å; F1124-V1128 HydrophobicContact CE1-CG2 3.72Å; F1124-V1128 HydrophobicContact CZ-CG2 4.32Å; F1124-V1128 WeakPolarHBondContact O-CB 3.26Å; F1124-V1128 WeakPolarHBondContact O-CG2 3.39Å; F1124-V1128 PolarHBondContact O-N 2.8Å
1125	A	73.8	Confident	69.1	Low	59 Å²	59	93 Å²	93	49%	0.488	51%	0.514	S	S	.	.	H	α-helix	trans	-62.2	-36.2	173.8	0	0	0	0	0	112.3	L1121 V1122 A1129	L1121-A1125 VanDerWaalsContact O-CB 3.25Å; L1121-A1125 WeakPolarHBondContact O-CB 3.29Å; L1121-A1125 PolarHBondContact O-N 3.29Å; V1122-A1125 PolarHBondContact O-N 2.98Å; A1125-A1129 VanDerWaalsContact O-CB 3.26Å; A1125-A1129 WeakPolarHBondContact O-CB 3.47Å; A1125-A1129 PolarHBondContact O-N 3.4Å
1126	F	77.7	Confident	68.1	Low	142 Å²	142	95.1 Å²	95.1	62%	0.623	52%	0.519	S	S	*	.	H	α-helix	trans	-70.8	-39.6	176.2	-146.3	-96.2	0	0	0	112	V1122 A1123 F1124 A1129 I1130	V1122-F1126 WeakPolarHBondContact O-CB 3.47Å; V1122-F1126 PolarHBondContact O-N 2.99Å; A1123-F1126 PolarHBondContact O-N 2.98Å; F1124-F1126 VanDerWaalsContact C-N 3.3Å; F1124-F1126 PolarHBondContact O-N 3.06Å; F1126-A1129 PolarHBondContact O-N 3.37Å; F1126-I1130 HydrophobicContact CD1-CD1 3.71Å; F1126-I1130 HydrophobicContact CD1-CG1 4.39Å; F1126-I1130 HydrophobicContact CE1-CD1 3.96Å; F1126-I1130 VanDerWaalsContact O-CG1 3.31Å; F1126-I1130 WeakPolarHBondContact O-CG1 3.49Å; F1126-I1130 PolarHBondContact O-N 3.17Å
1127	L	73.8	Confident	66.7	Low	110 Å²	110	95.2 Å²	95.2	58%	0.576	52%	0.524	S	S	*	.	H	α-helix	trans	-64.5	-43.5	172.8	-77.3	166.3	0	0	0	112	A1123 F1124 A1129 I1130 T1131	A1123-L1127 WeakPolarHBondContact O-CG 3.25Å; A1123-L1127 PolarHBondContact O-N 3.1Å; F1124-L1127 PolarHBondContact O-N 2.85Å; L1127-A1129 VanDerWaalsContact C-N 3.34Å; L1127-I1130 PolarHBondContact O-N 3.4Å; L1127-T1131 PolarHBondContact O-N 3.41Å; L1127-T1131 PolarHBondContact O-OG1 2.71Å
1128	V	75.1	Confident	65.2	Low	55 Å²	55	97.1 Å²	97.1	33%	0.333	54%	0.54	S	S	.	.	H	α-helix	trans	-64.8	-37.3	173.9	170.4	0	0	0	0	111.3	F1124 T1131 L1132	F1124-V1128 HydrophobicContact CD1-CG2 3.94Å; F1124-V1128 HydrophobicContact CE1-CG2 3.72Å; F1124-V1128 HydrophobicContact CZ-CG2 4.32Å; F1124-V1128 WeakPolarHBondContact O-CB 3.26Å; F1124-V1128 WeakPolarHBondContact O-CG2 3.39Å; F1124-V1128 PolarHBondContact O-N 2.8Å; V1128-T1131 WeakPolarHBondContact CA-OG1 3.47Å; V1128-T1131 PolarHBondContact O-N 2.75Å; V1128-T1131 PolarHBondContact O-OG1 3.03Å; V1128-L1132 HydrophobicContact CG1-CD1 3.73Å; V1128-L1132 HydrophobicContact CG1-CG 4.25Å; V1128-L1132 VanDerWaalsContact O-CB 3.26Å; V1128-L1132 WeakPolarHBondContact O-CB 3.46Å; V1128-L1132 VanDerWaalsContact O-CG 3.24Å; V1128-L1132 WeakPolarHBondContact O-CG 3.31Å; V1128-L1132 PolarHBondContact O-N 3.25Å
1129	A	71.4	Confident	63.3	Low	54 Å²	54	97.5 Å²	97.5	45%	0.446	55%	0.547	S	S	.	.	H	α-helix	trans	-64.8	-38.7	172.7	0	0	0	0	0	112	A1125 F1126 L1127 A1133	A1125-A1129 VanDerWaalsContact O-CB 3.26Å; A1125-A1129 WeakPolarHBondContact O-CB 3.47Å; A1125-A1129 PolarHBondContact O-N 3.4Å; F1126-A1129 PolarHBondContact O-N 3.37Å; L1127-A1129 VanDerWaalsContact C-N 3.34Å; A1129-A1133 WeakPolarHBondContact O-CB 3.1Å; A1129-A1133 PolarHBondContact O-N 3.04Å
1130	I	74.1	Confident	61.2	Low	71 Å²	71	103.8 Å²	103.8	36%	0.364	56%	0.56	S	S	.	*	H	α-helix	trans	-69.2	-40.6	176.3	-71.8	166.6	0	0	0	111.7	F1126 L1127 A1133 R1134	F1126-I1130 HydrophobicContact CD1-CD1 3.71Å; F1126-I1130 HydrophobicContact CD1-CG1 4.39Å; F1126-I1130 HydrophobicContact CE1-CD1 3.96Å; F1126-I1130 VanDerWaalsContact O-CG1 3.31Å; F1126-I1130 WeakPolarHBondContact O-CG1 3.49Å; F1126-I1130 PolarHBondContact O-N 3.17Å; L1127-I1130 PolarHBondContact O-N 3.4Å; I1130-A1133 PolarHBondContact O-N 3.35Å; I1130-R1134 WeakPolarHBondContact O-CB 3.38Å; I1130-R1134 WeakPolarHBondContact O-CG 3.35Å; I1130-R1134 PolarHBondContact O-N 3.29Å
1131	T	66.3	Low	59	Low	77 Å²	77	107.7 Å²	107.7	47%	0.472	57%	0.573	S	S	.	*	H	α-helix	trans	-71.4	-39.6	176.8	52.7	0	0	0	0	112.1	L1127 V1128 R1134 Q1135	L1127-T1131 PolarHBondContact O-N 3.41Å; L1127-T1131 PolarHBondContact O-OG1 2.71Å; V1128-T1131 WeakPolarHBondContact CA-OG1 3.47Å; V1128-T1131 PolarHBondContact O-N 2.75Å; V1128-T1131 PolarHBondContact O-OG1 3.03Å; T1131-R1134 PolarHBondContact O-N 3.4Å; T1131-Q1135 PolarHBondContact O-N 3.38Å
1132	L	64.7	Low	56.6	Low	91 Å²	91	110.1 Å²	110.1	48%	0.476	59%	0.585	S	S	.	*	H	α-helix	trans	-67.6	-34.1	172.6	-70.3	173.4	0	0	0	112.5	V1128 K1136	V1128-L1132 HydrophobicContact CG1-CD1 3.73Å; V1128-L1132 HydrophobicContact CG1-CG 4.25Å; V1128-L1132 VanDerWaalsContact O-CB 3.26Å; V1128-L1132 WeakPolarHBondContact O-CB 3.46Å; V1128-L1132 VanDerWaalsContact O-CG 3.24Å; V1128-L1132 WeakPolarHBondContact O-CG 3.31Å; V1128-L1132 PolarHBondContact O-N 3.25Å; L1132-K1136 WeakPolarHBondContact O-CB 3.04Å; L1132-K1136 PolarHBondContact O-N 2.57Å
1133	A	55.6	Low	54.2	Low	53 Å²	53	114.8 Å²	114.8	44%	0.438	60%	0.601	S	S	.	*	H	α-helix	trans	-65.4	-44.3	171.1	0	0	0	0	0	111.1	A1129 I1130 K1136 V1137	A1129-A1133 WeakPolarHBondContact O-CB 3.1Å; A1129-A1133 PolarHBondContact O-N 3.04Å; I1130-A1133 PolarHBondContact O-N 3.35Å; A1133-K1136 PolarHBondContact O-N 3.5Å; A1133-V1137 VanDerWaalsContact O-CG2 3.31Å; A1133-V1137 WeakPolarHBondContact O-CG2 3.27Å; A1133-V1137 PolarHBondContact O-N 3.48Å
1134	R	46.5	Very low	52.1	Low	187 Å²	187	124.5 Å²	124.5	71%	0.706	63%	0.627	S	S	*	*	H	α-helix	trans	-63.3	-39.8	174.8	-76.8	178.8	171.7	-172	-3.3	112.4	I1130 T1131 V1137 A1138	I1130-R1134 WeakPolarHBondContact O-CB 3.38Å; I1130-R1134 WeakPolarHBondContact O-CG 3.35Å; I1130-R1134 PolarHBondContact O-N 3.29Å; T1131-R1134 PolarHBondContact O-N 3.4Å; R1134-V1137 PolarHBondContact O-N 2.97Å; R1134-A1138 VanDerWaalsContact O-CB 3.31Å; R1134-A1138 WeakPolarHBondContact O-CB 3.32Å; R1134-A1138 PolarHBondContact O-N 3.35Å
1135	Q	45.4	Very low	49.8	Very low	126 Å²	126	121.1 Å²	121.1	59%	0.589	63%	0.632	S	S	*	*	H	α-helix	trans	-66.5	-35.5	173.5	-77.3	-177.2	-42.7	0	0	112.8	T1131 A1138 T1139	T1131-Q1135 PolarHBondContact O-N 3.38Å; Q1135-A1138 PolarHBondContact O-N 3.47Å; Q1135-T1139 PolarHBondContact O-N 3.22Å; Q1135-T1139 PolarHBondContact O-OG1 3.11Å
1136	K	39.9	Very low	47.8	Very low	159 Å²	159	123.6 Å²	123.6	69%	0.691	65%	0.645	S	S	*	*	H	α-helix	trans	-73.4	-29.4	173.7	-78.9	-170	172.6	-173.3	0	114.3	L1132 A1133	L1132-K1136 WeakPolarHBondContact O-CB 3.04Å; L1132-K1136 PolarHBondContact O-N 2.57Å; A1133-K1136 PolarHBondContact O-N 3.5Å
1137	V	40.3	Very low	45.6	Very low	107 Å²	107	123.5 Å²	123.5	65%	0.648	65%	0.651	S	S	*	*	H	α-helix	trans	-74	-36.2	171.1	173.9	0	0	0	0	110.9	A1133 R1134 T1139	A1133-V1137 VanDerWaalsContact O-CG2 3.31Å; A1133-V1137 WeakPolarHBondContact O-CG2 3.27Å; A1133-V1137 PolarHBondContact O-N 3.48Å; R1134-V1137 PolarHBondContact O-N 2.97Å; V1137-T1139 PolarHBondContact O-N 3.37Å
1138	A	35.3	Very low	43.5	Very low	83 Å²	83	125.9 Å²	125.9	69%	0.686	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	3.2	175.7	0	0	0	0	0	115.1	R1134 Q1135	R1134-A1138 VanDerWaalsContact O-CB 3.31Å; R1134-A1138 WeakPolarHBondContact O-CB 3.32Å; R1134-A1138 PolarHBondContact O-N 3.35Å; Q1135-A1138 PolarHBondContact O-N 3.47Å
1139	T	32.8	Very low	41.4	Very low	108 Å²	108	130.9 Å²	130.9	66%	0.663	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	16.5	179.9	47.7	0	0	0	0	113.9	Q1135 V1137	Q1135-T1139 PolarHBondContact O-N 3.22Å; Q1135-T1139 PolarHBondContact O-OG1 3.11Å; V1137-T1139 PolarHBondContact O-N 3.37Å
1140	Y	30	Very low	39.3	Very low	209 Å²	209	132.8 Å²	132.8	82%	0.82	69%	0.689	S	S	*	*	S	Bend	trans	-124.3	-1.2	176.2	-112.7	-93.6	0	0	0	115
1141	E	28.6	Very low	37.1	Very low	169 Å²	169	138.5 Å²	138.5	79%	0.79	72%	0.715	S	S	*	*	S	Bend	trans	-120.4	58.8	-177.3	-82.6	-73	164.1	0	0	110.8
1142	L	28.3	Very low	35.4	Very low	168 Å²	168	140.2 Å²	140.2	88%	0.88	72%	0.721	S	S	*	*	S	Bend	trans	-157.9	27.9	172.1	-116.9	169.3	0	0	0	114.8
1143	Q	27	Very low	33.6	Very low	190 Å²	190	143.9 Å²	143.9	89%	0.888	73%	0.733	S	S	*	*	S	Bend	trans	-140.8	62.1	173.3	-79.2	-159.4	-20.8	0	0	114
1144	R	30	Very low	32.4	Very low	255 Å²	255	146 Å²	146	96%	0.962	74%	0.737	S	S	*	*			trans	-172.2	133.8	141.8	-110.1	165.3	-179.3	-178.5	-0.9	111.9
1145	G	30.4	Very low	31.6	Very low	71 Å²	71	143.6 Å²	143.6	73%	0.732	74%	0.738	S	S	*	*			trans	-90.5	157.4	173.6	0	0	0	0	0	113.3
1146	S	30.2	Very low	30.8	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	75%	0.749	S	S	*	*			trans	13.9	126.1	154	-51	0	0	0	0	119.9
1147	N	31.7	Very low	30.1	Very low	140 Å²	140	142.4 Å²	142.4	75%	0.749	75%	0.747	S	S	*	*				-170.1	145.9	99.9	-95.9	-22.6	0	0	0	113.2
1148	H	30.8	Very low	29.5	Very low	161 Å²	161	142.9 Å²	142.9	75%	0.745	75%	0.75	S	S	*	*			trans	37.2	130.5	150.8	-71.6	-81.4	0	0	0	119.9
1149	L	30.7	Very low	29.1	Very low	159 Å²	159	146.2 Å²	146.2	83%	0.832	75%	0.751	S	S	*	*			cis	-155.5	145.8	44.9	-124	143.4	0	0	0	112.9
1150	T	26.8	Very low	28.7	Very low	94 Å²	94	148.5 Å²	148.5	58%	0.577	76%	0.755	S	S	*	*			trans	-99.1	134.5	172.9	49.3	0	0	0	0	111.4
1151	E	28.9	Very low	28.5	Very low	191 Å²	191	144.7 Å²	144.7	89%	0.893	76%	0.757	S	S	*	*			trans	-127.9	124.8	135.5	-69.3	-168.9	141.7	0	0	107.8
1152	N	29.4	Very low	28.4	Very low	113 Å²	113	140 Å²	140	60%	0.604	75%	0.754	S	S	*	*			cis	89.3	142	32.6	-68.3	-5.3	0	0	0	114.1
1153	F	27.9	Very low	28.3	Very low	169 Å²	169	137.1 Å²	137.1	74%	0.741	75%	0.748	S	S	*	*			cis	-175.2	-160.8	-26.6	-144.5	-99.6	0	0	0	105.9
1154	N	29.2	Very low	28.3	Very low	96 Å²	96	135.9 Å²	135.9	51%	0.513	74%	0.742	S	S	.	*			trans	73.4	165.6	143.4	-75.7	-25.3	0	0	0	118
1155	L	30.1	Very low	28.1	Very low	138 Å²	138	132.4 Å²	132.4	72%	0.723	73%	0.734	S	S	*	*			cis	-119.6	167.4	-4.5	-106.5	113.4	0	0	0	108.5
1156	C	27.7	Very low	27.9	Very low	122 Å²	122	133.4 Å²	133.4	82%	0.824	73%	0.73	S	S	*	*			cis	-131.4	124.1	28.6	-61.6	0	0	0	0	115.3
1157	Q	25.6	Very low	27.7	Very low	138 Å²	138	133.9 Å²	133.9	65%	0.645	73%	0.728	S	S	*	*			trans	-79.2	-178.9	135.8	-60.5	166	-44.5	0	0	107.4
1158	T	28.4	Very low	27.5	Very low	116 Å²	116	134 Å²	134	71%	0.712	73%	0.728	S	S	*	*			cis	-153.5	145.5	25.8	39.2	0	0	0	0	107.3
1159	E	25.8	Very low	27.4	Very low	154 Å²	154	130.8 Å²	130.8	72%	0.72	72%	0.724	S	S	*	*				83.2	139.6	65.3	-144.8	-166.8	-91.2	0	0	115.7
1160	Q	25.8	Very low	27.4	Very low	156 Å²	156	131 Å²	131	73%	0.729	72%	0.721	S	S	*	*			trans	91.1	138.5	161.2	-51.8	-162	6.7	0	0	123.1
1161	C	25.8	Very low	27.4	Very low	128 Å²	128	137 Å²	137	87%	0.865	73%	0.733	S	S	*	*			trans	66.1	138.2	156.9	-66.6	0	0	0	0	122.3
1162	G	26.2	Very low	27.3	Very low	71 Å²	71	136.5 Å²	136.5	73%	0.732	73%	0.728	S	S	*	*			trans	124.5	53.1	142.4	0	0	0	0	0	121.2
1163	S	26.8	Very low	27.4	Very low	107 Å²	107	137 Å²	137	75%	0.748	74%	0.736	S	S	*	*			trans	27.5	123.9	144.6	59.3	0	0	0	0	122.8
1164	Q	25.8	Very low	27.5	Very low	165 Å²	165	135.4 Å²	135.4	77%	0.771	74%	0.735	S	S	*	*			trans	79.1	151.5	143.8	-63.3	179.5	-13.2	0	0	121.7
1165	F	27.1	Very low	27.4	Very low	182 Å²	182	137.6 Å²	137.6	80%	0.798	75%	0.745	S	S	*	*			trans	63.5	148.3	172.1	-58.2	-80.8	0	0	0	118.5
1166	S	24.5	Very low	27.3	Very low	91 Å²	91	137.1 Å²	137.1	64%	0.636	74%	0.744	S	S	*	*				178.5	141.1	-55.5	50.3	0	0	0	0	110.3
1167	V	27.7	Very low	27.6	Very low	120 Å²	120	138.9 Å²	138.9	73%	0.727	75%	0.745	S	S	*	*			trans	67.7	107.5	150.7	176.2	0	0	0	0	119
1168	N	26.6	Very low	27.9	Very low	142 Å²	142	136 Å²	136	76%	0.759	75%	0.745	S	S	*	*				46.2	141.1	127.6	-49.1	-17	0	0	0	120.5
1169	S	29	Very low	28	Very low	95 Å²	95	140.8 Å²	140.8	66%	0.664	75%	0.751	S	S	*	*				179.6	143.4	74.4	41.6	0	0	0	0	116.3
1170	H	29.6	Very low	28.3	Very low	164 Å²	164	138.1 Å²	138.1	76%	0.759	75%	0.75	S	S	*	*			trans	58.2	158.9	143.4	-58.2	-39.4	0	0	0	120.5
1171	R	27.4	Very low	29.1	Very low	220 Å²	220	135.8 Å²	135.8	83%	0.83	75%	0.748	S	S	*	*			cis	-153	143.5	7.6	-144.4	168.1	-175.5	176.6	1.5	113.1
1172	F	27	Very low	29.1	Very low	179 Å²	179	135.2 Å²	135.2	79%	0.785	74%	0.741	S	S	*	*			trans	2	144.3	151.1	-68.2	-109.2	0	0	0	121.7
1173	T	31.2	Very low	29.1	Very low	125 Å²	125	140.6 Å²	140.6	77%	0.767	74%	0.744	S	S	*	*				-159.4	143	110.8	24.2	0	0	0	0	112.8
1174	N	30.4	Very low	29	Very low	135 Å²	135	144.6 Å²	144.6	72%	0.722	75%	0.749	S	S	*	*			trans	43.3	126	148.9	-58.9	4.2	0	0	0	120.9
1175	L	27.9	Very low	28.9	Very low	141 Å²	141	144.6 Å²	144.6	74%	0.738	75%	0.748	S	S	*	*				76.2	109.6	62.5	-89.9	88.5	0	0	0	115.7
1176	D	28.2	Very low	28.8	Very low	128 Å²	128	141.3 Å²	141.3	68%	0.684	74%	0.743	S	S	*	*				53.2	119.1	125.9	-50.1	-17.7	0	0	0	121.7
1177	N	32.3	Very low	28.9	Very low	160 Å²	160	144 Å²	144	86%	0.856	75%	0.75	S	S	*	*				163.6	146.9	113.8	-85	-61.8	0	0	0	110.3
1178	A	33.2	Very low	28.9	Very low	78 Å²	78	146.1 Å²	146.1	65%	0.645	75%	0.752	S	S	*	*			cis	-163.4	163.4	-17.6	0	0	0	0	0	111.3
1179	Y	30.8	Very low	28.9	Very low	215 Å²	215	148.5 Å²	148.5	84%	0.843	76%	0.756	S	S	*	*			trans	-11.3	136.3	154.8	-65.6	-96.9	0	0	0	117.5
1180	S	31.7	Very low	29.4	Very low	98 Å²	98	148.5 Å²	148.5	69%	0.685	75%	0.753	S	S	*	*				62.5	161.5	67.2	102.1	0	0	0	0	114.4
1181	P	41	Very low	29.4	Very low	108 Å²	108	146.9 Å²	146.9	70%	0.701	75%	0.75	S	S	*	*			cis	-137.2	-156.7	5.5	37.9	-14.9	0	0	0	114.4
1182	T	27.1	Very low	29.7	Very low	116 Å²	116	142.6 Å²	142.6	71%	0.712	74%	0.739	S	S	*	*			trans	4.1	142.8	158.1	55.9	0	0	0	0	120.4
1183	K	26.3	Very low	29.9	Very low	183 Å²	183	141.1 Å²	141.1	80%	0.796	73%	0.733	S	S	*	*			cis	-164.9	163.4	8.7	-122.1	172.9	-178.8	175.8	0	108.8
1184	F	23.5	Very low	29.9	Very low	192 Å²	192	141.5 Å²	141.5	84%	0.842	73%	0.728	S	S	*	*			trans	72.8	143.5	178	-85.8	-90.4	0	0	0	118.6
1185	Q	25.4	Very low	30	Very low	164 Å²	164	142.1 Å²	142.1	77%	0.766	73%	0.727	S	S	*	*			trans	51.6	108.5	153.8	-88.8	173.1	-26.9	0	0	123.1
1186	T	24.4	Very low	30.2	Very low	113 Å²	113	142.3 Å²	142.3	69%	0.693	73%	0.729	S	S	*	*				51.1	124.5	127.4	52.8	0	0	0	0	123.3
1187	L	25.4	Very low	30.3	Very low	147 Å²	147	143 Å²	143	77%	0.77	73%	0.733	S	S	*	*			trans	79.8	133.3	138.5	-72.2	164.2	0	0	0	121
1188	E	28.9	Very low	30.1	Very low	166 Å²	166	139.8 Å²	139.8	78%	0.776	72%	0.722	S	S	*	*			trans	64.8	129.1	156.7	-64.6	165.7	-174.5	0	0	118.3
1189	K	26.4	Very low	29.8	Very low	192 Å²	192	141.8 Å²	141.8	84%	0.835	73%	0.73	S	S	*	*			cis	72	152.6	43.4	-80.2	-163.8	173.4	-175	0	114.3
1190	P	39.8	Very low	29.7	Very low	95 Å²	95	135.9 Å²	135.9	62%	0.617	72%	0.72	S	S	*	*			cis	-141.9	-166.6	-23.4	35.2	-14.2	0	0	0	114.3
1191	D	29.9	Very low	29.5	Very low	129 Å²	129	137.6 Å²	137.6	69%	0.69	72%	0.722	S	S	*	*			trans	75	157.9	142.5	-81.3	-44.6	0	0	0	119.5
1192	H	33	Very low	29.1	Very low	131 Å²	131	141.2 Å²	141.2	61%	0.606	73%	0.729	S	S	*	*			cis	-156	168.1	12	-127	16.9	0	0	0	107.9
1193	K	31.3	Very low	29	Very low	147 Å²	147	142.8 Å²	142.8	64%	0.639	73%	0.733	S	S	*	*			cis	-170.9	-172.5	-7	-148.2	179.1	-161.9	149	0	108.4
1194	I	31.8	Very low	29.6	Very low	133 Å²	133	138.6 Å²	138.6	68%	0.682	72%	0.724	S	S	*	*			trans	72.6	129.6	150.2	-74	159.3	0	0	0	117.3
1195	H	32.2	Very low	29.8	Very low	148 Å²	148	135.2 Å²	135.2	69%	0.685	72%	0.72	S	S	*	*			cis	-148.7	157.9	-14.4	-104.3	-50.2	0	0	0	106.4
1196	N	31.9	Very low	29.8	Very low	145 Å²	145	134.2 Å²	134.2	78%	0.775	72%	0.719	S	S	*	*			cis	-155.5	168.2	47.3	-128.3	-11.8	0	0	0	113.6
1197	N	29.3	Very low	30	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	73%	0.727	S	S	*	*			trans	-122.4	172.3	-173.2	-95.8	6.9	0	0	0	109.9
1198	S	29.4	Very low	30.2	Very low	91 Å²	91	136.9 Å²	136.9	64%	0.636	72%	0.722	S	S	*	*			cis	-178.5	168.1	-6	46.3	0	0	0	0	110.7
1199	C	26.9	Very low	30.4	Very low	120 Å²	120	134.6 Å²	134.6	81%	0.811	72%	0.722	S	S	*	*			trans	72.8	153.8	153.2	-69.7	0	0	0	0	119.7
1200	S	28.9	Very low	30.4	Very low	91 Å²	91	135 Å²	135	64%	0.636	72%	0.724	S	S	*	*			cis	-176.5	152.4	-15.1	51.9	0	0	0	0	114.9
1201	N	27.8	Very low	29.8	Very low	135 Å²	135	136 Å²	136	72%	0.722	73%	0.728	S	S	*	*			trans	78.9	143	145.6	-66.3	5.9	0	0	0	125.3
1202	H	31.3	Very low	29.5	Very low	184 Å²	184	138.1 Å²	138.1	85%	0.852	73%	0.731	S	S	*	*			trans	111.2	128.3	139.7	-73.9	-53.5	0	0	0	123.1
1203	D	26.3	Very low	29.1	Very low	149 Å²	149	141.6 Å²	141.6	80%	0.797	74%	0.74	S	S	*	*			trans	-89.3	-174.1	168.7	-113.2	-40.6	0	0	0	111.1
1204	P	37.9	Very low	28.9	Very low	94 Å²	94	140.7 Å²	140.7	61%	0.61	74%	0.742	S	S	*	*			cis	-141.7	171.5	-21	35.1	-15.3	0	0	0	116.7
1205	T	28.5	Very low	28.7	Very low	121 Å²	121	138.8 Å²	138.8	74%	0.742	74%	0.737	S	S	*	*			trans	65.6	142.1	143.5	51.9	0	0	0	0	125.9
1206	L	25.6	Very low	28.6	Very low	143 Å²	143	138 Å²	138	75%	0.749	74%	0.738	S	S	*	*			trans	70.1	105.1	142.9	-78.7	163.7	0	0	0	122.4
1207	Y	28.3	Very low	28.4	Very low	220 Å²	220	135.9 Å²	135.9	86%	0.863	73%	0.73	S	S	*	*				174.3	157.9	105.2	-109.2	-86.7	0	0	0	112
1208	S	29.1	Very low	28.6	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	73%	0.73	S	S	*	*			trans	-102.7	156.4	168.6	69.4	0	0	0	0	110.8
1209	P	34	Very low	28.8	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	73%	0.731	S	S	*	*				-152.5	156.3	97	39.2	-21.7	0	0	0	118
1210	F	25.2	Very low	29.1	Very low	200 Å²	200	136.1 Å²	136.1	88%	0.877	73%	0.728	S	S	*	*			trans	11.3	147	141.4	-86.9	-84.2	0	0	0	124.1
1211	V	27	Very low	29.3	Very low	115 Å²	115	138.6 Å²	138.6	70%	0.697	74%	0.74	S	S	*	*			trans	105.6	113.3	143.1	160.5	0	0	0	0	120.1
1212	K	24.5	Very low	29.4	Very low	175 Å²	175	135.4 Å²	135.4	76%	0.761	74%	0.739	S	S	*	*			trans	72.7	131.4	153.7	-77.4	178.8	178.4	-176.4	0	118.1
1213	Y	24.5	Very low	29.5	Very low	204 Å²	204	132.1 Å²	132.1	80%	0.8	74%	0.737	S	S	*	*				49.2	126.2	79.1	-73.3	-94.3	0	0	0	110.2
1214	D	26.7	Very low	29.7	Very low	127 Å²	127	130.5 Å²	130.5	68%	0.679	73%	0.732	S	S	*	*			cis	-160.4	176.7	13.8	-136.6	-16.8	0	0	0	105.9
1215	T	28	Very low	29.4	Very low	94 Å²	94	133.1 Å²	133.1	58%	0.577	74%	0.736	S	S	*	*			cis	177.3	176.5	32.4	3.7	0	0	0	0	107.7
1216	N	30.2	Very low	29.5	Very low	131 Å²	131	134 Å²	134	70%	0.701	73%	0.732	S	S	*	*			trans	70	150	138	-73.2	-2.4	0	0	0	122.7
1217	T	27.3	Very low	29.6	Very low	100 Å²	100	134.7 Å²	134.7	61%	0.613	74%	0.735	S	S	*	*			cis	-171.1	158.2	-30.7	27.7	0	0	0	0	107.6
1218	N	34.3	Very low	29.6	Very low	144 Å²	144	127.3 Å²	127.3	77%	0.77	73%	0.726	S	S	*	*				156.3	142.9	124.9	-81.1	-11	0	0	0	108.5
1219	S	32.4	Very low	29.5	Very low	92 Å²	92	132.4 Å²	132.4	64%	0.643	74%	0.736	S	S	*	*			cis	162.4	151.2	-2.3	55.8	0	0	0	0	104.5
1220	T	33.5	Very low	29.1	Very low	124 Å²	124	131.6 Å²	131.6	76%	0.761	73%	0.732	S	S	*	*			cis	-165.7	166.8	7.6	1	0	0	0	0	112.3
1221	T	33.8	Very low	29.2	Very low	143 Å²	143	128 Å²	128	88%	0.877	73%	0.727	S	S	*	*			trans	83.3	148.4	-177.9	72.3	0	0	0	0	114.4
1222	G	29.6	Very low	29.2	Very low	69 Å²	69	130.9 Å²	130.9	71%	0.711	73%	0.73	S	S	*	*			cis	157	162.3	-8.4	0	0	0	0	0	111.9
1223	S	32.6	Very low	29.3	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	73%	0.725	S	S	*	*			cis	-171.4	146.3	-6.5	-82.4	0	0	0	0	107.8
1224	V	31.2	Very low	29.3	Very low	116 Å²	116	127.3 Å²	127.3	70%	0.703	73%	0.725	S	S	*	*			cis	-163.8	150	-4.2	101.2	0	0	0	0	110.3
1225	H	30.8	Very low	29.3	Very low	149 Å²	149	127.6 Å²	127.6	69%	0.69	73%	0.732	S	S	*	*			trans	69	149.1	160.2	-73.8	-152.8	0	0	0	120.2
1226	Q	30.3	Very low	29.1	Very low	139 Å²	139	127.5 Å²	127.5	65%	0.65	74%	0.735	S	S	*	*			cis	-160.9	141.5	-7.8	-122.3	173.7	-43.2	0	0	113.1
1227	L	28.6	Very low	29	Very low	157 Å²	157	128 Å²	128	82%	0.822	74%	0.736	S	S	*	*			trans	50.5	149.1	147.7	-64	163.4	0	0	0	121
1228	G	28.4	Very low	28.9	Very low	65 Å²	65	129.9 Å²	129.9	67%	0.67	74%	0.743	S	S	*	*			cis	-163.4	-168.5	7	0	0	0	0	0	113.2
1229	F	27.4	Very low	28.7	Very low	204 Å²	204	128.7 Å²	128.7	90%	0.895	74%	0.741	S	S	*	*			trans	-103.8	146.1	-153.5	-84.3	-104.1	0	0	0	118.6
1230	C	24.5	Very low	28.5	Very low	101 Å²	101	129.5 Å²	129.5	68%	0.682	74%	0.738	S	S	*	*			trans	66.2	129	137.6	-76.8	0	0	0	0	126.1
1231	T	27.4	Very low	28.5	Very low	124 Å²	124	130.4 Å²	130.4	76%	0.761	74%	0.737	S	S	*	*			trans	75.2	105.2	134.6	53.8	0	0	0	0	123.2
1232	K	27.2	Very low	28.3	Very low	177 Å²	177	130 Å²	130	77%	0.77	73%	0.725	S	S	*	*				74.3	121.1	127.2	-87.4	-171.3	158	-139.3	0	122.8
1233	E	26.4	Very low	28.3	Very low	142 Å²	142	133.9 Å²	133.9	66%	0.664	72%	0.724	S	S	*	*				109.6	124.8	129.4	-82.9	172.8	-147.2	0	0	121.7
1234	M	25	Very low	28.1	Very low	161 Å²	161	132.8 Å²	132.8	79%	0.793	72%	0.716	S	S	*	*			trans	58.5	117.2	159.1	-66.6	-159.7	171.3	0	0	122.6
1235	T	26.5	Very low	27.7	Very low	133 Å²	133	136.6 Å²	136.6	82%	0.816	72%	0.723	S	S	*	*			trans	69	143.5	144.1	59.2	0	0	0	0	119.4
1236	S	24.6	Very low	28.2	Very low	93 Å²	93	134.3 Å²	134.3	65%	0.65	72%	0.722	S	S	*	*			cis	-171.6	-179.3	-14.4	54.8	0	0	0	0	110.9
1237	I	26.8	Very low	28.1	Very low	141 Å²	141	134.2 Å²	134.2	72%	0.723	73%	0.725	S	S	*	*			trans	83.9	111.3	155.2	-68.8	164.3	0	0	0	119
1238	N	25.9	Very low	28.1	Very low	140 Å²	140	136.5 Å²	136.5	75%	0.749	72%	0.724	S	S	*	*			trans	64.4	158.1	140	-68.6	11.3	0	0	0	121
1239	T	29.4	Very low	28	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.724	72%	0.719	S	S	*	*			cis	-155.7	162.4	0.8	3.7	0	0	0	0	109.2
1240	D	29.6	Very low	28	Very low	109 Å²	109	135.8 Å²	135.8	58%	0.583	71%	0.709	S	S	*	*			cis	-118.7	-106.3	-9	-169.1	-2.5	0	0	0	108.2	Q1242	D1240-Q1242 WeakPolarHBondContact OD2-CG 3.31Å; D1240-Q1242 PolarHBondContact OD2-NE2 3.41Å
1241	I	32.2	Very low	28.3	Very low	144 Å²	144	138.5 Å²	138.5	74%	0.738	72%	0.716	S	S	*	*			cis	-152.2	135.1	-25.9	-148.1	163.8	0	0	0	106
1242	Q	29.4	Very low	28.3	Very low	135 Å²	135	140.3 Å²	140.3	63%	0.631	72%	0.72	S	S	*	*			cis	-143.6	-175.3	-26.7	-116.5	168.3	31.6	0	0	105.9	D1240	D1240-Q1242 WeakPolarHBondContact OD2-CG 3.31Å; D1240-Q1242 PolarHBondContact OD2-NE2 3.41Å
1243	H	30.4	Very low	28.8	Very low	149 Å²	149	137 Å²	137	69%	0.69	72%	0.716	S	S	*	*			cis	-150.3	-168.8	20.1	-168.1	-111	0	0	0	110.5
1244	S	29.1	Very low	28.9	Very low	92 Å²	92	138 Å²	138	64%	0.643	72%	0.724	S	S	*	*			trans	3.4	105.8	164.4	55	0	0	0	0	120.2
1245	K	22.7	Very low	29	Very low	195 Å²	195	136.4 Å²	136.4	85%	0.848	72%	0.724	S	S	*	*			trans	-90.5	-135.6	133.5	-49.9	174.5	-178.5	176.4	0	107.5
1246	P	40.2	Very low	29.1	Very low	101 Å²	101	134.2 Å²	134.2	66%	0.656	72%	0.72	S	S	*	*				-125.4	-172.1	-52.1	23.7	-2.4	0	0	0	112.4
1247	I	29.1	Very low	29.2	Very low	138 Å²	138	134.9 Å²	134.9	71%	0.708	72%	0.724	S	S	*	*				162.3	119.5	109.5	-81.3	-167.4	0	0	0	115.6
1248	Y	28.8	Very low	29.1	Very low	205 Å²	205	133.2 Å²	133.2	80%	0.804	73%	0.725	S	S	*	*			trans	40.6	162.8	140.3	-65.7	-112.1	0	0	0	124.3
1249	N	26.4	Very low	29.2	Very low	107 Å²	107	133.4 Å²	133.4	57%	0.572	73%	0.725	S	S	*	*			cis	-176.4	164.4	-35.5	-160.9	3.4	0	0	0	111
1250	H	27.6	Very low	29	Very low	146 Å²	146	135.5 Å²	135.5	68%	0.676	73%	0.727	S	S	*	*			trans	59.2	114.4	155.8	-67.4	-31.9	0	0	0	122.6
1251	N	29.1	Very low	28.7	Very low	158 Å²	158	139.2 Å²	139.2	85%	0.845	74%	0.738	S	S	*	*				165.5	169	102.8	-90.1	-28.4	0	0	0	115.2
1252	I	27.9	Very low	28.7	Very low	162 Å²	162	137.9 Å²	137.9	83%	0.831	74%	0.739	S	S	*	*			trans	-146.5	157.4	-166.7	-61.8	171.1	0	0	0	107.8
1253	P	37	Very low	28.6	Very low	108 Å²	108	142 Å²	142	70%	0.701	75%	0.749	S	S	*	*			cis	-123.9	-169.1	-21.6	37.5	-20.9	0	0	0	112.7
1254	I	29.8	Very low	28.4	Very low	162 Å²	162	142.7 Å²	142.7	83%	0.831	75%	0.75	S	S	*	*				-171.4	166.7	122.9	-96.9	161.2	0	0	0	110.7
1255	T	27.4	Very low	28.1	Very low	129 Å²	129	146.3 Å²	146.3	79%	0.791	75%	0.754	S	S	*	*			trans	-98	162.8	-160.2	48.1	0	0	0	0	116.9
1256	A	28.1	Very low	28.3	Very low	87 Å²	87	145.1 Å²	145.1	72%	0.719	75%	0.752	S	S	*	*			trans	123.4	108.9	133.9	0	0	0	0	0	119.9
1257	S	26.4	Very low	27.6	Very low	106 Å²	106	143.7 Å²	143.7	74%	0.741	75%	0.748	S	S	*	*				64.7	101	126.6	-49.9	0	0	0	0	123.9
1258	S	25.7	Very low	27.6	Very low	106 Å²	106	143 Å²	143	74%	0.741	75%	0.75	S	S	*	*				80.2	147.4	118.1	72.3	0	0	0	0	124.4
1259	L	25.9	Very low	27.7	Very low	145 Å²	145	140.5 Å²	140.5	76%	0.759	75%	0.745	S	S	*	*			trans	83.6	95.7	152.4	-73.5	156.8	0	0	0	122.4
1260	Q	25.4	Very low	27.9	Very low	161 Å²	161	141.5 Å²	141.5	75%	0.752	75%	0.751	S	S	*	*				46	125.7	129.9	-65.9	-180	-31.9	0	0	123.4
1261	F	23.5	Very low	28.1	Very low	188 Å²	188	140.5 Å²	140.5	83%	0.825	75%	0.75	S	S	*	*			trans	31.8	146.2	133.7	-68.6	-77.3	0	0	0	121.9
1262	P	33.6	Very low	28.3	Very low	116 Å²	116	139 Å²	139	75%	0.753	74%	0.743	S	S	*	*			cis	-154.6	150.2	42.5	40.6	-18.2	0	0	0	121.2
1263	R	26.3	Very low	28.6	Very low	222 Å²	222	136.4 Å²	136.4	84%	0.838	73%	0.73	S	S	*	*				38.4	117.3	122.2	-150.7	-170	-143	-179	6.6	121.1
1264	K	25.7	Very low	28.4	Very low	163 Å²	163	137.3 Å²	137.3	71%	0.709	73%	0.729	S	S	*	*				154.1	135.3	118.7	-88	-159.3	179	-172.8	0	117.4
1265	F	23.8	Very low	28.4	Very low	168 Å²	168	139 Å²	139	74%	0.737	73%	0.73	S	S	*	*			trans	61.1	157.6	134.8	-74	-128	0	0	0	118.7
1266	Q	26.1	Very low	28.4	Very low	170 Å²	170	138.5 Å²	138.5	79%	0.794	73%	0.727	S	S	*	*			cis	-157.2	-166.6	-2.6	-136.1	179.2	-37.9	0	0	107.9
1267	A	25.2	Very low	28.4	Very low	70 Å²	70	141.6 Å²	141.6	58%	0.579	73%	0.727	S	S	*	*			cis	-163.7	-159.9	-1.1	0	0	0	0	0	109
1268	V	30.7	Very low	28.5	Very low	124 Å²	124	142.3 Å²	142.3	75%	0.752	72%	0.722	S	S	*	*			trans	81.7	93.8	162.9	-168.5	0	0	0	0	115.5
1269	H	30.6	Very low	28.6	Very low	153 Å²	153	143.9 Å²	143.9	71%	0.708	72%	0.722	S	S	*	*				69.4	135.3	78.9	-75.6	-69.6	0	0	0	113.4
1270	N	30.6	Very low	28.7	Very low	127 Å²	127	140.9 Å²	140.9	68%	0.679	71%	0.713	S	S	*	*			cis	-147	175.9	7.1	-81	-46.8	0	0	0	107.9
1271	N	32.1	Very low	28.8	Very low	125 Å²	125	138.3 Å²	138.3	67%	0.668	71%	0.713	S	S	*	*			cis	-169.7	-177.4	-29.3	-83.9	-7.2	0	0	0	104
1272	N	32.8	Very low	29.1	Very low	128 Å²	128	136.6 Å²	136.6	68%	0.684	71%	0.712	S	S	*	*			cis	-157.4	179.8	6.5	-142.6	13.4	0	0	0	106.6
1273	N	33.3	Very low	28.8	Very low	107 Å²	107	140.2 Å²	140.2	57%	0.572	72%	0.716	S	S	*	*			cis	-159.3	-178.1	3.3	-160.6	5.9	0	0	0	109.2
1274	N	32.4	Very low	28.7	Very low	126 Å²	126	141.7 Å²	141.7	67%	0.674	72%	0.722	S	S	*	*	S	Bend	trans	37.5	110.5	152.3	-69.8	-9.8	0	0	0	119.3
1275	K	31.3	Very low	28.6	Very low	197 Å²	197	140 Å²	140	86%	0.857	72%	0.719	S	S	*	*			cis	-142.6	139.1	2.8	-84.4	-173.7	174	-178.1	0	111.8
1276	T	26.6	Very low	28.7	Very low	119 Å²	119	138 Å²	138	73%	0.73	73%	0.726	S	S	*	*			trans	-78.5	172.8	164.3	43.7	0	0	0	0	111.3
1277	E	28.1	Very low	28.5	Very low	153 Å²	153	136.2 Å²	136.2	72%	0.715	72%	0.721	S	S	*	*			cis	-157.2	175.7	-2	-120.4	160.6	-74.9	0	0	106
1278	N	27.8	Very low	28.5	Very low	120 Å²	120	141.9 Å²	141.9	64%	0.642	74%	0.738	S	S	*	*			cis	-153.7	-159.6	10.6	-132.2	-37.3	0	0	0	107.2
1279	L	28	Very low	28.1	Very low	139 Å²	139	143.5 Å²	143.5	73%	0.728	74%	0.737	S	S	*	*			cis	-154.6	-163.9	3.3	-135	-176.1	0	0	0	109.7	S1281	L1279-S1281 PolarHBondContact O-N 3.49Å
1280	S	28.6	Very low	27.9	Very low	83 Å²	83	142.5 Å²	142.5	58%	0.58	74%	0.741	S	S	*	*			trans	-17.8	108.1	161.2	51.5	0	0	0	0	116.9
1281	S	27.1	Very low	27.5	Very low	106 Å²	106	143.5 Å²	143.5	74%	0.741	74%	0.742	S	S	*	*				83.3	131.3	87	70.9	0	0	0	0	113.7	L1279	L1279-S1281 PolarHBondContact O-N 3.49Å
1282	D	29.7	Very low	27.1	Very low	152 Å²	152	144.9 Å²	144.9	81%	0.813	74%	0.744	S	S	*	*			cis	-152.1	178.1	47.1	-152.7	-2.7	0	0	0	115.3
1283	K	28.3	Very low	26.7	Very low	192 Å²	192	144.2 Å²	144.2	84%	0.835	75%	0.75	S	S	*	*			trans	74.1	114	175.9	-70.4	-175.4	176.2	177.1	0	118.8
1284	W	24.1	Very low	26.3	Very low	254 Å²	254	143.6 Å²	143.6	96%	0.962	76%	0.759	S	S	*	*			trans	-89.7	160.9	164.9	-104.4	54.9	0	0	0	112.8
1285	I	24.1	Very low	26.1	Very low	128 Å²	128	143.4 Å²	143.4	66%	0.656	77%	0.765	S	S	*	*			trans	-90.1	153	175.9	-66.2	166.6	0	0	0	110.6	L1287	I1285-L1287 HydrophobicContact CG2-CD1 3.73Å
1286	S	25.9	Very low	25.9	Very low	125 Å²	125	138.9 Å²	138.9	87%	0.874	76%	0.764	S	S	*	*			trans	-150.1	96.9	150.5	-76.3	0	0	0	0	111.2
1287	L	22.2	Very low	25.8	Very low	133 Å²	133	138.5 Å²	138.5	70%	0.696	77%	0.766	S	S	*	*			trans	-79.7	147.6	155.8	-82.5	82.9	0	0	0	109.1	I1285	I1285-L1287 HydrophobicContact CG2-CD1 3.73Å
1288	M	24.4	Very low	26	Very low	188 Å²	188	136.2 Å²	136.2	93%	0.926	77%	0.765	S	S	*	*			trans	-144.4	133.8	147.7	-100.1	-65.4	179.4	0	0	108.6
1289	H	22.3	Very low	25.9	Very low	158 Å²	158	137.1 Å²	137.1	73%	0.731	77%	0.769	S	S	*	*			trans	-83.6	162.3	172.5	-83	70.8	0	0	0	110.7
1290	V	26.7	Very low	25.7	Very low	133 Å²	133	136.9 Å²	136.9	81%	0.806	77%	0.769	S	S	*	*				-176.4	154.7	116.5	147	0	0	0	0	109.8
1291	Q	22.8	Very low	25.6	Very low	148 Å²	148	143.4 Å²	143.4	69%	0.692	78%	0.782	S	S	*	*			trans	-76.3	-178.5	-177.7	-52.9	133.3	-68	0	0	111.4
1292	H	23.4	Very low	25.6	Very low	154 Å²	154	147.9 Å²	147.9	71%	0.713	79%	0.789	S	S	*	*			cis	-162.8	173.3	25.9	-119.1	-61.5	0	0	0	111.6
1293	S	24.9	Very low	25.3	Very low	114 Å²	114	146.2 Å²	146.2	80%	0.797	79%	0.789	S	S	*	*			trans	70.8	133.5	155.3	50.1	0	0	0	0	120.9
1294	A	24.5	Very low	25.1	Very low	94 Å²	94	145.2 Å²	145.2	78%	0.777	79%	0.788	S	S	*	*			trans	-89.7	171	164.7	0	0	0	0	0	110.5
1295	P	28.4	Very low	25.2	Very low	122 Å²	122	143.1 Å²	143.1	79%	0.792	78%	0.78	S	S	*	*				-151.5	175.1	75.9	41.3	-22.8	0	0	0	117.4
1296	A	26.6	Very low	25.2	Very low	102 Å²	102	146.8 Å²	146.8	84%	0.843	79%	0.787	S	S	*	*			trans	70.9	142	155.2	0	0	0	0	0	120.8
1297	S	25.1	Very low	25.1	Very low	110 Å²	110	150.3 Å²	150.3	77%	0.769	79%	0.786	S	S	*	*			trans	-89.7	175.4	164.8	63	0	0	0	0	110.6
1298	P	31	Very low	25.2	Very low	106 Å²	106	149.4 Å²	149.4	69%	0.688	79%	0.786	S	S	*	*				-154.3	173.5	82.7	42.5	-23.4	0	0	0	117.9
1299	N	26.1	Very low	25.3	Very low	138 Å²	138	148.5 Å²	148.5	74%	0.738	78%	0.783	S	S	*	*			trans	74	114.4	152.7	-69.2	11.9	0	0	0	122.6
1300	D	24.4	Very low	25.4	Very low	135 Å²	135	146.2 Å²	146.2	72%	0.722	78%	0.777	S	S	*	*				33.5	117.1	112.7	-62.1	-42.5	0	0	0	119.9
1301	Y	25.9	Very low	25.2	Very low	219 Å²	219	146.2 Å²	146.2	86%	0.859	77%	0.768	S	S	*	*				-165.1	88.7	118.5	-120.1	-77	0	0	0	111.6
1302	F	27.9	Very low	25.3	Very low	200 Å²	200	150.8 Å²	150.8	88%	0.877	78%	0.781	S	S	*	*			trans	174.6	90.9	136.9	-108.1	-75.1	0	0	0	110.9
1303	S	22.5	Very low	25.2	Very low	117 Å²	117	149.7 Å²	149.7	82%	0.818	78%	0.776	S	S	*	*			trans	-140	91	165.1	-173.6	0	0	0	0	109.4
1304	Q	25.1	Very low	25.1	Very low	172 Å²	172	150.7 Å²	150.7	80%	0.804	77%	0.769	S	S	*	*			trans	-167.2	133.5	167	-117.7	174.7	60.5	0	0	111.4
1305	R	24.9	Very low	25.1	Very low	210 Å²	210	151.8 Å²	151.8	79%	0.792	76%	0.762	S	S	*	*			trans	67.9	122	-178	-55.1	-178.6	176.6	178.9	-1.7	113.3
1306	Y	25.6	Very low	24.9	Very low	205 Å²	205	155.2 Å²	155.2	80%	0.804	76%	0.759	S	S	*	*	S	Bend	cis	-134.8	168.8	15.7	-95.3	-85.6	0	0	0	113.4
1307	K	23.5	Very low	24.8	Very low	198 Å²	198	156.2 Å²	156.2	86%	0.861	75%	0.751	S	S	*	*			trans	75.1	141	-172.6	-52.4	178.2	-178.5	176.8	0	112.4
1308	T	23.7	Very low	24.9	Very low	114 Å²	114	156.8 Å²	156.8	70%	0.699	74%	0.743	S	S	*	*			cis	-145.4	158.4	6.1	-21.7	0	0	0	0	110.4
1309	I	25.6	Very low	24.8	Very low	169 Å²	169	157.8 Å²	157.8	87%	0.867	75%	0.75	S	S	*	*			trans	-158	133.9	131.6	-103.9	159.6	0	0	0	107.3
1310	D	24.2	Very low	24.7	Very low	111 Å²	111	157.9 Å²	157.9	59%	0.594	75%	0.75	S	S	*	*			trans	-89	157.3	178.1	-105.6	-76.8	0	0	0	111.9
1311	Q	22.9	Very low	24.8	Very low	132 Å²	132	160.7 Å²	160.7	62%	0.617	76%	0.759	S	S	*	*			trans	26.9	123.3	145.6	-61.8	166.9	57.5	0	0	119.4
1312	Y	24.5	Very low	24.7	Very low	245 Å²	245	158.5 Å²	158.5	96%	0.961	75%	0.754	S	S	*	*				-112	116.4	129.3	-111.4	-81.7	0	0	0	109.7
1313	Q	22.2	Very low	24.5	Very low	131 Å²	131	157.7 Å²	157.7	61%	0.612	75%	0.747	S	S	*	*			trans	-96.4	137.3	176.6	-105.9	-161.6	16.9	0	0	111.9
1314	M	22.7	Very low	24.6	Very low	134 Å²	134	160.8 Å²	160.8	66%	0.66	75%	0.748	S	S	*	*			trans	70.8	152.7	145.2	-65	-162.1	-175.6	0	0	122
1315	N	23.9	Very low	24.4	Very low	117 Å²	117	158.3 Å²	158.3	63%	0.626	74%	0.739	S	S	*	*			trans	82.7	133.7	147.8	-65.8	-23.4	0	0	0	119.5
1316	R	24.1	Very low	24.5	Very low	195 Å²	195	156.5 Å²	156.5	74%	0.736	74%	0.744	S	S	*	*			cis	-169.2	171.3	-13	-131.6	177.7	-137.1	-161.8	3	113.1
1317	N	25.2	Very low	24.4	Very low	123 Å²	123	154.7 Å²	154.7	66%	0.658	74%	0.743	S	S	*	*			trans	76	132.9	154.5	-62.1	-8.7	0	0	0	118
1318	I	26.7	Very low	24.7	Very low	121 Å²	121	150.2 Å²	150.2	62%	0.621	74%	0.735	S	S	*	*			cis	111.2	122.7	25.4	-78.4	168.7	0	0	0	111.2	N1320	I1318-N1320 HydrophobicContact CG2-CB 4.36Å
1319	P	29.3	Very low	24.9	Very low	127 Å²	127	153.1 Å²	153.1	83%	0.825	74%	0.74	S	S	*	*				-128.3	135.5	110.5	8.2	12.9	0	0	0	111.5
1320	N	24.7	Very low	24.9	Very low	140 Å²	140	152.7 Å²	152.7	75%	0.749	73%	0.734	S	S	*	*			cis	98.5	100.6	44.4	-90.5	-16.6	0	0	0	114.4	I1318	I1318-N1320 HydrophobicContact CG2-CB 4.36Å
1321	Q	26.6	Very low	24.8	Very low	195 Å²	195	153.1 Å²	153.1	91%	0.911	74%	0.744	S	S	*	*			trans	-152.8	162.1	152.6	-70.5	-164.7	-2.2	0	0	110.6
1322	K	24.2	Very low	24.7	Very low	172 Å²	172	152.5 Å²	152.5	75%	0.748	75%	0.754	S	S	*	*				-157.9	92.8	-74.5	-120.9	-139.1	173.1	-162.4	0	113
1323	Y	22.7	Very low	24.6	Very low	184 Å²	184	147.7 Å²	147.7	72%	0.722	74%	0.744	S	S	*	*			trans	63	173.6	164.7	-55.7	-89.3	0	0	0	115.3	I1325	Y1323-I1325 HydrophobicContact CD1-CD1 3.72Å; Y1323-I1325 HydrophobicContact CD1-CG1 4.44Å; Y1323-I1325 HydrophobicContact CE1-CD1 4.24Å
1324	E	23.5	Very low	24.8	Very low	181 Å²	181	148.5 Å²	148.5	85%	0.846	75%	0.753	S	S	*	*			cis	-126.9	149.2	3.4	-69.4	174.5	135.8	0	0	108.7
1325	I	22.6	Very low	24.9	Very low	121 Å²	121	149.1 Å²	149.1	62%	0.621	75%	0.754	S	S	*	*			cis	77.8	103.3	49.8	-58.7	179.7	0	0	0	115.3	Y1323 Q1327	Y1323-I1325 HydrophobicContact CD1-CD1 3.72Å; Y1323-I1325 HydrophobicContact CD1-CG1 4.44Å; Y1323-I1325 HydrophobicContact CE1-CD1 4.24Å; I1325-Q1327 HydrophobicContact CG2-CG 4.18Å
1326	L	25.7	Very low	25	Very low	171 Å²	171	153.1 Å²	153.1	90%	0.895	76%	0.762	S	S	*	*			trans	-165.6	94.4	149.3	-97.1	171.7	0	0	0	106.2
1327	Q	23.4	Very low	25.4	Very low	168 Å²	168	151.6 Å²	151.6	79%	0.785	77%	0.768	S	S	*	*				74	138.1	73.3	-76.3	-91.8	-11.1	0	0	115.3	I1325	I1325-Q1327 HydrophobicContact CG2-CG 4.18Å
1328	P	30.5	Very low	25.5	Very low	104 Å²	104	152.9 Å²	152.9	68%	0.675	78%	0.775	S	S	*	*			trans	-128.7	162.6	-158.2	41.7	-25.3	0	0	0	117.4
1329	H	27.1	Very low	25.6	Very low	174 Å²	174	156.1 Å²	156.1	81%	0.806	78%	0.784	S	S	*	*			trans	-144	159	166	-67.5	-11.5	0	0	0	108.8
1330	Q	26.4	Very low	25.5	Very low	161 Å²	161	157.3 Å²	157.3	75%	0.752	78%	0.782	S	S	*	*			cis	-166.6	160	-24.2	-106.8	176.9	-11.9	0	0	107.4
1331	C	21.1	Very low	25.6	Very low	120 Å²	120	156.6 Å²	156.6	81%	0.811	79%	0.788	S	S	*	*			trans	18	152.4	146.4	-58.7	0	0	0	0	122.7
1332	S	22.6	Very low	25.6	Very low	118 Å²	118	152.7 Å²	152.7	83%	0.825	78%	0.778	S	S	*	*			cis	-168.1	-178.7	-5.4	48.8	0	0	0	0	111.2
1333	I	21.7	Very low	25.6	Very low	144 Å²	144	150.2 Å²	150.2	74%	0.738	78%	0.782	S	S	*	*			trans	-80	145.8	173.7	-63.8	155.7	0	0	0	110.7
1334	D	25.5	Very low	26	Very low	149 Å²	149	146.6 Å²	146.6	80%	0.797	78%	0.781	S	S	*	*				-171.2	172.1	118.5	-130.3	-33.3	0	0	0	115.3
1335	E	24.5	Very low	26	Very low	147 Å²	147	145.4 Å²	145.4	69%	0.687	78%	0.78	S	S	*	*			trans	-88.7	176.9	-166.6	-60	-178.8	154.6	0	0	116.3
1336	Y	27	Very low	26.2	Very low	201 Å²	201	149.5 Å²	149.5	79%	0.788	79%	0.794	S	S	*	*			trans	58	93.3	167.4	-66.9	-86.6	0	0	0	119.4
1337	N	32.7	Very low	26.2	Very low	163 Å²	163	144.8 Å²	144.8	87%	0.872	78%	0.779	S	S	*	*				-175.2	167.1	113.3	-101.2	-65.2	0	0	0	114
1338	N	28.1	Very low	26.4	Very low	150 Å²	150	145.1 Å²	145.1	80%	0.802	79%	0.787	S	S	*	*			trans	-90.5	145.4	-166.5	-83.3	-69.6	0	0	0	116.3
1339	K	27.8	Very low	26.3	Very low	188 Å²	188	143.2 Å²	143.2	82%	0.817	79%	0.786	S	S	*	*			trans	71.2	109.8	170.6	-63.9	-177.8	176	179.8	0	116.1
1340	I	27.2	Very low	26.1	Very low	153 Å²	153	143 Å²	143	79%	0.785	79%	0.79	S	S	*	*				87.2	111.7	57.2	-67.8	164.3	0	0	0	114	V1342	I1340-V1342 HydrophobicContact CG2-CG2 3.92Å
1341	S	26.2	Very low	26.1	Very low	124 Å²	124	143.5 Å²	143.5	87%	0.867	79%	0.794	S	S	*	*			trans	-148.2	164	136.8	64.4	0	0	0	0	109.4
1342	V	26.3	Very low	26.4	Very low	114 Å²	114	148.1 Å²	148.1	69%	0.691	80%	0.8	S	S	*	*			trans	-129.6	145	-132.2	-167	0	0	0	0	115.6	I1340 P1344	I1340-V1342 HydrophobicContact CG2-CG2 3.92Å; V1342-P1344 HydrophobicContact CG1-CB 4.14Å
1343	S	25.6	Very low	26.5	Very low	120 Å²	120	150 Å²	150	84%	0.839	80%	0.8	S	S	*	*			trans	-149.2	140.4	144.4	-142.7	0	0	0	0	108.7
1344	P	29.8	Very low	26.7	Very low	107 Å²	107	150.2 Å²	150.2	70%	0.695	80%	0.803	S	S	*	*				-122.1	135.8	-113.6	36.8	-27.2	0	0	0	116.8	V1342	V1342-P1344 HydrophobicContact CG1-CB 4.14Å
1345	N	25.2	Very low	26.8	Very low	156 Å²	156	150.5 Å²	150.5	83%	0.834	81%	0.805	S	S	*	*			trans	-152.2	121.7	161.3	-129.1	-14.4	0	0	0	108.8
1346	F	25.5	Very low	26.8	Very low	208 Å²	208	151.1 Å²	151.1	91%	0.912	81%	0.809	S	S	*	*			trans	51.8	144.8	172.4	-97.2	-120.2	0	0	0	119.3
1347	A	26.2	Very low	26.9	Very low	71 Å²	71	149.2 Å²	149.2	59%	0.587	81%	0.807	S	S	*	*			cis	-164.5	158.6	-23	0	0	0	0	0	109.1
1348	N	28.2	Very low	26.5	Very low	176 Å²	176	148.5 Å²	148.5	94%	0.941	80%	0.803	S	S	*	*			trans	-172.6	149.1	159.6	-97.8	-43	0	0	0	108.5
1349	G	27.1	Very low	26.6	Very low	63 Å²	63	147 Å²	147	65%	0.649	80%	0.804	S	S	*	*			cis	171.5	108.8	-7.1	0	0	0	0	0	112.5
1350	L	23.9	Very low	26.6	Very low	170 Å²	170	145.9 Å²	145.9	89%	0.89	81%	0.807	S	S	*	*			trans	53.9	149.2	157.5	-87.3	163.2	0	0	0	122.9
1351	M	25.6	Very low	26.7	Very low	172 Å²	172	143.7 Å²	143.7	85%	0.847	80%	0.803	S	S	*	*			trans	65.2	104.6	160.7	-69.8	-169.8	169.7	0	0	120.6
1352	K	26.9	Very low	26.9	Very low	217 Å²	217	144.8 Å²	144.8	94%	0.943	80%	0.799	S	S	*	*				-151.7	100	105.1	-115.6	177.4	-176.7	179.5	0	113
1353	L	24.8	Very low	27	Very low	157 Å²	157	146.1 Å²	146.1	82%	0.822	80%	0.801	S	S	*	*			trans	-94.2	140.9	149.4	-90	162.9	0	0	0	107.4
1354	N	26	Very low	26.9	Very low	149 Å²	149	146.1 Å²	146.1	80%	0.797	80%	0.796	S	S	*	*			trans	169.9	125.3	130.7	-88.8	-5.8	0	0	0	112.4
1355	N	27.5	Very low	26.8	Very low	155 Å²	155	150.8 Å²	150.8	83%	0.829	81%	0.805	S	S	*	*			trans	-170.7	128.1	133.9	-89.8	-13.6	0	0	0	104
1356	M	26.3	Very low	26.8	Very low	159 Å²	159	150.1 Å²	150.1	78%	0.783	81%	0.807	S	S	*	*	S	Bend	cis	-119.4	146.7	19.4	-72.8	156.4	-74.5	0	0	113.1
1357	E	28	Very low	26.6	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.752	80%	0.804	S	S	*	*				30.9	142.9	123.9	-50.8	-170.7	131.3	0	0	119.6
1358	L	25.1	Very low	26.3	Very low	148 Å²	148	151.5 Å²	151.5	78%	0.775	81%	0.813	S	S	*	*			cis	161.3	118.5	-14.3	-111.9	167.2	0	0	0	105
1359	S	29.5	Very low	26.1	Very low	119 Å²	119	150.1 Å²	150.1	83%	0.832	81%	0.805	S	S	*	*			trans	173	96.8	134.4	38.1	0	0	0	0	114
1360	N	28	Very low	25.9	Very low	165 Å²	165	153.8 Å²	153.8	88%	0.882	81%	0.809	S	S	*	*			trans	45.4	151.7	153.3	-87.8	3	0	0	0	124.3
1361	P	28.7	Very low	26.1	Very low	106 Å²	106	153.6 Å²	153.6	69%	0.688	81%	0.809	S	S	*	*			trans	-110.7	171.4	-169.9	42.6	-34.4	0	0	0	114.5
1362	N	29.8	Very low	26	Very low	148 Å²	148	152.2 Å²	152.2	79%	0.791	80%	0.798	S	S	*	*			trans	-161	146.7	136.9	-115.2	-26.6	0	0	0	114.2
1363	I	30	Very low	26	Very low	141 Å²	141	148 Å²	148	72%	0.723	80%	0.796	S	S	*	*			trans	61.8	103.5	152.1	-57.7	168	0	0	0	119
1364	T	23.3	Very low	25.9	Very low	121 Å²	121	147.8 Å²	147.8	74%	0.742	80%	0.795	S	S	*	*			trans	-13.6	132.3	148.5	54.3	0	0	0	0	119.8
1365	K	26.6	Very low	25.9	Very low	205 Å²	205	147.9 Å²	147.9	89%	0.891	80%	0.795	S	S	*	*				-167.3	169.4	104.6	-106.4	179.8	179	-176.4	0	112.4
1366	T	24.9	Very low	25.6	Very low	142 Å²	142	149.5 Å²	149.5	87%	0.871	79%	0.791	S	S	*	*			trans	-93.5	161.6	-162.9	-40	0	0	0	0	113.9
1367	F	21.7	Very low	25.5	Very low	194 Å²	194	148.7 Å²	148.7	85%	0.851	79%	0.788	S	S	*	*			trans	-75.6	152.4	-170.3	-82.1	-105.6	0	0	0	117.3
1368	C	20.7	Very low	25.6	Very low	114 Å²	114	146.6 Å²	146.6	77%	0.77	79%	0.786	S	S	*	*			trans	-153.2	146.2	142.2	-84.5	0	0	0	0	104.9
1369	L	23.7	Very low	25.7	Very low	146 Å²	146	145.1 Å²	145.1	76%	0.764	79%	0.786	S	S	*	*			cis	-148.1	-173	7.5	-111.7	158.4	0	0	0	110.6
1370	D	22.9	Very low	25.5	Very low	140 Å²	140	149.6 Å²	149.6	75%	0.749	79%	0.79	S	S	*	*			trans	-46.7	163.3	-174.1	-58.6	-40.7	0	0	0	119.7
1371	D	27.9	Very low	25.4	Very low	167 Å²	167	145 Å²	145	89%	0.893	78%	0.782	S	S	*	*				-156.8	161.7	127.8	-136.8	-25.6	0	0	0	113.8
1372	K	24.6	Very low	25.3	Very low	142 Å²	142	147.3 Å²	147.3	62%	0.617	79%	0.787	S	S	*	*			trans	-122.8	144.8	-176.2	-62.1	174.5	-172	164.8	0	113.5	V205	V205-K1372 HydrophobicContact CG1-CD 4.11Å
1373	S	25.8	Very low	25	Very low	128 Å²	128	147.1 Å²	147.1	90%	0.895	79%	0.785	S	S	*	*			trans	-164	147.5	156.3	-87.9	0	0	0	0	114.1
1374	L	23.2	Very low	24.8	Very low	154 Å²	154	150 Å²	150	81%	0.806	79%	0.792	S	S	*	*			trans	-91.7	164.5	-172	-58.4	91.7	0	0	0	114.5
1375	L	25.1	Very low	24.8	Very low	150 Å²	150	147.4 Å²	147.4	79%	0.785	79%	0.79	S	S	*	*				-155.7	147.7	127.2	-152.4	70.7	0	0	0	112.5	I1377	L1375-I1377 HydrophobicContact CD2-CD1 4.13Å; L1375-I1377 HydrophobicContact CD2-CG1 4.39Å
1376	Y	21.3	Very low	24.7	Very low	190 Å²	190	143.9 Å²	143.9	75%	0.745	79%	0.79	S	S	*	*			trans	-139.4	139.5	169.6	-126.1	-80.7	0	0	0	109.5	I207	I207-Y1376 HydrophobicContact CG2-CE2 4.25Å
1377	I	25.8	Very low	24.7	Very low	142 Å²	142	144.5 Å²	144.5	73%	0.728	79%	0.786	S	S	*	*			trans	-139.6	142.7	174.9	-60.7	179.9	0	0	0	108.9	L1375	L1375-I1377 HydrophobicContact CD2-CD1 4.13Å; L1375-I1377 HydrophobicContact CD2-CG1 4.39Å
1378	T	28.6	Very low	24.9	Very low	116 Å²	116	141.8 Å²	141.8	71%	0.712	79%	0.786	S	S	*	*			trans	-134.6	157.3	168.2	66.2	0	0	0	0	110
1379	P	28.7	Very low	25	Very low	118 Å²	118	144.9 Å²	144.9	77%	0.766	79%	0.789	S	S	*	*				-148.4	132	127.7	33	-15.1	0	0	0	116.9
1380	K	24.8	Very low	25.3	Very low	213 Å²	213	146.2 Å²	146.2	93%	0.926	80%	0.796	S	S	*	*			trans	31.3	131.4	141.8	-61.3	-176.9	176.8	-178.9	0	122.6
1381	G	26.3	Very low	25.4	Very low	69 Å²	69	146.7 Å²	146.7	71%	0.711	80%	0.799	S	S	*	*			trans	166.3	75.7	159.5	0	0	0	0	0	114.1
1382	I	26	Very low	25.4	Very low	154 Å²	154	148 Å²	148	79%	0.79	80%	0.799	S	S	*	*				88.3	108.9	93.4	-71.5	173.3	0	0	0	116.1
1383	L	24	Very low	25.7	Very low	144 Å²	144	148 Å²	148	75%	0.754	81%	0.806	S	S	*	*			trans	63.1	131	148.4	-70.8	172.5	0	0	0	125
1384	K	24.8	Very low	25.7	Very low	200 Å²	200	146.2 Å²	146.2	87%	0.87	79%	0.794	S	S	*	*			trans	65.3	148.8	149.1	-65.3	176.5	177.1	-174.2	0	118.6
1385	G	23.4	Very low	26.2	Very low	68 Å²	68	146.4 Å²	146.4	70%	0.701	79%	0.79	S	S	*	*			cis	164.1	153.6	-9.5	0	0	0	0	0	114
1386	C	24.4	Very low	26.4	Very low	131 Å²	131	149.5 Å²	149.5	89%	0.885	79%	0.791	S	S	*	*			trans	62.6	107.1	164.1	-59.8	0	0	0	0	121.7
1387	I	24.7	Very low	26.9	Very low	155 Å²	155	146.6 Å²	146.6	80%	0.795	79%	0.789	S	S	*	*			trans	-3.7	133.9	135.3	-58.2	155.3	0	0	0	118.1
1388	T	27.1	Very low	27.2	Very low	137 Å²	137	145.4 Å²	145.4	84%	0.84	78%	0.784	S	S	*	*				-151.4	132.3	128.5	44.7	0	0	0	0	110.7
1389	E	22.9	Very low	27.5	Very low	179 Å²	179	145.5 Å²	145.5	84%	0.836	78%	0.78	S	S	*	*			trans	-84.4	151.1	164.6	-62.3	166.5	128.5	0	0	110.4
1390	L	28.5	Very low	27.9	Very low	174 Å²	174	146.8 Å²	146.8	91%	0.911	78%	0.78	S	S	*	*			trans	-152.8	124.4	155.4	-93.1	-179.2	0	0	0	109.4
1391	D	24.5	Very low	28.4	Very low	150 Å²	150	143 Å²	143	80%	0.802	77%	0.77	S	S	*	*			trans	-73	150.4	163.5	-76.1	-57.1	0	0	0	110.8
1392	E	28.6	Very low	28.9	Very low	195 Å²	195	145.1 Å²	145.1	91%	0.911	77%	0.765	S	S	*	*				-161.4	146	126.2	-116.6	176.1	-156.2	0	0	115.1
1393	N	30.4	Very low	29.4	Very low	142 Å²	142	144 Å²	144	76%	0.759	76%	0.761	S	S	*	*			trans	-75.8	133.7	-160.1	-71.5	-79.2	0	0	0	117.3
1394	S	26.9	Very low	30	Very low	90 Å²	90	142.9 Å²	142.9	63%	0.629	76%	0.756	S	S	*	*				44.7	130.1	128.8	81.6	0	0	0	0	122.9
1395	H	32.6	Very low	30.5	Very low	157 Å²	157	139.6 Å²	139.6	73%	0.727	75%	0.748	S	S	*	*				-173.9	127.7	117.3	-93.6	12.8	0	0	0	108.2
1396	R	30.8	Very low	31.3	Very low	215 Å²	215	142.9 Å²	142.9	81%	0.811	75%	0.749	S	S	*	*				55.7	134.6	85.3	-71.7	-174.3	178	-177.7	0.5	114.9
1397	N	31.6	Very low	31.9	Very low	130 Å²	130	142.6 Å²	142.6	70%	0.695	74%	0.739	S	S	*	*			cis	179.3	144	-22.4	-116.6	44.6	0	0	0	106.5
1398	N	32.5	Very low	32.4	Very low	117 Å²	117	139.7 Å²	139.7	63%	0.626	73%	0.732	S	S	*	*			trans	66.5	152.8	143.5	-64.9	51	0	0	0	120.3
1399	D	34.3	Very low	32.8	Very low	117 Å²	117	139.6 Å²	139.6	63%	0.626	73%	0.727	S	S	*	*			cis	-160.3	153.9	-13.3	-88.1	-19.5	0	0	0	109.9
1400	D	36.1	Very low	33.4	Very low	146 Å²	146	137 Å²	137	78%	0.781	72%	0.718	S	S	*	*			trans	51	165.7	150	-49.4	-26.1	0	0	0	121.6
1401	D	36.8	Very low	33.7	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	71%	0.705	S	S	*	*			cis	-159.4	163.2	10.5	-155.3	1.3	0	0	0	116
1402	N	36.7	Very low	34.1	Very low	115 Å²	115	133.1 Å²	133.1	62%	0.615	69%	0.694	S	S	*	*			trans	57	105.2	145.8	-94.4	-53	0	0	0	127.1
1403	N	36.6	Very low	34.5	Very low	131 Å²	131	127 Å²	127	70%	0.701	67%	0.674	S	S	*	*				69.6	131.5	116.2	-93.6	-46.8	0	0	0	128.9
1404	N	36.2	Very low	34.8	Very low	120 Å²	120	127.8 Å²	127.8	64%	0.642	67%	0.67	S	S	*	*			trans	77.1	94.8	135.5	-80.5	-40.3	0	0	0	127
1405	N	36.1	Very low	35.1	Very low	131 Å²	131	130 Å²	130	70%	0.701	68%	0.675	S	S	*	*				65.9	144.3	109	-81.9	-40.1	0	0	0	126.5
1406	N	38.7	Very low	35.1	Very low	136 Å²	136	127.4 Å²	127.4	73%	0.727	67%	0.67	S	S	*	*			trans	80.6	140.4	147.5	-76.6	-17.8	0	0	0	120.9
1407	N	37	Very low	35	Very low	126 Å²	126	124.2 Å²	124.2	67%	0.674	66%	0.664	S	S	*	*			cis	-166.2	165.9	-10	-149.7	-11.6	0	0	0	114.2
1408	S	36	Very low	35	Very low	94 Å²	94	125 Å²	125	66%	0.657	67%	0.665	S	S	*	*			trans	68.5	170	148.9	81.5	0	0	0	0	117.9
1409	N	36.3	Very low	35.1	Very low	135 Å²	135	125.9 Å²	125.9	72%	0.722	67%	0.67	S	S	*	*			cis	-171.8	-174.5	-24.1	-102.7	21.4	0	0	0	106.4
1410	N	35.5	Very low	35	Very low	124 Å²	124	125.5 Å²	125.5	66%	0.663	67%	0.672	S	S	*	*			cis	-165.8	178.5	-45.7	-95	35.9	0	0	0	105
1411	N	34	Very low	34.7	Very low	116 Å²	116	124.8 Å²	124.8	62%	0.62	66%	0.664	S	S	*	*			cis	-147.4	-165.9	1	-131.8	50.1	0	0	0	104.7
1412	E	33.5	Very low	34.4	Very low	126 Å²	126	125.8 Å²	125.8	59%	0.589	66%	0.662	S	S	*	*			cis	-112	-164.7	4	-85.9	-84.2	85.2	0	0	108.4	K1414	E1412-K1414 IonicContact OE1-NZ 2.87Å; E1412-K1414 IonicContact OE2-NZ 3.81Å; E1412-K1414 PolarHBondContact OE2-NZ 3.48Å
1413	S	36.4	Very low	34.1	Very low	68 Å²	68	126.5 Å²	126.5	48%	0.476	67%	0.666	S	S	.	*			cis	70.3	158	21.7	140.1	0	0	0	0	114.5
1414	K	35.6	Very low	33.8	Very low	157 Å²	157	125.5 Å²	125.5	68%	0.683	67%	0.665	S	S	*	*			cis	-155.3	171	-7.4	-104.7	165	-129.4	109.7	0	104.3	E1412	E1412-K1414 IonicContact OE1-NZ 2.87Å; E1412-K1414 IonicContact OE2-NZ 3.81Å; E1412-K1414 PolarHBondContact OE2-NZ 3.48Å
1415	N	34.2	Very low	33.4	Very low	136 Å²	136	127.9 Å²	127.9	73%	0.727	68%	0.677	S	S	*	*			cis	-158	171.3	5.1	-131.1	26.2	0	0	0	104.4
1416	V	32.2	Very low	32.9	Very low	103 Å²	103	127 Å²	127	62%	0.624	68%	0.681	S	S	*	*			cis	-166	178.7	-8.8	82	0	0	0	0	104.2
1417	E	29.6	Very low	32.5	Very low	148 Å²	148	128.4 Å²	128.4	69%	0.692	69%	0.687	S	S	*	*			cis	-144.3	168.3	4	-106.3	144.7	-138.4	0	0	102.9
1418	M	31.5	Very low	32.1	Very low	146 Å²	146	128.6 Å²	128.6	72%	0.719	69%	0.692	S	S	*	*			cis	-164.4	175.8	9.8	-111.9	176.1	-80.3	0	0	103.5
1419	D	33.6	Very low	31.7	Very low	137 Å²	137	130.6 Å²	130.6	73%	0.733	70%	0.696	S	S	*	*			cis	-177	163.3	-24.7	-103.7	26.7	0	0	0	104.4
1420	V	32.4	Very low	31.2	Very low	109 Å²	109	132.8 Å²	132.8	66%	0.661	70%	0.701	S	S	*	*			cis	-166	146.6	-6.3	121	0	0	0	0	105.3
1421	E	30.9	Very low	30.7	Very low	130 Å²	130	131.1 Å²	131.1	61%	0.607	70%	0.699	S	S	*	*			cis	-171.1	159	-22.6	-130.5	-160.5	130.3	0	0	109.2
1422	K	30	Very low	30.2	Very low	153 Å²	153	132.9 Å²	132.9	67%	0.665	71%	0.708	S	S	*	*			trans	64	150.3	155.3	-65.9	161.1	170.2	133.1	0	118.5
1423	N	30	Very low	29.8	Very low	131 Å²	131	137.3 Å²	137.3	70%	0.701	72%	0.721	S	S	*	*			cis	-159.3	150.3	-16.6	-115	-0.1	0	0	0	111.9
1424	T	29.6	Very low	29.2	Very low	110 Å²	110	139.7 Å²	139.7	68%	0.675	74%	0.736	S	S	*	*			trans	23.5	119.5	151.7	57.8	0	0	0	0	120.5
1425	N	28.7	Very low	28.5	Very low	169 Å²	169	138.1 Å²	138.1	90%	0.904	74%	0.743	S	S	*	*				94	154.1	56.2	-82.1	1.2	0	0	0	115.7
1426	S	25.5	Very low	28.1	Very low	112 Å²	112	138.8 Å²	138.8	78%	0.783	75%	0.747	S	S	*	*			trans	-117.2	157.8	-156.6	52.4	0	0	0	0	116.3
1427	I	29.3	Very low	28.1	Very low	167 Å²	167	140.6 Å²	140.6	86%	0.856	75%	0.753	S	S	*	*			trans	-177.8	146.3	162.9	-107	160.1	0	0	0	107.6
1428	V	30.3	Very low	27.9	Very low	129 Å²	129	141.1 Å²	141.1	78%	0.782	76%	0.76	S	S	*	*			cis	-158.2	171.4	-26.2	93.2	0	0	0	0	109.2
1429	N	26.7	Very low	27.9	Very low	137 Å²	137	143.3 Å²	143.3	73%	0.733	77%	0.766	S	S	*	*			trans	-73.1	142.5	-179.1	-60.7	-18.5	0	0	0	114.1
1430	H	26.1	Very low	27.5	Very low	180 Å²	180	145.5 Å²	145.5	83%	0.833	77%	0.771	S	S	*	*				-174.3	176.5	103.8	-114.2	-86.8	0	0	0	113.8
1431	S	25.7	Very low	27.2	Very low	89 Å²	89	150.5 Å²	150.5	62%	0.622	78%	0.778	S	S	*	*			trans	-102.3	143	-165.6	52.8	0	0	0	0	115.3
1432	L	23.4	Very low	27.1	Very low	153 Å²	153	150.7 Å²	150.7	80%	0.801	78%	0.779	S	S	*	*				179.7	154.7	126.6	-100.7	159.6	0	0	0	114.8
1433	Y	24.7	Very low	26.8	Very low	219 Å²	219	150.5 Å²	150.5	86%	0.859	79%	0.791	S	S	*	*			trans	64.3	149.7	167.2	-86.6	-75.9	0	0	0	121.8
1434	C	22.7	Very low	26.6	Very low	119 Å²	119	150.6 Å²	150.6	80%	0.804	79%	0.79	S	S	*	*			trans	-106.9	153.7	-171.2	-51.5	0	0	0	0	112.9
1435	C	21.8	Very low	26.4	Very low	123 Å²	123	154.4 Å²	154.4	83%	0.831	80%	0.8	S	S	*	*			trans	-165.5	151.2	144.2	-111.2	0	0	0	0	111.5
1436	N	25.7	Very low	26.2	Very low	151 Å²	151	154.6 Å²	154.6	81%	0.807	80%	0.798	S	S	*	*			trans	63.5	144.5	172.5	-90.6	-36.3	0	0	0	116.5
1437	L	32.1	Very low	26.3	Very low	141 Å²	141	156.2 Å²	156.2	74%	0.738	80%	0.798	S	S	*	*			cis	-155.3	148.3	23.8	-125.5	160.4	0	0	0	111.1
1438	N	26.1	Very low	26.1	Very low	158 Å²	158	155.2 Å²	155.2	85%	0.845	79%	0.794	S	S	*	*			trans	-82.2	124.5	161.3	-107	-24.7	0	0	0	110
1439	K	31	Very low	25.9	Very low	193 Å²	193	155.4 Å²	155.4	84%	0.839	80%	0.8	S	S	*	*			trans	-169.6	120.2	151.6	-113.9	162.9	-173.4	174.2	0	113.7
1440	Q	24.6	Very low	26	Very low	182 Å²	182	156.1 Å²	156.1	85%	0.85	80%	0.802	S	S	*	*			trans	-68.2	151.7	148.7	-64.4	174.3	-22.2	0	0	109.4
1441	R	26.8	Very low	26.7	Very low	215 Å²	215	153.1 Å²	153.1	81%	0.811	80%	0.799	S	S	*	*				-174.8	129.2	124.4	-103.6	175.9	-171.8	-141	6	113.5
1442	Q	28.2	Very low	27	Very low	133 Å²	133	157.7 Å²	157.7	62%	0.621	81%	0.807	S	S	*	*			trans	52.4	82.3	136.1	-63.1	169	-52.9	0	0	118.5	I1444	Q1442-I1444 PolarHBondContact O-N 3.2Å
1443	T	23.2	Very low	27.3	Very low	149 Å²	149	157.2 Å²	157.2	91%	0.914	81%	0.805	S	S	*	*			trans	-74.2	99.6	136.7	31.6	0	0	0	0	109.2
1444	I	25.5	Very low	27.4	Very low	133 Å²	133	152.4 Å²	152.4	68%	0.682	79%	0.794	S	S	*	*			trans	-126.2	80	162.4	-55.5	-177.7	0	0	0	108.9	Q1442	Q1442-I1444 PolarHBondContact O-N 3.2Å
1445	Q	27.1	Very low	27.7	Very low	190 Å²	190	152.6 Å²	152.6	89%	0.888	79%	0.787	S	S	*	*			trans	-125.9	100.8	143.4	-71.6	-175.4	-28.6	0	0	103.1
1446	M	24.6	Very low	28	Very low	173 Å²	173	153.6 Å²	153.6	85%	0.852	78%	0.783	S	S	*	*				74	125	61.6	-162.5	154.2	81.9	0	0	111.7
1447	N	25.7	Very low	28.1	Very low	146 Å²	146	153.1 Å²	153.1	78%	0.781	78%	0.78	S	S	*	*			trans	-77.6	142.3	-149.4	-54.7	-10.3	0	0	0	114.8
1448	D	26.7	Very low	27.9	Very low	146 Å²	146	154.7 Å²	154.7	78%	0.781	78%	0.783	S	S	*	*			trans	25.6	131.9	135.5	-54.4	-23.7	0	0	0	120.8
1449	C	25	Very low	27.9	Very low	134 Å²	134	154.6 Å²	154.6	91%	0.905	78%	0.783	S	S	*	*			trans	-129.4	107.7	159.5	-100.1	0	0	0	0	111.5
1450	I	29	Very low	27.7	Very low	151 Å²	151	152.9 Å²	152.9	77%	0.774	78%	0.778	S	S	*	*			trans	-73.5	144.7	169	-61.2	162.1	0	0	0	109.4	K1452	I1450-K1452 PolarHBondContact O-N 3.26Å; I1450-K1452 VanDerWaalsContact O-N 3.13Å
1451	P	42	Very low	27.7	Very low	118 Å²	118	151.7 Å²	151.7	77%	0.766	77%	0.772	S	S	*	*			trans	-75.5	99.7	168.2	30.8	-33.2	0	0	0	112
1452	K	31.8	Very low	27.6	Very low	184 Å²	184	148.5 Å²	148.5	80%	0.8	77%	0.77	S	S	*	*				46.5	134.9	126.6	-81	-176.5	-179.5	-177.8	0	119.5	I1450	I1450-K1452 PolarHBondContact O-N 3.26Å; I1450-K1452 VanDerWaalsContact O-N 3.13Å
1453	L	28.4	Very low	27.4	Very low	144 Å²	144	147.4 Å²	147.4	75%	0.754	77%	0.773	S	S	*	*			cis	-151	162.5	27	-89.8	115.8	0	0	0	113.8
1454	N	27.4	Very low	27.5	Very low	117 Å²	117	149 Å²	149	63%	0.626	77%	0.773	S	S	*	*			trans	80.2	112.6	147.4	-81.7	45.8	0	0	0	123.3
1455	D	28	Very low	27.5	Very low	124 Å²	124	151.8 Å²	151.8	66%	0.663	78%	0.779	S	S	*	*				101.3	101.4	123.5	-59.2	-13.9	0	0	0	122.6
1456	I	29.4	Very low	27.5	Very low	144 Å²	144	149.9 Å²	149.9	74%	0.738	78%	0.781	S	S	*	*			trans	84.7	102.5	132.9	-57.2	168	0	0	0	119.8
1457	D	28.2	Very low	27.5	Very low	140 Å²	140	148.1 Å²	148.1	75%	0.749	78%	0.775	S	S	*	*			trans	41	133.9	131.8	-53.1	-17.6	0	0	0	124.8
1458	H	26.5	Very low	27.7	Very low	175 Å²	175	151 Å²	151	81%	0.81	78%	0.78	S	S	*	*			trans	34.3	109.9	143.9	-65.1	-45.4	0	0	0	122.2
1459	N	27.4	Very low	27.6	Very low	156 Å²	156	149.5 Å²	149.5	83%	0.834	78%	0.781	S	S	*	*				-161	144.9	127.4	-88	-47.5	0	0	0	106.7
1460	E	25.3	Very low	27.7	Very low	157 Å²	157	150 Å²	150	73%	0.734	77%	0.774	S	S	*	*			cis	66.7	106.4	48.9	-76.8	-116.8	118.4	0	0	115.5
1461	Q	24.6	Very low	27.5	Very low	156 Å²	156	148.7 Å²	148.7	73%	0.729	77%	0.773	S	S	*	*			trans	71.3	160.2	155.1	-53.7	-165	16.5	0	0	121.7
1462	L	25.9	Very low	26.8	Very low	148 Å²	148	149.7 Å²	149.7	78%	0.775	77%	0.772	S	S	*	*			trans	66.7	83	163.6	-64.8	145.2	0	0	0	117.6
1463	T	23.3	Very low	26.5	Very low	111 Å²	111	145.6 Å²	145.6	68%	0.681	77%	0.766	S	S	*	*				51.8	111.8	85.6	69.4	0	0	0	0	118.3
1464	M	26.3	Very low	26.3	Very low	183 Å²	183	147 Å²	147	90%	0.901	77%	0.771	S	S	*	*			trans	-155.8	70.3	143	-134.4	168.3	60.4	0	0	110.5
1465	K	25.2	Very low	26.4	Very low	190 Å²	190	148.3 Å²	148.3	83%	0.826	78%	0.778	S	S	*	*				40	90.1	104	-78.3	-171.3	173.4	178.7	0	114.9
1466	V	27.5	Very low	26.5	Very low	151 Å²	151	151.3 Å²	151.3	92%	0.915	79%	0.785	S	S	*	*			trans	-76.8	141.2	157.1	175.3	0	0	0	0	109
1467	N	24.6	Very low	26.3	Very low	136 Å²	136	149.2 Å²	149.2	73%	0.727	78%	0.783	S	S	*	*			trans	-139.3	110.8	-173.1	-172.2	11.2	0	0	0	111
1468	K	29.1	Very low	26.3	Very low	205 Å²	205	150.2 Å²	150.2	89%	0.891	79%	0.789	S	S	*	*			trans	178.6	101.3	153.3	-107.8	175.3	-179.7	-177.8	0	114.2
1469	S	25	Very low	26.3	Very low	116 Å²	116	150.6 Å²	150.6	81%	0.811	79%	0.791	S	S	*	*				-158.8	136.1	129	56.3	0	0	0	0	108.8
1470	I	26.6	Very low	26.2	Very low	145 Å²	145	152.1 Å²	152.1	74%	0.744	80%	0.798	S	S	*	*			trans	-147.9	137.2	178.5	-64.1	-177.5	0	0	0	106.4
1471	T	24.9	Very low	26.1	Very low	122 Å²	122	149.5 Å²	149.5	75%	0.748	80%	0.797	S	S	*	*			trans	61.5	140.2	177.4	41.2	0	0	0	0	115.5
1472	D	27.3	Very low	26.1	Very low	140 Å²	140	151.1 Å²	151.1	75%	0.749	80%	0.804	S	S	*	*			cis	-144.8	161.6	20.7	-110.3	-40.3	0	0	0	115.6
1473	S	25.7	Very low	26.1	Very low	98 Å²	98	152 Å²	152	69%	0.685	81%	0.808	S	S	*	*			trans	68.9	114.6	153.6	67.8	0	0	0	0	122.7
1474	M	24.8	Very low	26.3	Very low	174 Å²	174	156 Å²	156	86%	0.857	82%	0.817	S	S	*	*			trans	71.9	136.1	131.5	-64.9	-174.5	175.1	0	0	123.5
1475	N	28.2	Very low	26.1	Very low	143 Å²	143	152.4 Å²	152.4	77%	0.765	81%	0.809	S	S	*	*			trans	88.7	116.2	156.8	-65.1	-40.9	0	0	0	120.6
1476	K	30	Very low	26.2	Very low	188 Å²	188	150.4 Å²	150.4	82%	0.817	81%	0.808	S	S	*	*			trans	55.1	86	153.2	-60	-175.8	179	-176.5	0	116.4
1477	S	25.7	Very low	26.3	Very low	100 Å²	100	151.8 Å²	151.8	70%	0.699	80%	0.804	S	S	*	*				61.2	111.9	68.1	85.1	0	0	0	0	114.7
1478	N	27.8	Very low	26.3	Very low	161 Å²	161	153.2 Å²	153.2	86%	0.861	81%	0.811	S	S	*	*			trans	-174.6	94.3	134.1	-96	-1.6	0	0	0	110.2
1479	Q	26.8	Very low	26.3	Very low	183 Å²	183	150.5 Å²	150.5	86%	0.855	81%	0.807	S	S	*	*			trans	-135.2	135.7	154.8	-82.8	-168.3	-35.8	0	0	107.4	S1481	Q1479-S1481 PolarHBondContact O-N 3.04Å
1480	L	24.8	Very low	26.5	Very low	188 Å²	188	153.3 Å²	153.3	98%	0.984	81%	0.807	S	S	*	*			trans	-78.6	110.1	169.8	-84	85.8	0	0	0	108.6
1481	S	23.9	Very low	26.7	Very low	102 Å²	102	155.7 Å²	155.7	71%	0.713	82%	0.815	S	S	*	*			trans	-152.9	60.1	168.3	65.6	0	0	0	0	111.7	Q1479	Q1479-S1481 PolarHBondContact O-N 3.04Å
1482	E	24.4	Very low	27	Very low	190 Å²	190	157 Å²	157	89%	0.888	82%	0.818	S	S	*	*			trans	-123.3	83.5	160.8	-77.9	-162.9	151	0	0	110.4
1483	I	26.7	Very low	27.3	Very low	166 Å²	166	155 Å²	155	85%	0.851	81%	0.812	S	S	*	*	S	Bend	trans	-117.1	93.5	147.2	-64.2	-177.6	0	0	0	105.8
1484	F	27	Very low	27.6	Very low	196 Å²	196	159.8 Å²	159.8	86%	0.86	82%	0.824	S	S	*	*			trans	17.7	129.8	169.9	-67.9	-83.6	0	0	0	121.1
1485	S	23.2	Very low	27.7	Very low	106 Å²	106	159.3 Å²	159.3	74%	0.741	82%	0.824	S	S	*	*			trans	-143.6	123.9	148.3	-69.4	0	0	0	0	111.1
1486	N	26.4	Very low	27.8	Very low	149 Å²	149	160.3 Å²	160.3	80%	0.797	83%	0.828	S	S	*	*	S	Bend	trans	77	126.3	156.4	-58.8	-16.5	0	0	0	121.7
1487	Q	28.7	Very low	27.8	Very low	180 Å²	180	157.8 Å²	157.8	84%	0.841	82%	0.823	S	S	*	*			trans	69.9	87.8	144.8	-67.3	-175.5	-35.3	0	0	119.7
1488	N	24.6	Very low	28	Very low	165 Å²	165	161.5 Å²	161.5	88%	0.882	83%	0.833	S	S	*	*			trans	-129.1	131.1	132.1	-98.3	-38	0	0	0	108.6
1489	D	29.7	Very low	28	Very low	149 Å²	149	158.5 Å²	158.5	80%	0.797	82%	0.817	S	S	*	*			trans	-147.7	139.9	167.9	-82.4	-53.3	0	0	0	105.1
1490	E	30	Very low	28	Very low	174 Å²	174	158.4 Å²	158.4	81%	0.813	81%	0.814	S	S	*	*			cis	-134.5	141.9	4.3	-52.7	171.7	113.8	0	0	110.1
1491	Q	30.9	Very low	28.2	Very low	196 Å²	196	152 Å²	152	92%	0.916	79%	0.785	S	S	*	*				-171.2	152.8	113	-100.1	-178.1	21.6	0	0	111
1492	N	30.2	Very low	28.6	Very low	149 Å²	149	153.2 Å²	153.2	80%	0.797	78%	0.779	S	S	*	*			trans	-152	179.8	-148	-149.9	13.6	0	0	0	108.7
1493	P	34.5	Very low	29	Very low	98 Å²	98	149.8 Å²	149.8	64%	0.636	77%	0.766	S	S	*	*			cis	-123.5	163	-28.8	13	10.1	0	0	0	113.4
1494	Q	31.5	Very low	29.1	Very low	198 Å²	198	150.1 Å²	150.1	93%	0.925	76%	0.764	S	S	*	*				-165.3	97.1	124.2	-90.5	-122.8	-6.1	0	0	110.2
1495	L	25.7	Very low	29.4	Very low	165 Å²	165	148 Å²	148	86%	0.864	76%	0.756	S	S	*	*			trans	-152.9	119.8	164.4	-140.1	163.8	0	0	0	106.8
1496	L	31.2	Very low	29.7	Very low	163 Å²	163	149.3 Å²	149.3	85%	0.853	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-91.4	148.7	-175.9	-147.6	80.5	0	0	0	111.2
1497	L	29.5	Very low	29.8	Very low	136 Å²	136	150.2 Å²	150.2	71%	0.712	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-65.4	141.9	-172.5	-71.8	62.2	0	0	0	112.6
1498	I	30.1	Very low	29.7	Very low	177 Å²	177	149 Å²	149	91%	0.908	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-99.8	138.4	137.8	-69.2	-178	0	0	0	107.4
1499	N	29	Very low	29.9	Very low	98 Å²	98	148.3 Å²	148.3	52%	0.524	75%	0.754	S	S	.	*	P	Polyproline II helix	trans	-98.9	128.6	-150.4	-163.8	-4.2	0	0	0	113	S1501	N1499-S1501 VanDerWaalsContact CG-OG 3.22Å; N1499-S1501 PolarHBondContact ND2-OG 3.2Å; N1499-S1501 VanDerWaalsContact ND2-OG 3.15Å; N1499-S1501 PolarHBondContact O-N 3.4Å; N1499-S1501 PolarHBondContact OD1-N 3Å
1500	K	26.9	Very low	29.7	Very low	182 Å²	182	148.9 Å²	148.9	79%	0.791	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	37.9	172.6	-155.8	-178.7	176.5	-179.2	0	112.4
1501	S	28.4	Very low	29.7	Very low	53 Å²	53	147.4 Å²	147.4	37%	0.371	75%	0.753	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.4	-8	169.8	59.9	0	0	0	0	113.2	N1499	N1499-S1501 VanDerWaalsContact CG-OG 3.22Å; N1499-S1501 PolarHBondContact ND2-OG 3.2Å; N1499-S1501 VanDerWaalsContact ND2-OG 3.15Å; N1499-S1501 PolarHBondContact O-N 3.4Å; N1499-S1501 PolarHBondContact OD1-N 3Å
1502	Q	32.3	Very low	29.7	Very low	127 Å²	127	146.1 Å²	146.1	59%	0.593	75%	0.753	S	S	*	*	S	Bend	trans	-83.7	-7.8	-174	-133.9	76.3	8.6	0	0	114.8	N1506	Q1502-N1506 PolarHBondContact O-ND2 3.11Å
1503	I	32.8	Very low	29.7	Very low	119 Å²	119	145.7 Å²	145.7	61%	0.61	75%	0.75	S	S	*	*	S	Bend	trans	-105.9	-26.8	-174	-66	178.6	0	0	0	112.2	Q1505	I1503-Q1505 VanDerWaalsContact C-N 3.3Å
1504	E	29.5	Very low	29.5	Very low	173 Å²	173	150.3 Å²	150.3	81%	0.808	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-0.1	172	-66.3	-170.4	146.5	0	0	113.7
1505	Q	31.4	Very low	29.5	Very low	151 Å²	151	151.2 Å²	151.2	71%	0.706	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-6.5	168.9	-74.5	-161.6	-27.4	0	0	114.7	I1503	I1503-Q1505 VanDerWaalsContact C-N 3.3Å
1506	N	31.1	Very low	29.8	Very low	133 Å²	133	148.8 Å²	148.8	71%	0.711	75%	0.753	S	S	*	*	S	Bend	trans	-105.9	6.7	-176.6	-80.8	-53.8	0	0	0	115	Q1502	Q1502-N1506 PolarHBondContact O-ND2 3.11Å
1507	L	27.7	Very low	29.8	Very low	168 Å²	168	145.6 Å²	145.6	88%	0.88	75%	0.745	S	S	*	*	S	Bend	trans	-127.3	19.4	173.7	-88.7	170.6	0	0	0	113.9
1508	L	27.5	Very low	30	Very low	154 Å²	154	149.6 Å²	149.6	81%	0.806	75%	0.752	S	S	*	*	S	Bend	trans	-136.5	44.9	178.3	-130.5	171.4	0	0	0	112.6
1509	N	27.2	Very low	29.7	Very low	152 Å²	152	148.9 Å²	148.9	81%	0.813	75%	0.75	S	S	*	*			trans	-144.1	34.6	176.2	-128.9	-8.8	0	0	0	114.9
1510	I	26.6	Very low	29.7	Very low	160 Å²	160	148.5 Å²	148.5	82%	0.821	75%	0.753	S	S	*	*	S	Bend	trans	-129.5	76.4	164.8	-52.9	-179	0	0	0	109.6
1511	N	29.4	Very low	29.8	Very low	143 Å²	143	147 Å²	147	77%	0.765	75%	0.752	S	S	*	*			trans	173.8	83.9	141.9	-96.1	-39	0	0	0	111.4
1512	N	30.7	Very low	29.8	Very low	170 Å²	170	151.6 Å²	151.6	91%	0.909	78%	0.777	S	S	*	*			trans	-152.3	135.8	147	-110.8	-40	0	0	0	109.9
1513	N	31.5	Very low	29.6	Very low	139 Å²	139	151.1 Å²	151.1	74%	0.743	78%	0.784	S	S	*	*			trans	-92.4	137.9	-165.5	-70.2	-70.1	0	0	0	113
1514	K	30.2	Very low	29.4	Very low	196 Å²	196	151.4 Å²	151.4	85%	0.852	79%	0.791	S	S	*	*				-169.2	109.6	124.5	-106.7	165.5	-177.4	-178.4	0	114.8
1515	Y	31.3	Very low	29.2	Very low	216 Å²	216	150.9 Å²	150.9	85%	0.847	79%	0.792	S	S	*	*			trans	21.7	110.3	142.5	-67.8	-89.6	0	0	0	120.6
1516	S	31.8	Very low	28.9	Very low	114 Å²	114	149 Å²	149	80%	0.797	80%	0.795	S	S	*	*				160.9	142.5	106.4	62.2	0	0	0	0	110.3
1517	S	31.6	Very low	28.8	Very low	97 Å²	97	146.7 Å²	146.7	68%	0.678	79%	0.79	S	S	*	*			cis	-176.6	155	-20.9	43.3	0	0	0	0	107.1
1518	Y	32.2	Very low	28.9	Very low	219 Å²	219	146.4 Å²	146.4	86%	0.859	78%	0.784	S	S	*	*			trans	74.3	90.4	177.4	-69.6	-87.7	0	0	0	118.9
1519	N	24.7	Very low	29	Very low	162 Å²	162	146.3 Å²	146.3	87%	0.866	79%	0.789	S	S	*	*				-153.6	120.6	122.2	-157.8	-4.9	0	0	0	109.7
1520	P	29.9	Very low	29	Very low	91 Å²	91	144 Å²	144	59%	0.591	79%	0.785	S	S	*	*			trans	-109.9	150.1	-172.9	39	-31.9	0	0	0	115.1
1521	I	28.9	Very low	29.2	Very low	151 Å²	151	142.3 Å²	142.3	77%	0.774	78%	0.782	S	S	*	*			trans	75.8	84.8	163.3	-50.4	149	0	0	0	116.2
1522	V	27.8	Very low	29	Very low	148 Å²	148	145.6 Å²	145.6	90%	0.897	79%	0.79	S	S	*	*				-127.7	96.1	128.5	-179.6	0	0	0	0	108.9
1523	T	28.4	Very low	28.7	Very low	118 Å²	118	147.8 Å²	147.8	72%	0.724	80%	0.8	S	S	*	*			trans	-97.8	131.7	150.5	44.2	0	0	0	0	106.3
1524	T	28.7	Very low	28.6	Very low	124 Å²	124	148.3 Å²	148.3	76%	0.761	80%	0.802	S	S	*	*				-159.1	147.4	70	-60.6	0	0	0	0	111
1525	I	24.4	Very low	28.5	Very low	162 Å²	162	145.7 Å²	145.7	83%	0.831	80%	0.8	S	S	*	*			trans	-99.3	150.1	176	-71	171.9	0	0	0	110.2
1526	S	25.9	Very low	28.3	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	80%	0.797	S	S	*	*			trans	79.7	141.1	177	-143.6	0	0	0	0	114
1527	S	29.4	Very low	28.1	Very low	85 Å²	85	143.5 Å²	143.5	59%	0.594	80%	0.797	S	S	*	*			cis	-150.1	159.5	24.2	77.1	0	0	0	0	115.9
1528	H	29.8	Very low	27.9	Very low	163 Å²	163	146.4 Å²	146.4	76%	0.755	81%	0.805	S	S	*	*			trans	66.3	84.8	161.2	-59.8	100.1	0	0	0	119.9
1529	V	29.2	Very low	27.6	Very low	151 Å²	151	141.5 Å²	141.5	92%	0.915	80%	0.801	S	S	*	*				-114.4	106.8	125	174.2	0	0	0	0	107.3
1530	S	26.6	Very low	27.8	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	80%	0.796	S	S	*	*			trans	-166.1	72.8	172.4	-92.8	0	0	0	0	111.2
1531	T	31.4	Very low	27.7	Very low	125 Å²	125	143.8 Å²	143.8	77%	0.767	81%	0.812	S	S	*	*			trans	-167.8	99.2	152.3	17.9	0	0	0	0	110.9
1532	F	24.7	Very low	27.6	Very low	212 Å²	212	143.3 Å²	143.3	93%	0.93	82%	0.815	S	S	*	*				-149.4	64.4	129.5	-129	-71.3	0	0	0	110.6
1533	I	24.6	Very low	27.5	Very low	216 Å²	216	142.8 Å²	142.8	100%	1.108	81%	0.808	S	S	*	*				-87.1	0	122	-63.7	177	0	0	0	105

Retrieved 1,533 of 1,533 residues in 2170.7 ms (Link to these results)

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