A0A3Q0KG43_SCHMA Loading...

WD_REPEATS_REGION domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KG43, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,203 aa.

						>A0A3Q0KG43_SCHMA|A0A3Q0KG43
MSITKGPVNVHKKGLTSAVYDIHGRCIVTGGSDGKIKVFESLDDACPVEHIVGEKINAIACRYENVIVATEGTYVHILQMEDGLPDGVATRFTAEVNHLAMNKDLSKIALCSSDFSVKVVDLSGHDSDRELVFNGHQGAVLSVAFDPLDVFIASASCDGSVRLWDLVIGKETKCISTLVKCNDPLFAPSYCRLCWESTVGKFLLVPVDKEIRMFERVCWSLLCSLSCPSVAQAYNICASSRDGNLISAGSLDGWIIVWRVEDRQPIHRIRDPSHSRICSLFWHPLDKNLLFANENGSVGLVHAPDHQPSRDPLSPNRIAQLMGCDEDGDTADLLSAAAAQAESSRLLTDDDVILHSNEDDSSSDSIDLSRIKSDYMSLNDEAEEKQAPTEVEIKATVPIIEDNICPKKDNVTTQSLQKAFQSGATPLGFRERFMVWNRIGIVTQFRDTAEYQAEDDASNQSSGGSIEVEFHDNSLHHSLRLSNSSGYSMADLSLTALLLASKGSDDPNLDDLNDDEQNELYDLSRIAILPLDVGSSNIGDTSAEWTTTLPPGELCDAVCLVTEEGNDRTESPGYAVVATSKRLLRIFTQPSPSSSVAHSNNLHLLQINKLGSPPISLSGHHTVVLASHPSNPILAVVTCNVVGELEWRVFYLGGIMLGSNRTATPLWMKSSLSIWQHLPLSPPLKHNTSLDTSVVRLTWFGFSDTGGLFTYDSNGVVRRLIHGRSQRHPEFHWVPICDTRSLLKQSNRRTDNYFVVGVLESYESVENLSSENKNDLKSNVVGFGQLQAIYCKASKWPRVFPRPVVSNIPFRLPLCAMNTDQSDLEENYLQCLISEDWPIWGPNTTDANEDILSHLLSLNTKSLTKRKAVLLRLFALAAKLESDWASLAIANMMPDAATVQLAIRYAGRLRRQNLAHRLAGVALEKERRVSETVEVNDWDDIPQSSTFKGKYNRDPTTFSGHSPSNNRIHSHSKTSRPTNDSDYHDVADTSLVSSGTDDGHTDVSINNLPLADSESLSHSVLTPSSRNPFKSSHDPKEITPRSIAHGTELLDVWTPKTTATNTKVSQKPNVNKTQNNKKRSLASCQRSKLPKMKSVTITDVDQEFTDWFEENRDTLEESYPEVSVEELVRIGQSEYRSIKSQKDGVFDGKDKENLLQNNVKRPLSENDDLIQCNSSAAKRRLSEFENDVSKRISSFAFCQNSSK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	49.8	Very low	71.2	Confident	43 Å²	43	51.1 Å²	51.1	21%	0.212	31%	0.311	C	S	.	.				0	136.7	0	-74.9	166.3	-175.6	0	0	109	V257 H267 I269 W282 V301 H302 A303	M1-V257 HydrophobicContact CE-CB 3.96Å; M1-V257 HydrophobicContact CE-CG1 4.11Å; M1-V257 HydrophobicContact CE-CG2 3.57Å; M1-V257 HydrophobicContact SD-CG2 4.16Å; M1-H267 HydrophobicContact CB-CB 4.49Å; M1-H267 HydrophobicContact CE-CB 4.2Å; M1-H267 WeakPolarHBondContact CE-CD2 3.33Å; M1-H267 HydrophobicContact CG-CB 4.19Å; M1-H267 VanDerWaalsContact CG-CD2 3.48Å; M1-H267 WeakPolarHBondContact CG-CD2 3.48Å; M1-H267 PolarHBondContact N-CE1 3.1Å; M1-H267 VanDerWaalsContact N-CE1 3.33Å; M1-H267 PolarHBondContact N-ND1 3.22Å; M1-H267 HydrophobicContact SD-CB 3.5Å; M1-H267 VanDerWaalsContact SD-CB 3.5Å; M1-H267 VanDerWaalsContact SD-CD2 3.52Å; M1-I269 HydrophobicContact CB-CD1 3.62Å; M1-I269 HydrophobicContact CB-CG1 4.43Å; M1-I269 HydrophobicContact CG-CD1 4.1Å; M1-I269 HydrophobicContact SD-CD1 3.43Å; M1-I269 WeakPolarHBondContact SD-CD1 3.38Å; M1-W282 HydrophobicContact CE-CH2 4.39Å; M1-V301 HydrophobicContact CB-CG1 3.95Å; M1-V301 HydrophobicContact CE-CG1 4.38Å; M1-V301 HydrophobicContact CG-CG1 3.74Å; M1-V301 HydrophobicContact SD-CG1 3.4Å; M1-V301 WeakPolarHBondContact SD-CG1 3.31Å; M1-H302 VanDerWaalsContact CA-O 3.24Å; M1-H302 WeakPolarHBondContact CA-O 3.44Å; M1-H302 WeakPolarHBondContact CB-O 3.49Å; M1-H302 WeakPolarHBondContact CG-O 3.39Å; M1-A303 HydrophobicContact CE-CB 3.15Å; M1-A303 HydrophobicContact CG-CB 4.23Å
2	S	54.9	Low	72.7	Confident	84 Å²	84	59.7 Å²	59.7	59%	0.587	34%	0.341	S	S	*	.			trans	-108.7	154.7	152	53.8	0	0	0	0	107.3	T4	S2-T4 PolarHBondContact O-N 2.69Å
3	I	55.5	Low	73.9	Confident	56 Å²	56	66 Å²	66	29%	0.287	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	105.9	165.2	-66.8	172.5	0	0	0	105.5	K5 I269 P272 V301	I3-K5 WeakPolarHBondContact CG2-O 3.2Å; I3-K5 PolarHBondContact O-N 2.8Å; I3-I269 HydrophobicContact CD1-CG2 4.09Å; I3-I269 HydrophobicContact CG1-CG2 3.87Å; I3-P272 HydrophobicContact CD1-CG 4.41Å; I3-V301 HydrophobicContact CG1-CG2 4.48Å
4	T	58.7	Low	74.9	Confident	82 Å²	82	62.3 Å²	62.3	50%	0.503	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-32.4	179	21.7	0	0	0	0	110	S2 L300 H302	S2-T4 PolarHBondContact O-N 2.69Å; T4-L300 PolarHBondContact N-O 3.16Å; T4-L300 PolarHBondContact OG1-O 2.83Å; T4-H302 HydrophobicContact CG2-CB 3.41Å; T4-H302 VanDerWaalsContact CG2-CB 3.41Å; T4-H302 PolarHBondContact OG1-N 3.06Å
5	K	62.3	Low	75.9	Confident	37 Å²	37	59.9 Å²	59.9	16%	0.161	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	124	172.9	-175.8	164	169.2	158.1	0	111.6	I3 L42 D43 L300	I3-K5 WeakPolarHBondContact CG2-O 3.2Å; I3-K5 PolarHBondContact O-N 2.8Å; K5-L42 HydrophobicContact CD-CB 3.83Å; K5-L42 HydrophobicContact CD-CD1 4.38Å; K5-L42 PolarHBondContact NZ-O 3.49Å; K5-D43 IonicContact NZ-OD1 3.69Å; K5-D43 PolarHBondContact NZ-OD1 3.2Å; K5-D43 IonicContact NZ-OD2 2.61Å; K5-D43 PolarHBondContact NZ-OD2 3.2Å; K5-L300 HydrophobicContact CB-CB 4.28Å; K5-L300 PolarHBondContact N-O 2.78Å; K5-L300 PolarHBondContact O-N 3.02Å
6	G	69	Low	77	Confident	40 Å²	40	56.1 Å²	56.1	41%	0.412	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	154	177.3	0	0	0	0	0	112.3	V8	G6-V8 PolarHBondContact O-N 3.05Å; G6-V8 VanDerWaalsContact O-N 3.15Å
7	P	81.1	Confident	78	Confident	39 Å²	39	53.8 Å²	53.8	25%	0.253	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	118.3	179.5	26.5	-35.5	0	0	0	110.6	D271 F291 V298	P7-D271 WeakPolarHBondContact CG-OD1 3.44Å; P7-F291 HydrophobicContact CB-CE2 4.46Å; P7-F291 HydrophobicContact CB-CZ 4.41Å; P7-V298 WeakPolarHBondContact CA-O 3.35Å
8	V	85.2	Confident	78.8	Confident	53 Å²	53	50.8 Å²	50.8	32%	0.321	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.3	176.2	-179.7	0	0	0	0	108.4	G6 V10 S297 V298	G6-V8 PolarHBondContact O-N 3.05Å; G6-V8 VanDerWaalsContact O-N 3.15Å; V8-V10 HydrophobicContact CG1-CG2 4.44Å; V8-V10 PolarHBondContact O-N 3.03Å; V8-S297 CarbonylContact O-C 3.52Å; V8-S297 WeakPolarHBondContact O-CA 3.31Å; V8-S297 WeakPolarHBondContact O-CB 3.09Å; V8-V298 PolarHBondContact N-O 3.14Å; V8-V298 PolarHBondContact O-N 3.48Å
9	N	86.8	Confident	79.6	Confident	111 Å²	111	48.8 Å²	48.8	59%	0.594	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	117.5	178.8	-165.3	-21.4	0	0	0	110.5	H11	N9-H11 PolarHBondContact OD1-O 3.41Å
10	V	88.2	Confident	80.1	Confident	11 Å²	11	47.3 Å²	47.3	7%	0.067	26%	0.263	C	S	.	.			trans	-115.5	-37.5	-173.2	175.2	0	0	0	0	112.1	V8 K37 F39 G296 V298	V8-V10 HydrophobicContact CG1-CG2 4.44Å; V8-V10 PolarHBondContact O-N 3.03Å; V10-K37 HydrophobicContact CG1-CB 4.38Å; V10-K37 HydrophobicContact CG1-CD 3.49Å; V10-K37 VanDerWaalsContact CG1-CD 3.49Å; V10-K37 PolarHBondContact O-NZ 3.41Å; V10-F39 HydrophobicContact CB-CZ 4.32Å; V10-F39 HydrophobicContact CG1-CE2 3.65Å; V10-F39 HydrophobicContact CG1-CZ 3.44Å; V10-F39 VanDerWaalsContact CG1-CZ 3.44Å; V10-F39 HydrophobicContact CG2-CE2 4.36Å; V10-F39 HydrophobicContact CG2-CZ 3.86Å; V10-G296 PolarHBondContact N-O 3.14Å; V10-V298 HydrophobicContact CB-CG2 4.49Å; V10-V298 HydrophobicContact CG2-CB 4.44Å; V10-V298 HydrophobicContact CG2-CG2 4.36Å
11	H	92.2	Very high	80.5	Confident	6 Å²	6	45.3 Å²	45.3	3%	0.028	25%	0.252	C	S	.	.	S	Bend	trans	-123	169.1	-177.2	-70.1	-74.6	0	0	0	111.8	N9 T29 D33 K35 G296	N9-H11 PolarHBondContact OD1-O 3.41Å; H11-T29 WeakPolarHBondContact NE2-CB 3.42Å; H11-T29 PolarHBondContact NE2-OG1 3.44Å; H11-T29 VanDerWaalsContact NE2-OG1 3.13Å; H11-D33 IonicContact CE1-OD1 3.24Å; H11-D33 IonicContact CG-OD1 3.04Å; H11-D33 IonicContact CG-OD2 3.95Å; H11-D33 IonicContact ND1-OD1 2.7Å; H11-D33 PolarHBondContact ND1-OD1 3.43Å; H11-D33 IonicContact ND1-OD2 4Å; H11-D33 PolarHBondContact ND1-OD2 3.47Å; H11-D33 VanDerWaalsContact ND1-OD2 3.13Å; H11-K35 PolarHBondContact CE1-O 3.35Å; H11-G296 PolarHBondContact N-O 3.48Å
12	K	88.9	Confident	82	Confident	154 Å²	154	46.2 Å²	46.2	67%	0.67	26%	0.257	S	S	*	.			trans	-65.6	157.2	166.7	-64.5	-178.6	-178.6	172.3	0	110.9	G14 D33	K12-G14 PolarHBondContact O-N 3.34Å; K12-D33 HydrophobicContact CB-CB 4.1Å; K12-D33 HydrophobicContact CD-CB 4.02Å; K12-D33 HydrophobicContact CG-CB 3.98Å; K12-D33 PolarHBondContact N-OD2 3.47Å
13	K	88.7	Confident	83.3	Confident	142 Å²	142	47 Å²	47	62%	0.617	25%	0.251	S	S	*	.	S	Bend	trans	-52.4	126.8	173.7	-173.8	178.7	-178.1	-178.8	0	110.8	E294	K13-E294 CarbonylContact C-O 3.46Å; K13-E294 WeakPolarHBondContact CA-O 3.41Å; K13-E294 VanDerWaalsContact CG-O 3.31Å; K13-E294 WeakPolarHBondContact CG-O 3.45Å
14	G	88.1	Confident	84.6	Confident	14 Å²	14	45 Å²	45	14%	0.144	24%	0.244	C	C	.	.	S	Bend	trans	153.9	-172.5	178.5	0	0	0	0	0	111.3	K12 T16 S32 E294	K12-G14 PolarHBondContact O-N 3.34Å; G14-T16 PolarHBondContact O-N 3.48Å; G14-T16 PolarHBondContact O-OG1 3.37Å; G14-S32 WeakPolarHBondContact CA-OG 3.38Å; G14-E294 PolarHBondContact N-O 3.34Å; G14-E294 CarbonylContact O-C 3.51Å; G14-E294 WeakPolarHBondContact O-CA 3.42Å; G14-E294 VanDerWaalsContact O-O 3.04Å
15	L	89.3	Confident	85.8	Confident	26 Å²	26	49.1 Å²	49.1	14%	0.136	25%	0.251	C	S	.	.			trans	-57.4	127.2	173.3	179.4	65.7	0	0	0	109.8	S32 N57 Y190 C278	L15-S32 PolarHBondContact N-OG 3.5Å; L15-S32 PolarHBondContact O-N 2.59Å; L15-S32 VanDerWaalsContact O-N 3.09Å; L15-S32 PolarHBondContact O-OG 3.46Å; L15-N57 WeakPolarHBondContact CD2-O 3.43Å; L15-Y190 HydrophobicContact CD1-CD2 4.15Å; L15-Y190 HydrophobicContact CD1-CE2 3.62Å; L15-C278 HydrophobicContact CD1-CB 3.81Å
16	T	93.4	Very high	87.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126.9	179.6	-56.4	0	0	0	0	108.9	G14 G30 C278 A292 G296 V298	G14-T16 PolarHBondContact O-N 3.48Å; G14-T16 PolarHBondContact O-OG1 3.37Å; T16-G30 WeakPolarHBondContact CA-O 3.32Å; T16-C278 WeakPolarHBondContact O-CB 3.31Å; T16-A292 HydrophobicContact CG2-CB 4.01Å; T16-G296 WeakPolarHBondContact OG1-CA 3.39Å; T16-V298 HydrophobicContact CG2-CG2 4.38Å
17	S	93.7	Very high	88.1	Confident	17 Å²	17	47 Å²	47	12%	0.119	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137	176.9	-170.7	0	0	0	0	109.1	T29 G30 I59	S17-T29 CarbonylContact O-C 3.59Å; S17-T29 VanDerWaalsContact O-CA 3.29Å; S17-T29 WeakPolarHBondContact O-CA 3.25Å; S17-G30 PolarHBondContact N-O 3.14Å; S17-G30 PolarHBondContact O-N 3.17Å; S17-I59 WeakPolarHBondContact OG-CG1 3.44Å
18	A	93.4	Very high	88.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	130.8	-177.5	0	0	0	0	0	109.5	V28 T29 S279 L290 A292 V298	A18-V28 WeakPolarHBondContact CA-O 3.45Å; A18-T29 HydrophobicContact CB-CG2 3.97Å; A18-S279 PolarHBondContact N-OG 3.35Å; A18-S279 VanDerWaalsContact N-OG 3.15Å; A18-S279 PolarHBondContact O-OG 3.44Å; A18-L290 HydrophobicContact CB-CD2 3.93Å; A18-L290 HydrophobicContact CB-CG 4.35Å; A18-A292 HydrophobicContact CB-CB 4.05Å; A18-V298 HydrophobicContact CB-CG1 4.23Å; A18-V298 HydrophobicContact CB-CG2 4.35Å
19	V	92.7	Very high	89	Confident	13 Å²	13	42.6 Å²	42.6	8%	0.079	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	157.2	-177.1	-62.2	0	0	0	0	110.5	V28 I59 C61 F281	V19-V28 HydrophobicContact CG2-CB 4.11Å; V19-V28 PolarHBondContact N-O 2.97Å; V19-V28 PolarHBondContact O-N 3.4Å; V19-I59 HydrophobicContact CG1-CG1 4.29Å; V19-I59 HydrophobicContact CG2-CD1 3.81Å; V19-I59 HydrophobicContact CG2-CG1 4.05Å; V19-C61 VanDerWaalsContact CG2-SG 3.56Å; V19-F281 HydrophobicContact CG1-CD2 4.27Å; V19-F281 HydrophobicContact CG1-CE2 4.49Å
20	Y	90.4	Very high	89.3	Confident	18 Å²	18	37.3 Å²	37.3	7%	0.071	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	153.1	167.9	-78.3	-73	0	0	0	111.2	C26 I27 F281 H283 L290 L300	Y20-C26 WeakPolarHBondContact CA-O 3.28Å; Y20-I27 HydrophobicContact CD1-CG1 3.71Å; Y20-I27 HydrophobicContact CE1-CD1 3.86Å; Y20-I27 HydrophobicContact CE1-CG1 3.3Å; Y20-F281 AromaticContact CD2-CD1 3.99Å; Y20-F281 HydrophobicContact CD2-CD1 3.99Å; Y20-H283 AromaticContact CD1-CD2 3.96Å; Y20-H283 HydrophobicContact CD2-CB 4.22Å; Y20-H283 AromaticContact CE1-CD2 3.66Å; Y20-H283 HydrophobicContact CE2-CB 3.8Å; Y20-H283 AromaticContact CE2-CD2 3.9Å; Y20-H283 AromaticContact CZ-CD2 3.64Å; Y20-L290 HydrophobicContact CD2-CB 4.34Å; Y20-L290 HydrophobicContact CD2-CD2 4.17Å; Y20-L290 HydrophobicContact CE2-CB 3.59Å; Y20-L290 HydrophobicContact CE2-CD2 3.99Å; Y20-L290 HydrophobicContact CE2-CG 4.33Å; Y20-L300 WeakPolarHBondContact OH-CD2 3.43Å
21	D	87.8	Confident	89.5	Confident	6 Å²	6	36.8 Å²	36.8	3%	0.032	17%	0.174	C	C	.	.			trans	-65.2	167.6	159.3	81.1	-41.8	0	0	0	110.7	H23 G24 R25 C26	D21-H23 PolarHBondContact O-N 3.11Å; D21-H23 IonicContact OD2-CD2 3.07Å; D21-G24 PolarHBondContact O-N 3.32Å; D21-G24 VanDerWaalsContact OD1-C 3.25Å; D21-G24 VanDerWaalsContact OD1-CA 3.29Å; D21-G24 WeakPolarHBondContact OD1-CA 3.4Å; D21-G24 PolarHBondContact OD1-N 3.39Å; D21-R25 PolarHBondContact OD1-N 3.2Å; D21-R25 IonicContact OD2-NE 2.86Å; D21-C26 HydrophobicContact CB-CB 4.35Å; D21-C26 PolarHBondContact N-O 3.3Å; D21-C26 PolarHBondContact OD1-N 2.73Å
22	I	81.2	Confident	89.3	Confident	61 Å²	61	38.4 Å²	38.4	31%	0.313	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.4	-175.1	65.8	172.5	0	0	0	113.2	Y63 L105	I22-Y63 HydrophobicContact CD1-CD1 3.76Å; I22-Y63 HydrophobicContact CD1-CE1 4.35Å; I22-L105 HydrophobicContact CG2-CD1 3.57Å
23	H	82.7	Confident	89.5	Confident	101 Å²	101	32.4 Å²	32.4	47%	0.468	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-7	-179.3	-60.7	-60.9	0	0	0	113	D21 R25	D21-H23 PolarHBondContact O-N 3.11Å; D21-H23 IonicContact OD2-CD2 3.07Å; H23-R25 HydrophobicContact CB-CG 3.82Å; H23-R25 PolarHBondContact CD2-NH2 3.34Å; H23-R25 PolarHBondContact O-N 3.02Å
24	G	82.6	Confident	89.5	Confident	14 Å²	14	25.6 Å²	25.6	14%	0.144	13%	0.132	C	C	.	.	S	Bend	trans	70.3	12.9	-174.3	0	0	0	0	0	114.4	D21 H283	D21-G24 PolarHBondContact O-N 3.32Å; D21-G24 VanDerWaalsContact OD1-C 3.25Å; D21-G24 VanDerWaalsContact OD1-CA 3.29Å; D21-G24 WeakPolarHBondContact OD1-CA 3.4Å; D21-G24 PolarHBondContact OD1-N 3.39Å; G24-H283 WeakPolarHBondContact CA-NE2 3.48Å; G24-H283 PolarHBondContact O-NE2 3.16Å
25	R	84.5	Confident	89.7	Confident	169 Å²	169	27.7 Å²	27.7	64%	0.638	14%	0.137	S	C	*	.	S	Bend	trans	-80.5	-32.9	-179.6	-64.3	-176.3	-61.4	176.3	2.2	113	D21 H23	D21-R25 PolarHBondContact OD1-N 3.2Å; D21-R25 IonicContact OD2-NE 2.86Å; H23-R25 HydrophobicContact CB-CG 3.82Å; H23-R25 PolarHBondContact CD2-NH2 3.34Å; H23-R25 PolarHBondContact O-N 3.02Å
26	C	88.4	Confident	89.8	Confident	23 Å²	23	26.7 Å²	26.7	16%	0.155	13%	0.132	C	C	.	.			trans	-127	146.8	-176.2	-64.6	0	0	0	0	110.8	Y20 D21 V38 F39	Y20-C26 WeakPolarHBondContact CA-O 3.28Å; D21-C26 HydrophobicContact CB-CB 4.35Å; D21-C26 PolarHBondContact N-O 3.3Å; D21-C26 PolarHBondContact OD1-N 2.73Å; C26-V38 HydrophobicContact CB-CG1 4.1Å; C26-F39 CarbonylContact C-O 3.54Å; C26-F39 WeakPolarHBondContact CA-O 3.46Å
27	I	90.7	Very high	89.7	Confident	8 Å²	8	28.2 Å²	28.2	4%	0.041	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.5	172	-61.7	164.6	0	0	0	107.6	Y20 T29 V38 F39 L42 L290	Y20-I27 HydrophobicContact CD1-CG1 3.71Å; Y20-I27 HydrophobicContact CE1-CD1 3.86Å; Y20-I27 HydrophobicContact CE1-CG1 3.3Å; I27-T29 HydrophobicContact CG2-CG2 3.89Å; I27-V38 WeakPolarHBondContact O-CA 3.16Å; I27-F39 HydrophobicContact CB-CB 4.29Å; I27-F39 PolarHBondContact N-O 3.44Å; I27-F39 PolarHBondContact O-N 3Å; I27-L42 HydrophobicContact CD1-CD1 4.38Å; I27-L42 HydrophobicContact CD1-CD2 3.79Å; I27-L42 HydrophobicContact CD1-CG 3.61Å; I27-L290 HydrophobicContact CD1-CD1 4.17Å; I27-L290 HydrophobicContact CG2-CD1 4.26Å; I27-L290 HydrophobicContact CG2-CD2 3.81Å
28	V	92.5	Very high	89.6	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.7	174.4	-174.7	0	0	0	0	108.2	A18 V19 I36 K37 V38 I59 C61 V66 M80	A18-V28 WeakPolarHBondContact CA-O 3.45Å; V19-V28 HydrophobicContact CG2-CB 4.11Å; V19-V28 PolarHBondContact N-O 2.97Å; V19-V28 PolarHBondContact O-N 3.4Å; V28-I36 HydrophobicContact CG1-CG2 3.79Å; V28-K37 WeakPolarHBondContact CA-O 3.23Å; V28-V38 HydrophobicContact CG1-CG2 4.33Å; V28-V38 HydrophobicContact CG2-CG1 4.15Å; V28-V38 HydrophobicContact CG2-CG2 4.18Å; V28-I59 HydrophobicContact CB-CD1 4.44Å; V28-I59 HydrophobicContact CG1-CD1 4.05Å; V28-I59 WeakPolarHBondContact O-CD1 3.24Å; V28-C61 VanDerWaalsContact CG2-SG 3.53Å; V28-V66 HydrophobicContact CG1-CG1 4.11Å; V28-V66 HydrophobicContact CG1-CG2 4.07Å; V28-V66 HydrophobicContact CG2-CG2 4.49Å; V28-M80 HydrophobicContact CG2-CG 4.43Å; V28-M80 HydrophobicContact CG2-SD 3.9Å
29	T	93.9	Very high	89.4	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.5	-178.3	59.3	0	0	0	0	110.1	H11 S17 A18 I27 I36 K37 F39 V298	H11-T29 WeakPolarHBondContact NE2-CB 3.42Å; H11-T29 PolarHBondContact NE2-OG1 3.44Å; H11-T29 VanDerWaalsContact NE2-OG1 3.13Å; S17-T29 CarbonylContact O-C 3.59Å; S17-T29 VanDerWaalsContact O-CA 3.29Å; S17-T29 WeakPolarHBondContact O-CA 3.25Å; A18-T29 HydrophobicContact CB-CG2 3.97Å; I27-T29 HydrophobicContact CG2-CG2 3.89Å; T29-I36 CarbonylContact O-C 3.51Å; T29-I36 VanDerWaalsContact O-CA 3.25Å; T29-I36 WeakPolarHBondContact O-CA 3.47Å; T29-K37 PolarHBondContact N-O 3.45Å; T29-K37 PolarHBondContact O-N 3.14Å; T29-K37 WeakPolarHBondContact OG1-CB 3.49Å; T29-K37 PolarHBondContact OG1-O 3.44Å; T29-K37 VanDerWaalsContact OG1-O 3.04Å; T29-F39 HydrophobicContact CG2-CD2 4.34Å; T29-F39 HydrophobicContact CG2-CE2 4.18Å; T29-F39 WeakPolarHBondContact OG1-CE2 3.42Å; T29-V298 HydrophobicContact CG2-CG2 4.01Å
30	G	92.8	Very high	89	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	131.1	177.2	0	0	0	0	0	109.9	T16 S17 K35	T16-G30 WeakPolarHBondContact CA-O 3.32Å; S17-G30 PolarHBondContact N-O 3.14Å; S17-G30 PolarHBondContact O-N 3.17Å; G30-K35 WeakPolarHBondContact CA-O 3.23Å
31	G	91.8	Very high	88.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	173.1	-172.1	0	0	0	0	0	115	D33 G34 K35 I56	G31-D33 PolarHBondContact O-N 3.42Å; G31-D33 VanDerWaalsContact O-N 3.15Å; G31-G34 PolarHBondContact O-N 2.87Å; G31-G34 VanDerWaalsContact O-N 3.1Å; G31-K35 PolarHBondContact N-O 2.96Å; G31-I56 WeakPolarHBondContact O-CB 3.47Å; G31-I56 PolarHBondContact O-N 3.31Å
32	S	88.8	Confident	87.9	Confident	41 Å²	41	37.5 Å²	37.5	29%	0.287	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-1.1	171.6	-63	0	0	0	0	114	G14 L15 G34	G14-S32 WeakPolarHBondContact CA-OG 3.38Å; L15-S32 PolarHBondContact N-OG 3.5Å; L15-S32 PolarHBondContact O-N 2.59Å; L15-S32 VanDerWaalsContact O-N 3.09Å; L15-S32 PolarHBondContact O-OG 3.46Å; S32-G34 VanDerWaalsContact C-N 3.32Å
33	D	91.3	Very high	87.7	Confident	27 Å²	27	40.5 Å²	40.5	14%	0.144	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	3.3	169.7	58.7	1.1	0	0	0	113.4	H11 K12 G31 K35 E54	H11-D33 IonicContact CE1-OD1 3.24Å; H11-D33 IonicContact CG-OD1 3.04Å; H11-D33 IonicContact CG-OD2 3.95Å; H11-D33 IonicContact ND1-OD1 2.7Å; H11-D33 PolarHBondContact ND1-OD1 3.43Å; H11-D33 IonicContact ND1-OD2 4Å; H11-D33 PolarHBondContact ND1-OD2 3.47Å; H11-D33 VanDerWaalsContact ND1-OD2 3.13Å; K12-D33 HydrophobicContact CB-CB 4.1Å; K12-D33 HydrophobicContact CD-CB 4.02Å; K12-D33 HydrophobicContact CG-CB 3.98Å; K12-D33 PolarHBondContact N-OD2 3.47Å; G31-D33 PolarHBondContact O-N 3.42Å; G31-D33 VanDerWaalsContact O-N 3.15Å; D33-K35 VanDerWaalsContact C-N 3.26Å; D33-K35 HydrophobicContact CB-CD 4.42Å; D33-K35 PolarHBondContact O-N 3.28Å; D33-K35 PolarHBondContact OD1-N 2.87Å; D33-E54 CarbonylContact C-O 3.57Å
34	G	89.2	Confident	87.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	78.2	10.4	175	0	0	0	0	0	114.3	G31 S32 V52 G53 E54	G31-G34 PolarHBondContact O-N 2.87Å; G31-G34 VanDerWaalsContact O-N 3.1Å; S32-G34 VanDerWaalsContact C-N 3.32Å; G34-V52 PolarHBondContact O-N 3.31Å; G34-G53 VanDerWaalsContact CA-O 3.27Å; G34-G53 WeakPolarHBondContact CA-O 3.46Å; G34-G53 PolarHBondContact O-N 3.04Å; G34-E54 PolarHBondContact N-O 3.34Å
35	K	91.9	Very high	86.9	Confident	57 Å²	57	42.1 Å²	42.1	25%	0.248	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	141.8	-173.9	-69.2	166.6	171	-151.7	0	111.3	H11 G30 G31 D33 E49 H50 I51 I56	H11-K35 PolarHBondContact CE1-O 3.35Å; G30-K35 WeakPolarHBondContact CA-O 3.23Å; G31-K35 PolarHBondContact N-O 2.96Å; D33-K35 VanDerWaalsContact C-N 3.26Å; D33-K35 HydrophobicContact CB-CD 4.42Å; D33-K35 PolarHBondContact O-N 3.28Å; D33-K35 PolarHBondContact OD1-N 2.87Å; K35-E49 HydrophobicContact CB-CG 4.48Å; K35-E49 HydrophobicContact CD-CG 4.47Å; K35-E49 WeakPolarHBondContact CD-OE1 3.29Å; K35-E49 WeakPolarHBondContact CE-OE1 3.4Å; K35-E49 IonicContact NZ-OE1 3.49Å; K35-E49 PolarHBondContact NZ-OE1 3.25Å; K35-H50 CarbonylContact C-O 3.43Å; K35-H50 WeakPolarHBondContact CA-O 3.38Å; K35-I51 HydrophobicContact CG-CG1 3.95Å; K35-I56 WeakPolarHBondContact O-CD1 3.18Å
36	I	92.5	Very high	86.5	Confident	6 Å²	6	39.2 Å²	39.2	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	134.3	163.9	-63.2	-178.6	0	0	0	108.3	V28 T29 V38 E49 H50 V52 I56 V66 V68 L78	V28-I36 HydrophobicContact CG1-CG2 3.79Å; T29-I36 CarbonylContact O-C 3.51Å; T29-I36 VanDerWaalsContact O-CA 3.25Å; T29-I36 WeakPolarHBondContact O-CA 3.47Å; I36-V38 HydrophobicContact CG2-CG2 4.36Å; I36-E49 WeakPolarHBondContact O-CA 3.49Å; I36-H50 PolarHBondContact N-O 3.34Å; I36-H50 PolarHBondContact O-N 3.05Å; I36-V52 HydrophobicContact CD1-CG2 3.68Å; I36-V52 HydrophobicContact CG1-CG2 3.89Å; I36-I56 HydrophobicContact CD1-CD1 4.16Å; I36-I56 HydrophobicContact CG1-CD1 3.39Å; I36-V66 HydrophobicContact CD1-CG1 4.32Å; I36-V68 HydrophobicContact CD1-CB 4.28Å; I36-V68 HydrophobicContact CD1-CG1 4.01Å; I36-V68 HydrophobicContact CD1-CG2 3.27Å; I36-L78 HydrophobicContact CD1-CD1 3.93Å
37	K	92	Very high	86.2	Confident	31 Å²	31	39.5 Å²	39.5	14%	0.135	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.5	173.6	-68	175.3	170.4	-170.2	0	110.7	V10 V28 T29 F39 P47 V48 E49	V10-K37 HydrophobicContact CG1-CB 4.38Å; V10-K37 HydrophobicContact CG1-CD 3.49Å; V10-K37 VanDerWaalsContact CG1-CD 3.49Å; V10-K37 PolarHBondContact O-NZ 3.41Å; V28-K37 WeakPolarHBondContact CA-O 3.23Å; T29-K37 PolarHBondContact N-O 3.45Å; T29-K37 PolarHBondContact O-N 3.14Å; T29-K37 WeakPolarHBondContact OG1-CB 3.49Å; T29-K37 PolarHBondContact OG1-O 3.44Å; T29-K37 VanDerWaalsContact OG1-O 3.04Å; K37-F39 HydrophobicContact CB-CD2 4.3Å; K37-F39 HydrophobicContact CB-CE2 3.46Å; K37-F39 VanDerWaalsContact CB-CE2 3.46Å; K37-F39 HydrophobicContact CB-CZ 3.95Å; K37-F39 HydrophobicContact CD-CE2 4.41Å; K37-F39 HydrophobicContact CD-CZ 4.16Å; K37-P47 HydrophobicContact CB-CB 4.44Å; K37-V48 CarbonylContact C-O 3.51Å; K37-V48 VanDerWaalsContact CA-O 3.27Å; K37-V48 WeakPolarHBondContact CA-O 3.37Å; K37-E49 WeakPolarHBondContact CE-OE2 3.46Å; K37-E49 HydrophobicContact CG-CB 4.13Å; K37-E49 HydrophobicContact CG-CG 3.91Å; K37-E49 IonicContact NZ-OE2 3.79Å
38	V	91	Very high	85.9	Confident	13 Å²	13	42.3 Å²	42.3	8%	0.079	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.8	178.3	-172.5	0	0	0	0	108.7	C26 I27 V28 I36 P47 V48 M80	C26-V38 HydrophobicContact CB-CG1 4.1Å; I27-V38 WeakPolarHBondContact O-CA 3.16Å; V28-V38 HydrophobicContact CG1-CG2 4.33Å; V28-V38 HydrophobicContact CG2-CG1 4.15Å; V28-V38 HydrophobicContact CG2-CG2 4.18Å; I36-V38 HydrophobicContact CG2-CG2 4.36Å; V38-P47 WeakPolarHBondContact O-CA 3.46Å; V38-P47 VanDerWaalsContact O-CB 3.29Å; V38-P47 WeakPolarHBondContact O-CB 3.15Å; V38-V48 HydrophobicContact CB-CB 4.26Å; V38-V48 PolarHBondContact N-O 3.46Å; V38-V48 PolarHBondContact O-N 3.34Å; V38-V48 VanDerWaalsContact O-N 3.08Å; V38-M80 HydrophobicContact CG1-CG 4.06Å; V38-M80 HydrophobicContact CG1-SD 4.18Å; V38-M80 HydrophobicContact CG2-CG 3.83Å
39	F	87.9	Confident	85.6	Confident	10 Å²	10	46 Å²	46	4%	0.044	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.8	-177.5	-63.1	-96.6	0	0	0	109.6	V10 C26 I27 T29 K37 S41 D44 P47	V10-F39 HydrophobicContact CB-CZ 4.32Å; V10-F39 HydrophobicContact CG1-CE2 3.65Å; V10-F39 HydrophobicContact CG1-CZ 3.44Å; V10-F39 VanDerWaalsContact CG1-CZ 3.44Å; V10-F39 HydrophobicContact CG2-CE2 4.36Å; V10-F39 HydrophobicContact CG2-CZ 3.86Å; C26-F39 CarbonylContact C-O 3.54Å; C26-F39 WeakPolarHBondContact CA-O 3.46Å; I27-F39 HydrophobicContact CB-CB 4.29Å; I27-F39 PolarHBondContact N-O 3.44Å; I27-F39 PolarHBondContact O-N 3Å; T29-F39 HydrophobicContact CG2-CD2 4.34Å; T29-F39 HydrophobicContact CG2-CE2 4.18Å; T29-F39 WeakPolarHBondContact OG1-CE2 3.42Å; K37-F39 HydrophobicContact CB-CD2 4.3Å; K37-F39 HydrophobicContact CB-CE2 3.46Å; K37-F39 VanDerWaalsContact CB-CE2 3.46Å; K37-F39 HydrophobicContact CB-CZ 3.95Å; K37-F39 HydrophobicContact CD-CE2 4.41Å; K37-F39 HydrophobicContact CD-CZ 4.16Å; F39-S41 VanDerWaalsContact C-N 3.31Å; F39-D44 HydrophobicContact CD1-CB 4.25Å; F39-P47 HydrophobicContact CD1-CB 3.62Å; F39-P47 HydrophobicContact CD1-CG 4.11Å; F39-P47 HydrophobicContact CD2-CB 4.28Å; F39-P47 HydrophobicContact CE1-CB 3.47Å; F39-P47 VanDerWaalsContact CE1-CB 3.47Å; F39-P47 HydrophobicContact CE1-CG 3.46Å; F39-P47 VanDerWaalsContact CE1-CG 3.46Å; F39-P47 HydrophobicContact CE2-CB 4.14Å; F39-P47 HydrophobicContact CG-CB 4.01Å; F39-P47 HydrophobicContact CZ-CB 3.72Å; F39-P47 HydrophobicContact CZ-CG 3.67Å
40	E	84.4	Confident	85.3	Confident	162 Å²	162	48 Å²	48	76%	0.757	28%	0.275	S	S	*	.	S	Bend	trans	-71.6	-32.4	165.9	-65.4	-173.9	167.6	0	0	111.3
41	S	80.4	Confident	85.1	Confident	56 Å²	56	54.2 Å²	54.2	39%	0.392	31%	0.307	S	S	.	.	S	Bend	trans	-149.6	153.1	171.8	173.2	0	0	0	0	108.5	F39 D43 D44	F39-S41 VanDerWaalsContact C-N 3.31Å; S41-D43 PolarHBondContact O-N 3.29Å; S41-D43 PolarHBondContact OG-N 3.36Å; S41-D44 WeakPolarHBondContact O-CB 3.26Å; S41-D44 PolarHBondContact O-N 3.42Å
42	L	75.8	Confident	84.8	Confident	8 Å²	8	56 Å²	56	4%	0.042	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-13.5	173	-70.2	-178	0	0	0	112.7	K5 I27 D44 V298 L300	K5-L42 HydrophobicContact CD-CB 3.83Å; K5-L42 HydrophobicContact CD-CD1 4.38Å; K5-L42 PolarHBondContact NZ-O 3.49Å; I27-L42 HydrophobicContact CD1-CD1 4.38Å; I27-L42 HydrophobicContact CD1-CD2 3.79Å; I27-L42 HydrophobicContact CD1-CG 3.61Å; L42-D44 VanDerWaalsContact C-N 3.28Å; L42-V298 HydrophobicContact CD1-CG1 4.5Å; L42-V298 HydrophobicContact CD2-CB 4.39Å; L42-V298 HydrophobicContact CD2-CG1 3.98Å; L42-L300 HydrophobicContact CD1-CB 4.33Å; L42-L300 HydrophobicContact CD1-CD1 3.49Å; L42-L300 VanDerWaalsContact CD1-CD1 3.49Å; L42-L300 HydrophobicContact CD1-CG 3.69Å; L42-L300 HydrophobicContact CG-CD1 4.07Å
43	D	76.3	Confident	84.6	Confident	125 Å²	125	55 Å²	55	67%	0.668	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-4.2	174.9	-70.3	-63.9	0	0	0	112.9	K5 S41 A45	K5-D43 IonicContact NZ-OD1 3.69Å; K5-D43 PolarHBondContact NZ-OD1 3.2Å; K5-D43 IonicContact NZ-OD2 2.61Å; K5-D43 PolarHBondContact NZ-OD2 3.2Å; S41-D43 PolarHBondContact O-N 3.29Å; S41-D43 PolarHBondContact OG-N 3.36Å; D43-A45 PolarHBondContact O-N 3.28Å
44	D	77.4	Confident	84.3	Confident	54 Å²	54	61.3 Å²	61.3	29%	0.289	34%	0.343	S	S	.	.			trans	-63.9	120.4	178.4	-176	7.1	0	0	0	110.6	F39 S41 L42 C46	F39-D44 HydrophobicContact CD1-CB 4.25Å; S41-D44 WeakPolarHBondContact O-CB 3.26Å; S41-D44 PolarHBondContact O-N 3.42Å; L42-D44 VanDerWaalsContact C-N 3.28Å; D44-C46 VanDerWaalsContact C-N 3.31Å; D44-C46 PolarHBondContact OD1-N 2.89Å
45	A	71.5	Confident	84.4	Confident	95 Å²	95	64.3 Å²	64.3	79%	0.785	36%	0.356	S	S	*	.	S	Bend	trans	-76.2	-21.6	179.7	0	0	0	0	0	112.4	D43	D43-A45 PolarHBondContact O-N 3.28Å
46	C	75.2	Confident	84.5	Confident	107 Å²	107	61.6 Å²	61.6	72%	0.723	34%	0.344	S	S	*	.	S	Bend	trans	-136.7	67	-170.9	-65.8	0	0	0	0	111.2	D44	D44-C46 VanDerWaalsContact C-N 3.31Å; D44-C46 PolarHBondContact OD1-N 2.89Å
47	P	83	Confident	84.5	Confident	30 Å²	30	62 Å²	62	20%	0.195	35%	0.346	C	S	.	.			trans	-62.4	152.2	177.2	29.2	-37.3	0	0	0	111.6	K37 V38 F39 E49	K37-P47 HydrophobicContact CB-CB 4.44Å; V38-P47 WeakPolarHBondContact O-CA 3.46Å; V38-P47 VanDerWaalsContact O-CB 3.29Å; V38-P47 WeakPolarHBondContact O-CB 3.15Å; F39-P47 HydrophobicContact CD1-CB 3.62Å; F39-P47 HydrophobicContact CD1-CG 4.11Å; F39-P47 HydrophobicContact CD2-CB 4.28Å; F39-P47 HydrophobicContact CE1-CB 3.47Å; F39-P47 VanDerWaalsContact CE1-CB 3.47Å; F39-P47 HydrophobicContact CE1-CG 3.46Å; F39-P47 VanDerWaalsContact CE1-CG 3.46Å; F39-P47 HydrophobicContact CE2-CB 4.14Å; F39-P47 HydrophobicContact CG-CB 4.01Å; F39-P47 HydrophobicContact CZ-CB 3.72Å; F39-P47 HydrophobicContact CZ-CG 3.67Å; P47-E49 PolarHBondContact O-N 3.13Å
48	V	83.9	Confident	84.6	Confident	66 Å²	66	60.5 Å²	60.5	40%	0.4	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	121.7	169.3	177.6	0	0	0	0	108	K37 V38 H50 E81	K37-V48 CarbonylContact C-O 3.51Å; K37-V48 VanDerWaalsContact CA-O 3.27Å; K37-V48 WeakPolarHBondContact CA-O 3.37Å; V38-V48 HydrophobicContact CB-CB 4.26Å; V38-V48 PolarHBondContact N-O 3.46Å; V38-V48 PolarHBondContact O-N 3.34Å; V38-V48 VanDerWaalsContact O-N 3.08Å; V48-H50 WeakPolarHBondContact CG1-NE2 3.43Å; V48-E81 WeakPolarHBondContact CG1-O 3.49Å
49	E	87.2	Confident	84.7	Confident	77 Å²	77	60.2 Å²	60.2	36%	0.36	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.3	-175.2	-176.6	-176.9	142.5	0	0	111.5	K35 I36 K37 P47	K35-E49 HydrophobicContact CB-CG 4.48Å; K35-E49 HydrophobicContact CD-CG 4.47Å; K35-E49 WeakPolarHBondContact CD-OE1 3.29Å; K35-E49 WeakPolarHBondContact CE-OE1 3.4Å; K35-E49 IonicContact NZ-OE1 3.49Å; K35-E49 PolarHBondContact NZ-OE1 3.25Å; I36-E49 WeakPolarHBondContact O-CA 3.49Å; K37-E49 WeakPolarHBondContact CE-OE2 3.46Å; K37-E49 HydrophobicContact CG-CB 4.13Å; K37-E49 HydrophobicContact CG-CG 3.91Å; K37-E49 IonicContact NZ-OE2 3.79Å; P47-E49 PolarHBondContact O-N 3.13Å
50	H	87.4	Confident	85	Confident	44 Å²	44	60.2 Å²	60.2	20%	0.204	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.7	178.4	-63.3	-62.4	0	0	0	111	K35 I36 V48 E81 D82 G83	K35-H50 CarbonylContact C-O 3.43Å; K35-H50 WeakPolarHBondContact CA-O 3.38Å; I36-H50 PolarHBondContact N-O 3.34Å; I36-H50 PolarHBondContact O-N 3.05Å; V48-H50 WeakPolarHBondContact CG1-NE2 3.43Å; H50-E81 PolarHBondContact NE2-O 2.82Å; H50-E81 VanDerWaalsContact NE2-O 3.08Å; H50-D82 PolarHBondContact CE1-O 3.34Å; H50-D82 VanDerWaalsContact NE2-C 3.26Å; H50-G83 WeakPolarHBondContact CD2-CA 3.28Å; H50-G83 PolarHBondContact CE1-N 2.8Å; H50-G83 WeakPolarHBondContact NE2-CA 3.38Å; H50-G83 PolarHBondContact NE2-N 3.46Å; H50-G83 VanDerWaalsContact NE2-N 3.16Å
51	I	88.2	Confident	85.3	Confident	129 Å²	129	53.1 Å²	53.1	66%	0.662	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.4	174.9	-60.4	169.1	0	0	0	108.2	K35	K35-I51 HydrophobicContact CG-CG1 3.95Å
52	V	84.8	Confident	85.6	Confident	38 Å²	38	53 Å²	53	23%	0.23	30%	0.299	C	S	.	.			trans	-112.1	-28.6	-173.1	-176.1	0	0	0	0	112.3	G34 I36 V68 T70 L78	G34-V52 PolarHBondContact O-N 3.31Å; I36-V52 HydrophobicContact CD1-CG2 3.68Å; I36-V52 HydrophobicContact CG1-CG2 3.89Å; V52-V68 HydrophobicContact CG1-CG1 4.25Å; V52-T70 HydrophobicContact CG1-CG2 3.87Å; V52-L78 HydrophobicContact CB-CD1 4.17Å; V52-L78 HydrophobicContact CG1-CD1 3.66Å; V52-L78 HydrophobicContact CG2-CD1 3.36Å
53	G	84.7	Confident	86.1	Confident	21 Å²	21	58.2 Å²	58.2	22%	0.216	32%	0.319	C	S	.	.	S	Bend	trans	-168.4	-160.7	-178.9	0	0	0	0	0	111.7	G34	G34-G53 VanDerWaalsContact CA-O 3.27Å; G34-G53 WeakPolarHBondContact CA-O 3.46Å; G34-G53 PolarHBondContact O-N 3.04Å
54	E	86.3	Confident	86.6	Confident	158 Å²	158	58.1 Å²	58.1	74%	0.738	31%	0.314	S	S	*	.	S	Bend	trans	-84.3	-35.5	173.6	-61.1	-171.7	166.7	0	0	112.4	D33 G34 E71	D33-E54 CarbonylContact C-O 3.57Å; G34-E54 PolarHBondContact N-O 3.34Å; E54-E71 HydrophobicContact CB-CG 4.21Å; E54-E71 PolarHBondContact N-OE1 3.38Å; E54-E71 PolarHBondContact N-OE2 2.91Å
55	K	90.3	Very high	87.3	Confident	63 Å²	63	56.8 Å²	56.8	27%	0.274	31%	0.307	S	S	.	.			trans	-145.9	151.1	176	98.4	-171.9	166.6	158.6	0	111.4	N57 T70 E71 E95	K55-N57 WeakPolarHBondContact CE-OD1 3.01Å; K55-N57 PolarHBondContact NZ-OD1 3.46Å; K55-T70 CarbonylContact O-C 3.51Å; K55-T70 WeakPolarHBondContact O-CA 3.46Å; K55-T70 WeakPolarHBondContact O-CB 3.46Å; K55-E71 HydrophobicContact CD-CB 4.12Å; K55-E71 HydrophobicContact CG-CB 3.9Å; K55-E71 PolarHBondContact N-OE2 3.09Å; K55-E71 PolarHBondContact O-N 3.29Å; K55-E71 VanDerWaalsContact O-N 3.14Å; K55-E95 WeakPolarHBondContact CE-OE2 3.49Å; K55-E95 IonicContact NZ-OE2 3.51Å; K55-E95 PolarHBondContact NZ-OE2 3.11Å
56	I	93.6	Very high	88.3	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.6	171.5	-60.7	176.2	0	0	0	109.3	G31 K35 I36 I59 V68 T70	G31-I56 WeakPolarHBondContact O-CB 3.47Å; G31-I56 PolarHBondContact O-N 3.31Å; K35-I56 WeakPolarHBondContact O-CD1 3.18Å; I36-I56 HydrophobicContact CD1-CD1 4.16Å; I36-I56 HydrophobicContact CG1-CD1 3.39Å; I56-I59 HydrophobicContact CG2-CG2 3.61Å; I56-V68 HydrophobicContact CD1-CG1 4.09Å; I56-V68 HydrophobicContact CG1-CG1 4.11Å; I56-V68 HydrophobicContact CG2-CG1 3.87Å; I56-T70 HydrophobicContact CG1-CG2 4.5Å
57	N	92.5	Very high	89.1	Confident	13 Å²	13	47.3 Å²	47.3	7%	0.07	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-39.4	179.4	-70.9	-22.1	0	0	0	112.2	L15 K55 A69 V96	L15-N57 WeakPolarHBondContact CD2-O 3.43Å; K55-N57 WeakPolarHBondContact CE-OD1 3.01Å; K55-N57 PolarHBondContact NZ-OD1 3.46Å; N57-A69 PolarHBondContact N-O 3.23Å; N57-V96 WeakPolarHBondContact CB-O 3.28Å; N57-V96 PolarHBondContact ND2-O 2.87Å
58	A	94.1	Very high	89.6	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	154	179.9	0	0	0	0	0	112	A69 L99	A58-A69 HydrophobicContact CB-CB 4.47Å; A58-A69 PolarHBondContact O-N 3.36Å; A58-L99 HydrophobicContact CB-CD2 4.13Å; A58-L99 HydrophobicContact CB-CG 3.82Å
59	I	94.9	Very high	90.1	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.036	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	153.5	178	60.2	173.6	0	0	0	111.3	S17 V19 V28 I56 V66 I67 V68	S17-I59 WeakPolarHBondContact OG-CG1 3.44Å; V19-I59 HydrophobicContact CG1-CG1 4.29Å; V19-I59 HydrophobicContact CG2-CD1 3.81Å; V19-I59 HydrophobicContact CG2-CG1 4.05Å; V28-I59 HydrophobicContact CB-CD1 4.44Å; V28-I59 HydrophobicContact CG1-CD1 4.05Å; V28-I59 WeakPolarHBondContact O-CD1 3.24Å; I56-I59 HydrophobicContact CG2-CG2 3.61Å; I59-V66 HydrophobicContact CB-CG1 4.42Å; I59-I67 CarbonylContact C-O 3.56Å; I59-I67 WeakPolarHBondContact CA-O 3.37Å; I59-V68 HydrophobicContact CG2-CG1 4.33Å
60	A	92.7	Very high	90.3	Very high	10 Å²	10	39.4 Å²	39.4	8%	0.083	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	146	164.3	0	0	0	0	0	111	I67 L99 M101	A60-I67 PolarHBondContact N-O 3.04Å; A60-I67 PolarHBondContact O-N 2.8Å; A60-L99 HydrophobicContact CB-CD1 3.2Å; A60-M101 HydrophobicContact CB-CG 3.69Å
61	C	90.5	Very high	90.1	Very high	13 Å²	13	40.5 Å²	40.5	9%	0.088	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	136.7	176.2	-65.2	0	0	0	0	111	V19 V28	V19-C61 VanDerWaalsContact CG2-SG 3.56Å; V28-C61 VanDerWaalsContact CG2-SG 3.53Å
62	R	88.2	Confident	89.9	Confident	54 Å²	54	35.6 Å²	35.6	20%	0.204	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	100.6	172.9	174.8	175.7	-176.5	-92.7	1.7	108.7	E64 N65 I67 L105	R62-E64 PolarHBondContact O-N 3.01Å; R62-E64 VanDerWaalsContact O-N 3.16Å; R62-N65 CarbonylContact C-O 3.5Å; R62-N65 PolarHBondContact N-O 2.88Å; R62-N65 PolarHBondContact O-N 2.71Å; R62-I67 HydrophobicContact CB-CD1 4.4Å; R62-L105 WeakPolarHBondContact CD-O 3.49Å; R62-L105 HydrophobicContact CG-CB 4.24Å; R62-L105 PolarHBondContact NE-O 3.43Å
63	Y	86.5	Confident	89.9	Confident	116 Å²	116	35.4 Å²	35.4	46%	0.455	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	-117	-174.7	-48.5	-70.2	0	0	0	111	I22 L105	I22-Y63 HydrophobicContact CD1-CD1 3.76Å; I22-Y63 HydrophobicContact CD1-CE1 4.35Å; Y63-L105 HydrophobicContact CD1-CD1 4.41Å; Y63-L105 HydrophobicContact CE1-CD1 4.06Å; Y63-L105 HydrophobicContact CE2-CB 4.31Å
64	E	86.3	Confident	90	Very high	124 Å²	124	39.5 Å²	39.5	58%	0.579	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	2.6	178.9	-63.7	176.8	179.6	0	0	113.2	R62 M80	R62-E64 PolarHBondContact O-N 3.01Å; R62-E64 VanDerWaalsContact O-N 3.16Å; E64-M80 WeakPolarHBondContact O-CB 3.34Å; E64-M80 PolarHBondContact O-N 2.76Å
65	N	90.7	Very high	90.2	Very high	26 Å²	26	32 Å²	32	14%	0.139	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	147.6	179.4	-68.7	-11.9	0	0	0	111.6	R62 I77 L78 D86	R62-N65 CarbonylContact C-O 3.5Å; R62-N65 PolarHBondContact N-O 2.88Å; R62-N65 PolarHBondContact O-N 2.71Å; N65-I77 HydrophobicContact CB-CG2 3.89Å; N65-L78 CarbonylContact C-O 3.17Å; N65-L78 WeakPolarHBondContact CA-O 3.2Å; N65-D86 PolarHBondContact ND2-OD2 2.69Å
66	V	92.4	Very high	90.2	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.6	171.5	-174.2	0	0	0	0	108.6	V28 I36 I59 V68 L78 M80	V28-V66 HydrophobicContact CG1-CG1 4.11Å; V28-V66 HydrophobicContact CG1-CG2 4.07Å; V28-V66 HydrophobicContact CG2-CG2 4.49Å; I36-V66 HydrophobicContact CD1-CG1 4.32Å; I59-V66 HydrophobicContact CB-CG1 4.42Å; V66-V68 HydrophobicContact CB-CG2 4.46Å; V66-V68 HydrophobicContact CG1-CG2 3.85Å; V66-L78 PolarHBondContact N-O 3.49Å; V66-L78 PolarHBondContact O-N 2.71Å; V66-M80 HydrophobicContact CG2-CB 3.95Å; V66-M80 HydrophobicContact CG2-CG 3.96Å
67	I	93.7	Very high	90.1	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128.7	175.6	-53.4	174.4	0	0	0	108.3	I59 A60 R62 V75 H76 I77 A89 M101 I108 L122	I59-I67 CarbonylContact C-O 3.56Å; I59-I67 WeakPolarHBondContact CA-O 3.37Å; A60-I67 PolarHBondContact N-O 3.04Å; A60-I67 PolarHBondContact O-N 2.8Å; R62-I67 HydrophobicContact CB-CD1 4.4Å; I67-V75 HydrophobicContact CG2-CG1 3.56Å; I67-H76 CarbonylContact C-O 3.56Å; I67-H76 WeakPolarHBondContact CA-O 3.47Å; I67-I77 HydrophobicContact CG1-CG1 4.3Å; I67-I77 HydrophobicContact CG1-CG2 4.49Å; I67-A89 HydrophobicContact CG2-CB 4.4Å; I67-M101 HydrophobicContact CD1-SD 3.95Å; I67-I108 HydrophobicContact CB-CD1 4.07Å; I67-I108 HydrophobicContact CD1-CD1 3.83Å; I67-I108 HydrophobicContact CG2-CD1 3.55Å; I67-L122 HydrophobicContact CD1-CD1 3.56Å
68	V	93.4	Very high	90	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127.1	-164.2	-170.5	0	0	0	0	110.1	I36 V52 I56 I59 V66 T70 H76 L78	I36-V68 HydrophobicContact CD1-CB 4.28Å; I36-V68 HydrophobicContact CD1-CG1 4.01Å; I36-V68 HydrophobicContact CD1-CG2 3.27Å; V52-V68 HydrophobicContact CG1-CG1 4.25Å; I56-V68 HydrophobicContact CD1-CG1 4.09Å; I56-V68 HydrophobicContact CG1-CG1 4.11Å; I56-V68 HydrophobicContact CG2-CG1 3.87Å; I59-V68 HydrophobicContact CG2-CG1 4.33Å; V66-V68 HydrophobicContact CB-CG2 4.46Å; V66-V68 HydrophobicContact CG1-CG2 3.85Å; V68-T70 HydrophobicContact CG1-CG2 3.95Å; V68-H76 PolarHBondContact N-O 2.71Å; V68-H76 PolarHBondContact O-N 3.35Å; V68-L78 HydrophobicContact CG2-CD1 3.92Å; V68-L78 HydrophobicContact CG2-CG 4.31Å
69	A	93.7	Very high	89.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	113.2	167.7	0	0	0	0	0	109.5	N57 A58 V96 L99	N57-A69 PolarHBondContact N-O 3.23Å; A58-A69 HydrophobicContact CB-CB 4.47Å; A58-A69 PolarHBondContact O-N 3.36Å; A69-V96 HydrophobicContact CB-CB 3.79Å; A69-V96 HydrophobicContact CB-CG1 3.7Å; A69-L99 HydrophobicContact CB-CD2 4.01Å
70	T	91	Very high	89.3	Confident	7 Å²	7	36.3 Å²	36.3	4%	0.043	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-172.8	178	61.8	0	0	0	0	111.9	V52 K55 I56 V68 G72	V52-T70 HydrophobicContact CG1-CG2 3.87Å; K55-T70 CarbonylContact O-C 3.51Å; K55-T70 WeakPolarHBondContact O-CA 3.46Å; K55-T70 WeakPolarHBondContact O-CB 3.46Å; I56-T70 HydrophobicContact CG1-CG2 4.5Å; V68-T70 HydrophobicContact CG1-CG2 3.95Å; T70-G72 PolarHBondContact O-N 3.32Å; T70-G72 PolarHBondContact OG1-N 3.38Å
71	E	84.5	Confident	88.7	Confident	66 Å²	66	41.4 Å²	41.4	31%	0.308	20%	0.196	S	C	.	.	S	Bend	trans	-58.1	-20.9	168.3	69.5	-73.4	173.6	0	0	113.6	E54 K55	E54-E71 HydrophobicContact CB-CG 4.21Å; E54-E71 PolarHBondContact N-OE1 3.38Å; E54-E71 PolarHBondContact N-OE2 2.91Å; K55-E71 HydrophobicContact CD-CB 4.12Å; K55-E71 HydrophobicContact CG-CB 3.9Å; K55-E71 PolarHBondContact N-OE2 3.09Å; K55-E71 PolarHBondContact O-N 3.29Å; K55-E71 VanDerWaalsContact O-N 3.14Å
72	G	82.9	Confident	88.3	Confident	26 Å²	26	45.3 Å²	45.3	27%	0.268	22%	0.216	S	C	.	.	S	Bend	trans	-71.9	176.9	179.9	0	0	0	0	0	113.5	T70 Y74	T70-G72 PolarHBondContact O-N 3.32Å; T70-G72 PolarHBondContact OG1-N 3.38Å; G72-Y74 VanDerWaalsContact C-N 3.34Å
73	T	84.9	Confident	87.8	Confident	35 Å²	35	43.5 Å²	43.5	22%	0.215	21%	0.214	C	C	.	.	S	Bend	trans	-87.6	-7.7	173.4	56.8	0	0	0	0	113.2	R91 F92	T73-R91 CarbonylContact O-C 3.54Å; T73-R91 WeakPolarHBondContact O-CA 3.44Å; T73-F92 WeakPolarHBondContact CB-O 3.15Å; T73-F92 PolarHBondContact O-N 3.08Å
74	Y	87.1	Confident	87.8	Confident	106 Å²	106	42.6 Å²	42.6	42%	0.416	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	140.4	-176.1	-74.2	-91	0	0	0	110.1	G72 H76 V88 R91	G72-Y74 VanDerWaalsContact C-N 3.34Å; Y74-H76 WeakPolarHBondContact CB-NE2 3.5Å; Y74-V88 HydrophobicContact CD1-CG1 3.79Å; Y74-V88 HydrophobicContact CD1-CG2 4.34Å; Y74-R91 HydrophobicContact CD1-CB 4Å; Y74-R91 HydrophobicContact CE1-CB 4.02Å
75	V	90.9	Very high	87.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	114.3	172.3	-177.4	0	0	0	0	107.3	I67 V88 A89 T90 F92 V96 L110	I67-V75 HydrophobicContact CG2-CG1 3.56Å; V75-V88 CarbonylContact O-C 3.6Å; V75-V88 WeakPolarHBondContact O-CA 3.32Å; V75-A89 HydrophobicContact CB-CB 4.26Å; V75-A89 HydrophobicContact CG1-CB 4.01Å; V75-A89 PolarHBondContact O-N 2.95Å; V75-T90 HydrophobicContact CG2-CG2 4.3Å; V75-T90 PolarHBondContact N-O 2.68Å; V75-F92 HydrophobicContact CG2-CD2 4.28Å; V75-F92 HydrophobicContact CG2-CE2 4.3Å; V75-V96 HydrophobicContact CG2-CB 4.43Å; V75-V96 HydrophobicContact CG2-CG1 4.41Å; V75-V96 HydrophobicContact CG2-CG2 3.76Å; V75-L110 HydrophobicContact CG1-CD1 4.37Å; V75-L110 HydrophobicContact CG1-CD2 4Å; V75-L110 HydrophobicContact CG2-CD1 4.25Å; V75-L110 HydrophobicContact CG2-CD2 4.09Å
76	H	90.3	Very high	87.5	Confident	56 Å²	56	45 Å²	45	26%	0.259	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	145.6	-173.2	-68.2	-82.7	0	0	0	111.1	I67 V68 Y74 L78	I67-H76 CarbonylContact C-O 3.56Å; I67-H76 WeakPolarHBondContact CA-O 3.47Å; V68-H76 PolarHBondContact N-O 2.71Å; V68-H76 PolarHBondContact O-N 3.35Å; Y74-H76 WeakPolarHBondContact CB-NE2 3.5Å; H76-L78 HydrophobicContact CB-CD2 4.23Å
77	I	91.2	Very high	87.1	Confident	22 Å²	22	46.2 Å²	46.2	11%	0.113	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	121.8	168.1	-51.5	179.9	0	0	0	105.8	N65 I67 D86 G87 A89 L122	N65-I77 HydrophobicContact CB-CG2 3.89Å; I67-I77 HydrophobicContact CG1-CG1 4.3Å; I67-I77 HydrophobicContact CG1-CG2 4.49Å; I77-D86 HydrophobicContact CG2-CB 4.16Å; I77-D86 PolarHBondContact O-N 2.85Å; I77-G87 PolarHBondContact N-O 3.32Å; I77-G87 PolarHBondContact O-N 3.41Å; I77-G87 VanDerWaalsContact O-N 3.11Å; I77-A89 HydrophobicContact CD1-CB 3.99Å; I77-A89 HydrophobicContact CG1-CB 3.92Å; I77-L122 HydrophobicContact CD1-CD2 4.27Å
78	L	90.7	Very high	86.8	Confident	12 Å²	12	49.9 Å²	49.9	6%	0.063	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	148.4	-178.9	-52.8	178.5	0	0	0	109.8	I36 V52 N65 V66 V68 H76 L84 P85	I36-L78 HydrophobicContact CD1-CD1 3.93Å; V52-L78 HydrophobicContact CB-CD1 4.17Å; V52-L78 HydrophobicContact CG1-CD1 3.66Å; V52-L78 HydrophobicContact CG2-CD1 3.36Å; N65-L78 CarbonylContact C-O 3.17Å; N65-L78 WeakPolarHBondContact CA-O 3.2Å; V66-L78 PolarHBondContact N-O 3.49Å; V66-L78 PolarHBondContact O-N 2.71Å; V68-L78 HydrophobicContact CG2-CD1 3.92Å; V68-L78 HydrophobicContact CG2-CG 4.31Å; H76-L78 HydrophobicContact CB-CD2 4.23Å; L78-L84 CarbonylContact C-O 3.47Å; L78-L84 VanDerWaalsContact CA-O 3.31Å; L78-L84 WeakPolarHBondContact CA-O 3.44Å; L78-P85 HydrophobicContact CD2-CB 3.98Å
79	Q	88.8	Confident	86.5	Confident	60 Å²	60	50.6 Å²	50.6	28%	0.28	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	133.6	168.8	-167.4	177.1	-15	0	0	109.7	G83 L84	Q79-G83 WeakPolarHBondContact O-CA 3.29Å; Q79-G83 PolarHBondContact O-N 3.12Å; Q79-L84 PolarHBondContact N-O 3.02Å
80	M	84.2	Confident	86.2	Confident	27 Å²	27	51 Å²	51	13%	0.133	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-38	-173.5	-172.9	176.5	64	0	0	113	V28 V38 E64 V66	V28-M80 HydrophobicContact CG2-CG 4.43Å; V28-M80 HydrophobicContact CG2-SD 3.9Å; V38-M80 HydrophobicContact CG1-CG 4.06Å; V38-M80 HydrophobicContact CG1-SD 4.18Å; V38-M80 HydrophobicContact CG2-CG 3.83Å; E64-M80 WeakPolarHBondContact O-CB 3.34Å; E64-M80 PolarHBondContact O-N 2.76Å; V66-M80 HydrophobicContact CG2-CB 3.95Å; V66-M80 HydrophobicContact CG2-CG 3.96Å
81	E	81.2	Confident	85.9	Confident	116 Å²	116	53 Å²	53	54%	0.542	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-60.2	-177.1	-61.6	-177.2	164.3	0	0	111.6	V48 H50	V48-E81 WeakPolarHBondContact CG1-O 3.49Å; H50-E81 PolarHBondContact NE2-O 2.82Å; H50-E81 VanDerWaalsContact NE2-O 3.08Å
82	D	81	Confident	86	Confident	95 Å²	95	50 Å²	50	51%	0.508	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-7.9	-173.1	-65.1	-29.2	0	0	0	114.2	H50 L84	H50-D82 PolarHBondContact CE1-O 3.34Å; H50-D82 VanDerWaalsContact NE2-C 3.26Å; D82-L84 HydrophobicContact CB-CD1 3.96Å; D82-L84 HydrophobicContact CB-CG 3.89Å; D82-L84 PolarHBondContact O-N 2.89Å
83	G	79.4	Confident	85.8	Confident	16 Å²	16	49.5 Å²	49.5	17%	0.165	27%	0.267	C	S	.	.			trans	70.5	7.4	-178.9	0	0	0	0	0	114.4	H50 Q79	H50-G83 WeakPolarHBondContact CD2-CA 3.28Å; H50-G83 PolarHBondContact CE1-N 2.8Å; H50-G83 WeakPolarHBondContact NE2-CA 3.38Å; H50-G83 PolarHBondContact NE2-N 3.46Å; H50-G83 VanDerWaalsContact NE2-N 3.16Å; Q79-G83 WeakPolarHBondContact O-CA 3.29Å; Q79-G83 PolarHBondContact O-N 3.12Å
84	L	85.2	Confident	85.7	Confident	98 Å²	98	48.7 Å²	48.7	51%	0.513	27%	0.265	S	S	.	.			trans	-69.7	140.9	-177.2	-67.3	173.2	0	0	0	111	L78 Q79 D82 D86	L78-L84 CarbonylContact C-O 3.47Å; L78-L84 VanDerWaalsContact CA-O 3.31Å; L78-L84 WeakPolarHBondContact CA-O 3.44Å; Q79-L84 PolarHBondContact N-O 3.02Å; D82-L84 HydrophobicContact CB-CD1 3.96Å; D82-L84 HydrophobicContact CB-CG 3.89Å; D82-L84 PolarHBondContact O-N 2.89Å; L84-D86 PolarHBondContact O-N 2.51Å
85	P	85	Confident	85.7	Confident	98 Å²	98	46.4 Å²	46.4	64%	0.636	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	114.3	175.7	27.9	-32.6	0	0	0	111.1	L78	L78-P85 HydrophobicContact CD2-CB 3.98Å
86	D	85.8	Confident	85.8	Confident	102 Å²	102	46.4 Å²	46.4	55%	0.545	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-19.8	174.5	-173.4	39.1	0	0	0	111.5	N65 I77 L84	N65-D86 PolarHBondContact ND2-OD2 2.69Å; I77-D86 HydrophobicContact CG2-CB 4.16Å; I77-D86 PolarHBondContact O-N 2.85Å; L84-D86 PolarHBondContact O-N 2.51Å
87	G	85.2	Confident	86	Confident	28 Å²	28	44.4 Å²	44.4	29%	0.289	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	161.6	-161.5	171.3	0	0	0	0	0	114.6	I77	I77-G87 PolarHBondContact N-O 3.32Å; I77-G87 PolarHBondContact O-N 3.41Å; I77-G87 VanDerWaalsContact O-N 3.11Å
88	V	86.4	Confident	86.2	Confident	77 Å²	77	45.1 Å²	45.1	47%	0.467	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.8	177.1	173.3	0	0	0	0	108	Y74 V75 T90	Y74-V88 HydrophobicContact CD1-CG1 3.79Å; Y74-V88 HydrophobicContact CD1-CG2 4.34Å; V75-V88 CarbonylContact O-C 3.6Å; V75-V88 WeakPolarHBondContact O-CA 3.32Å; V88-T90 WeakPolarHBondContact CG1-O 3.35Å
89	A	86.6	Confident	86.4	Confident	15 Å²	15	44.9 Å²	44.9	12%	0.124	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	-51.4	177.9	0	0	0	0	0	111	I67 V75 I77 L122	I67-A89 HydrophobicContact CG2-CB 4.4Å; V75-A89 HydrophobicContact CB-CB 4.26Å; V75-A89 HydrophobicContact CG1-CB 4.01Å; V75-A89 PolarHBondContact O-N 2.95Å; I77-A89 HydrophobicContact CD1-CB 3.99Å; I77-A89 HydrophobicContact CG1-CB 3.92Å; A89-L122 HydrophobicContact CB-CD2 4.31Å
90	T	87.2	Confident	86.7	Confident	10 Å²	10	42.9 Å²	42.9	6%	0.061	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163	-178.9	173.6	-173.5	0	0	0	0	109.6	V75 V88 F92 L110 K118 V120 E130	V75-T90 HydrophobicContact CG2-CG2 4.3Å; V75-T90 PolarHBondContact N-O 2.68Å; V88-T90 WeakPolarHBondContact CG1-O 3.35Å; T90-F92 HydrophobicContact CG2-CD2 4.22Å; T90-F92 HydrophobicContact CG2-CE2 3.72Å; T90-L110 HydrophobicContact CG2-CD1 3.32Å; T90-K118 HydrophobicContact CG2-CD 4.36Å; T90-V120 HydrophobicContact CG2-CG2 3.79Å; T90-E130 PolarHBondContact OG1-OE2 3.48Å
91	R	85.8	Confident	87.1	Confident	47 Å²	47	43.2 Å²	43.2	18%	0.177	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	145.9	175.3	64.2	-179.6	-178	172.4	6.1	111.1	T73 Y74 K118 T750 D751 A793	T73-R91 CarbonylContact O-C 3.54Å; T73-R91 WeakPolarHBondContact O-CA 3.44Å; Y74-R91 HydrophobicContact CD1-CB 4Å; Y74-R91 HydrophobicContact CE1-CB 4.02Å; R91-K118 PolarHBondContact O-NZ 3.34Å; R91-T750 PolarHBondContact NH2-OG1 3.21Å; R91-D751 IonicContact CZ-OD1 3.16Å; R91-D751 VanDerWaalsContact NH2-CG 3.31Å; R91-D751 IonicContact NH2-OD1 2.68Å; R91-D751 PolarHBondContact NH2-OD1 3.24Å; R91-D751 IonicContact NH2-OD2 3.22Å; R91-D751 PolarHBondContact NH2-OD2 3.21Å; R91-A793 HydrophobicContact CG-CB 3.97Å
92	F	86.8	Confident	87.6	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.018	22%	0.221	C	C	.	.			trans	-116.9	-174	176	-77	-92.5	0	0	0	111	T73 V75 T90 A94 V96 L110 S116 K118	T73-F92 WeakPolarHBondContact CB-O 3.15Å; T73-F92 PolarHBondContact O-N 3.08Å; V75-F92 HydrophobicContact CG2-CD2 4.28Å; V75-F92 HydrophobicContact CG2-CE2 4.3Å; T90-F92 HydrophobicContact CG2-CD2 4.22Å; T90-F92 HydrophobicContact CG2-CE2 3.72Å; F92-A94 WeakPolarHBondContact CB-O 3.08Å; F92-V96 HydrophobicContact CB-CG2 4.11Å; F92-V96 HydrophobicContact CD2-CG2 3.27Å; F92-V96 HydrophobicContact CE2-CG2 3.75Å; F92-V96 HydrophobicContact CG-CG2 3.8Å; F92-L110 HydrophobicContact CE2-CB 3.64Å; F92-L110 HydrophobicContact CE2-CD1 4.16Å; F92-L110 HydrophobicContact CE2-CG 4.43Å; F92-L110 HydrophobicContact CZ-CB 3.52Å; F92-S116 WeakPolarHBondContact CD1-OG 3.44Å; F92-S116 VanDerWaalsContact CE1-OG 3.3Å; F92-S116 WeakPolarHBondContact CE1-OG 3.07Å; F92-K118 HydrophobicContact CD1-CD 4.33Å; F92-K118 HydrophobicContact CE1-CB 4.19Å; F92-K118 HydrophobicContact CE1-CD 3.79Å; F92-K118 HydrophobicContact CE1-CG 3.59Å; F92-K118 HydrophobicContact CE2-CB 4.47Å; F92-K118 HydrophobicContact CE2-CD 4.08Å; F92-K118 HydrophobicContact CE2-CG 4.41Å; F92-K118 HydrophobicContact CZ-CB 3.66Å; F92-K118 HydrophobicContact CZ-CD 3.66Å; F92-K118 HydrophobicContact CZ-CG 3.54Å
93	T	77.3	Confident	88	Confident	15 Å²	15	39 Å²	39	9%	0.092	22%	0.222	C	C	.	.	S	Bend	trans	-118.5	-4.6	-178.9	69	0	0	0	0	112.5	D114 K792 A793 S794 R798	T93-D114 PolarHBondContact N-OD2 3.39Å; T93-D114 WeakPolarHBondContact OG1-CB 3.48Å; T93-D114 VanDerWaalsContact OG1-CG 3.28Å; T93-D114 PolarHBondContact OG1-OD2 3.44Å; T93-K792 WeakPolarHBondContact CG2-O 3.25Å; T93-A793 HydrophobicContact CG2-CB 3.71Å; T93-A793 WeakPolarHBondContact CG2-O 3.5Å; T93-S794 PolarHBondContact OG1-OG 3.35Å; T93-R798 VanDerWaalsContact C-NH2 3.34Å; T93-R798 PolarHBondContact O-NE 3.12Å; T93-R798 PolarHBondContact O-NH2 3.34Å
94	A	83.7	Confident	88.3	Confident	19 Å²	19	42.2 Å²	42.2	16%	0.157	24%	0.235	C	C	.	.	S	Bend	trans	-135	-179	163.3	0	0	0	0	0	108.1	F92 S112 D114	F92-A94 WeakPolarHBondContact CB-O 3.08Å; A94-S112 PolarHBondContact O-OG 3.3Å; A94-D114 HydrophobicContact CB-CB 3.88Å
95	E	87.3	Confident	88.5	Confident	57 Å²	57	38.8 Å²	38.8	27%	0.266	22%	0.217	S	C	.	.			trans	-59.7	149.7	173.8	61.7	-176	164.5	0	0	111.5	K55 S112 S113	K55-E95 WeakPolarHBondContact CE-OE2 3.49Å; K55-E95 IonicContact NZ-OE2 3.51Å; K55-E95 PolarHBondContact NZ-OE2 3.11Å; E95-S112 VanDerWaalsContact O-CA 3.31Å; E95-S112 WeakPolarHBondContact O-CA 3.48Å; E95-S112 WeakPolarHBondContact O-CB 3.22Å; E95-S112 PolarHBondContact O-OG 3.32Å; E95-S113 PolarHBondContact O-N 2.86Å
96	V	93.2	Very high	88.7	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.9	176.4	177	0	0	0	0	108.1	N57 A69 V75 F92 L110 C111	N57-V96 WeakPolarHBondContact CB-O 3.28Å; N57-V96 PolarHBondContact ND2-O 2.87Å; A69-V96 HydrophobicContact CB-CB 3.79Å; A69-V96 HydrophobicContact CB-CG1 3.7Å; V75-V96 HydrophobicContact CG2-CB 4.43Å; V75-V96 HydrophobicContact CG2-CG1 4.41Å; V75-V96 HydrophobicContact CG2-CG2 3.76Å; F92-V96 HydrophobicContact CB-CG2 4.11Å; F92-V96 HydrophobicContact CD2-CG2 3.27Å; F92-V96 HydrophobicContact CE2-CG2 3.75Å; F92-V96 HydrophobicContact CG-CG2 3.8Å; V96-L110 HydrophobicContact CG1-CD2 4.11Å; V96-C111 CarbonylContact C-O 3.45Å; V96-C111 WeakPolarHBondContact CA-O 3.39Å; V96-C111 WeakPolarHBondContact CG1-O 3.35Å
97	N	93.6	Very high	89	Confident	14 Å²	14	33 Å²	33	8%	0.075	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-32.7	-171.8	-66.7	-32.6	0	0	0	112.9	C111 S113 V140 R192	N97-C111 PolarHBondContact N-O 2.76Å; N97-S113 PolarHBondContact ND2-N 3.47Å; N97-S113 PolarHBondContact ND2-OG 2.87Å; N97-S113 PolarHBondContact OD1-OG 3.42Å; N97-V140 WeakPolarHBondContact CB-O 3.49Å; N97-V140 PolarHBondContact ND2-O 3.02Å; N97-R192 PolarHBondContact O-NH2 2.89Å; N97-R192 VanDerWaalsContact O-NH2 3.07Å
98	H	95.6	Very high	89.4	Confident	37 Å²	37	31.7 Å²	31.7	17%	0.171	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	160	-179.9	-164.5	-110.3	0	0	0	111.8	C111 V143 R192	H98-C111 VanDerWaalsContact CB-SG 3.55Å; H98-C111 PolarHBondContact O-N 3.4Å; H98-C111 PolarHBondContact O-SG 3.41Å; H98-C111 VanDerWaalsContact O-SG 3.38Å; H98-V143 PolarHBondContact ND1-O 2.74Å; H98-R192 VanDerWaalsContact CD2-CD 3.44Å; H98-R192 WeakPolarHBondContact CD2-CD 3.36Å; H98-R192 PolarHBondContact CD2-NE 2.82Å; H98-R192 WeakPolarHBondContact NE2-CD 3.01Å
99	L	96.1	Very high	89.8	Confident	6 Å²	6	28 Å²	28	3%	0.031	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	151.1	177.6	68	78.4	0	0	0	111	A58 A60 A69 I108 A109 L110	A58-L99 HydrophobicContact CB-CD2 4.13Å; A58-L99 HydrophobicContact CB-CG 3.82Å; A60-L99 HydrophobicContact CB-CD1 3.2Å; A69-L99 HydrophobicContact CB-CD2 4.01Å; L99-I108 HydrophobicContact CB-CD1 4.27Å; L99-I108 HydrophobicContact CD1-CD1 4.11Å; L99-I108 HydrophobicContact CD2-CD1 4.46Å; L99-A109 CarbonylContact C-O 3.54Å; L99-A109 WeakPolarHBondContact CA-O 3.45Å; L99-L110 HydrophobicContact CB-CD2 3.34Å; L99-L110 HydrophobicContact CB-CG 4.38Å; L99-L110 HydrophobicContact CD2-CD2 4.13Å; L99-L110 HydrophobicContact CG-CD2 4.37Å
100	A	94.4	Very high	90.2	Very high	18 Å²	18	27.3 Å²	27.3	15%	0.149	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	136.6	178.2	0	0	0	0	0	110.4	A109 V143	A100-A109 PolarHBondContact N-O 3.29Å; A100-A109 PolarHBondContact O-N 3.22Å; A100-V143 HydrophobicContact CB-CG1 4.34Å
101	M	92.7	Very high	90.6	Very high	34 Å²	34	26.9 Å²	26.9	17%	0.167	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	151.6	175.5	-72.6	-62.5	-54	0	0	111	A60 I67 L105 K107 I108 L122	A60-M101 HydrophobicContact CB-CG 3.69Å; I67-M101 HydrophobicContact CD1-SD 3.95Å; M101-L105 HydrophobicContact CB-CD2 4.09Å; M101-L105 HydrophobicContact CE-CB 4.05Å; M101-L105 HydrophobicContact CE-CD2 4.2Å; M101-L105 WeakPolarHBondContact CE-O 3.29Å; M101-L105 HydrophobicContact CG-CD2 4.49Å; M101-K107 WeakPolarHBondContact CE-O 3.49Å; M101-I108 HydrophobicContact SD-CB 3.5Å; M101-I108 VanDerWaalsContact SD-CB 3.5Å; M101-I108 HydrophobicContact SD-CD1 3.9Å; M101-I108 HydrophobicContact SD-CG1 3.65Å; M101-L122 HydrophobicContact CE-CD1 3.98Å; M101-L122 HydrophobicContact SD-CD1 4.23Å
102	N	92.1	Very high	90.9	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.027	13%	0.126	C	C	.	.			trans	-80.4	170.4	166.9	76.2	-25.7	0	0	0	112	D104 L105 S106 K107 F145 D149	N102-D104 PolarHBondContact ND2-OD1 3.45Å; N102-D104 PolarHBondContact O-N 3.44Å; N102-D104 PolarHBondContact OD1-OD1 2.96Å; N102-L105 PolarHBondContact O-N 2.88Å; N102-L105 WeakPolarHBondContact OD1-CA 3.37Å; N102-L105 PolarHBondContact OD1-N 3.39Å; N102-L105 VanDerWaalsContact OD1-N 3.16Å; N102-S106 PolarHBondContact ND2-OG 3.3Å; N102-S106 PolarHBondContact OD1-N 3.21Å; N102-S106 VanDerWaalsContact OD1-N 3.09Å; N102-K107 HydrophobicContact CB-CB 4.49Å; N102-K107 PolarHBondContact N-O 2.93Å; N102-K107 PolarHBondContact OD1-N 3.44Å; N102-K107 PolarHBondContact OD1-O 3.4Å; N102-F145 HydrophobicContact CB-CB 4.46Å; N102-F145 HydrophobicContact CB-CD1 3.67Å; N102-F145 HydrophobicContact CB-CD2 4.04Å; N102-F145 HydrophobicContact CB-CE1 3.77Å; N102-F145 HydrophobicContact CB-CE2 4.11Å; N102-F145 HydrophobicContact CB-CG 3.81Å; N102-F145 HydrophobicContact CB-CZ 4Å; N102-D149 WeakPolarHBondContact CB-OD1 3.26Å; N102-D149 PolarHBondContact ND2-OD2 3.12Å
103	K	87.8	Confident	91	Very high	119 Å²	119	25.4 Å²	25.4	52%	0.517	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-34.8	-173	-83.6	-169.3	172.4	172.7	0	114.7	L105 P147 S197 T198	K103-L105 VanDerWaalsContact C-N 3.29Å; K103-P147 HydrophobicContact CD-CB 3.96Å; K103-S197 WeakPolarHBondContact CE-O 3.5Å; K103-S197 PolarHBondContact NZ-O 2.99Å; K103-T198 PolarHBondContact NZ-O 3.31Å
104	D	87.2	Confident	91.3	Very high	83 Å²	83	25.6 Å²	25.6	44%	0.444	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.2	-179.6	72.6	6.5	0	0	0	112.9	N102 S106	N102-D104 PolarHBondContact ND2-OD1 3.45Å; N102-D104 PolarHBondContact O-N 3.44Å; N102-D104 PolarHBondContact OD1-OD1 2.96Å; D104-S106 PolarHBondContact O-N 3.43Å; D104-S106 WeakPolarHBondContact OD1-CA 3.26Å; D104-S106 WeakPolarHBondContact OD1-CB 3.46Å; D104-S106 PolarHBondContact OD1-N 3.46Å; D104-S106 PolarHBondContact OD1-OG 3.16Å; D104-S106 PolarHBondContact OD2-OG 3.2Å
105	L	88.9	Confident	91.6	Very high	26 Å²	26	25.7 Å²	25.7	14%	0.136	13%	0.13	C	C	.	.	S	Bend	trans	60.9	19.2	-177.3	-49.3	171.9	0	0	0	114.5	I22 R62 Y63 M101 N102 K103	I22-L105 HydrophobicContact CG2-CD1 3.57Å; R62-L105 WeakPolarHBondContact CD-O 3.49Å; R62-L105 HydrophobicContact CG-CB 4.24Å; R62-L105 PolarHBondContact NE-O 3.43Å; Y63-L105 HydrophobicContact CD1-CD1 4.41Å; Y63-L105 HydrophobicContact CE1-CD1 4.06Å; Y63-L105 HydrophobicContact CE2-CB 4.31Å; M101-L105 HydrophobicContact CB-CD2 4.09Å; M101-L105 HydrophobicContact CE-CB 4.05Å; M101-L105 HydrophobicContact CE-CD2 4.2Å; M101-L105 WeakPolarHBondContact CE-O 3.29Å; M101-L105 HydrophobicContact CG-CD2 4.49Å; N102-L105 PolarHBondContact O-N 2.88Å; N102-L105 WeakPolarHBondContact OD1-CA 3.37Å; N102-L105 PolarHBondContact OD1-N 3.39Å; N102-L105 VanDerWaalsContact OD1-N 3.16Å; K103-L105 VanDerWaalsContact C-N 3.29Å
106	S	89.2	Confident	91.7	Very high	21 Å²	21	23.3 Å²	23.3	15%	0.147	12%	0.119	C	C	.	.	S	Bend	trans	-82.5	-30.2	174.7	69.7	0	0	0	0	112.4	N102 D104 L122	N102-S106 PolarHBondContact ND2-OG 3.3Å; N102-S106 PolarHBondContact OD1-N 3.21Å; N102-S106 VanDerWaalsContact OD1-N 3.09Å; D104-S106 PolarHBondContact O-N 3.43Å; D104-S106 WeakPolarHBondContact OD1-CA 3.26Å; D104-S106 WeakPolarHBondContact OD1-CB 3.46Å; D104-S106 PolarHBondContact OD1-N 3.46Å; D104-S106 PolarHBondContact OD1-OG 3.16Å; D104-S106 PolarHBondContact OD2-OG 3.2Å; S106-L122 WeakPolarHBondContact O-CB 3.35Å; S106-L122 PolarHBondContact O-N 2.91Å
107	K	91.6	Very high	91.7	Very high	58 Å²	58	23.2 Å²	23.2	25%	0.252	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	146.8	-174.9	-58.4	-179.7	-161.3	72.1	0	112.6	M101 N102 V119 V120 F145 D149	M101-K107 WeakPolarHBondContact CE-O 3.49Å; N102-K107 HydrophobicContact CB-CB 4.49Å; N102-K107 PolarHBondContact N-O 2.93Å; N102-K107 PolarHBondContact OD1-N 3.44Å; N102-K107 PolarHBondContact OD1-O 3.4Å; K107-V119 HydrophobicContact CB-CG1 4.22Å; K107-V119 HydrophobicContact CD-CG1 4.24Å; K107-V120 CarbonylContact C-O 3.52Å; K107-V120 VanDerWaalsContact CA-O 3.25Å; K107-V120 WeakPolarHBondContact CA-O 3.44Å; K107-F145 HydrophobicContact CB-CE2 4.16Å; K107-F145 HydrophobicContact CB-CZ 3.73Å; K107-F145 HydrophobicContact CD-CZ 4.44Å; K107-D149 IonicContact NZ-OD2 3.34Å
108	I	94	Very high	91.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.6	173.3	-168.8	172.8	0	0	0	110.7	I67 L99 M101 L110 V119 V120 L122	I67-I108 HydrophobicContact CB-CD1 4.07Å; I67-I108 HydrophobicContact CD1-CD1 3.83Å; I67-I108 HydrophobicContact CG2-CD1 3.55Å; L99-I108 HydrophobicContact CB-CD1 4.27Å; L99-I108 HydrophobicContact CD1-CD1 4.11Å; L99-I108 HydrophobicContact CD2-CD1 4.46Å; M101-I108 HydrophobicContact SD-CB 3.5Å; M101-I108 VanDerWaalsContact SD-CB 3.5Å; M101-I108 HydrophobicContact SD-CD1 3.9Å; M101-I108 HydrophobicContact SD-CG1 3.65Å; I108-L110 HydrophobicContact CD1-CD2 3.96Å; I108-L110 HydrophobicContact CD1-CG 4.27Å; I108-L110 HydrophobicContact CG1-CD2 4.26Å; I108-L110 HydrophobicContact CG1-CG 4.11Å; I108-L110 HydrophobicContact CG2-CD1 3.99Å; I108-L110 HydrophobicContact CG2-CG 4.39Å; I108-V119 CarbonylContact O-C 3.55Å; I108-V119 VanDerWaalsContact O-CA 3.27Å; I108-V119 WeakPolarHBondContact O-CA 3.27Å; I108-V120 HydrophobicContact CG2-CB 3.81Å; I108-V120 HydrophobicContact CG2-CG2 4.46Å; I108-V120 PolarHBondContact N-O 3.14Å; I108-V120 PolarHBondContact O-N 3.24Å; I108-L122 HydrophobicContact CB-CD1 4.33Å; I108-L122 HydrophobicContact CG2-CD1 4.23Å; I108-L122 HydrophobicContact CG2-CD2 4.17Å; I108-L122 HydrophobicContact CG2-CG 4.3Å
109	A	95.2	Very high	91.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.9	171.1	0	0	0	0	0	108.8	L99 A100 K118 V119 V143 F145 I152	L99-A109 CarbonylContact C-O 3.54Å; L99-A109 WeakPolarHBondContact CA-O 3.45Å; A100-A109 PolarHBondContact N-O 3.29Å; A100-A109 PolarHBondContact O-N 3.22Å; A109-K118 CarbonylContact C-O 3.48Å; A109-K118 WeakPolarHBondContact CA-O 3.13Å; A109-V119 HydrophobicContact CB-CG2 4.09Å; A109-V143 HydrophobicContact CB-CG1 4.26Å; A109-V143 HydrophobicContact CB-CG2 3.74Å; A109-F145 HydrophobicContact CB-CD2 3.46Å; A109-F145 VanDerWaalsContact CB-CD2 3.46Å; A109-F145 HydrophobicContact CB-CE2 3.47Å; A109-F145 VanDerWaalsContact CB-CE2 3.47Å; A109-I152 HydrophobicContact CB-CD1 3.84Å
110	L	95.3	Very high	91.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.1	-171.1	-68	159.9	0	0	0	108.6	V75 T90 F92 V96 L99 I108 V117 K118 V120	V75-L110 HydrophobicContact CG1-CD1 4.37Å; V75-L110 HydrophobicContact CG1-CD2 4Å; V75-L110 HydrophobicContact CG2-CD1 4.25Å; V75-L110 HydrophobicContact CG2-CD2 4.09Å; T90-L110 HydrophobicContact CG2-CD1 3.32Å; F92-L110 HydrophobicContact CE2-CB 3.64Å; F92-L110 HydrophobicContact CE2-CD1 4.16Å; F92-L110 HydrophobicContact CE2-CG 4.43Å; F92-L110 HydrophobicContact CZ-CB 3.52Å; V96-L110 HydrophobicContact CG1-CD2 4.11Å; L99-L110 HydrophobicContact CB-CD2 3.34Å; L99-L110 HydrophobicContact CB-CG 4.38Å; L99-L110 HydrophobicContact CD2-CD2 4.13Å; L99-L110 HydrophobicContact CG-CD2 4.37Å; I108-L110 HydrophobicContact CD1-CD2 3.96Å; I108-L110 HydrophobicContact CD1-CG 4.27Å; I108-L110 HydrophobicContact CG1-CD2 4.26Å; I108-L110 HydrophobicContact CG1-CG 4.11Å; I108-L110 HydrophobicContact CG2-CD1 3.99Å; I108-L110 HydrophobicContact CG2-CG 4.39Å; L110-V117 CarbonylContact O-C 3.57Å; L110-V117 WeakPolarHBondContact O-CA 3.38Å; L110-K118 PolarHBondContact N-O 3.05Å; L110-K118 PolarHBondContact O-N 3.35Å; L110-V120 HydrophobicContact CD1-CG2 4.15Å
111	C	95	Very high	90.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.2	179.5	70.9	0	0	0	0	111.8	V96 N97 H98 V117 V140 V143	V96-C111 CarbonylContact C-O 3.45Å; V96-C111 WeakPolarHBondContact CA-O 3.39Å; V96-C111 WeakPolarHBondContact CG1-O 3.35Å; N97-C111 PolarHBondContact N-O 2.76Å; H98-C111 VanDerWaalsContact CB-SG 3.55Å; H98-C111 PolarHBondContact O-N 3.4Å; H98-C111 PolarHBondContact O-SG 3.41Å; H98-C111 VanDerWaalsContact O-SG 3.38Å; C111-V117 HydrophobicContact CB-CG2 4.2Å; C111-V140 HydrophobicContact CB-CB 3.79Å; C111-V140 HydrophobicContact CB-CG1 3.53Å; C111-V143 HydrophobicContact CB-CB 4.06Å; C111-V143 HydrophobicContact CB-CG1 4.24Å
112	S	92.2	Very high	90.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	159.6	-170.3	177.4	0	0	0	0	113	A94 E95 D114 F115 S116 V140	A94-S112 PolarHBondContact O-OG 3.3Å; E95-S112 VanDerWaalsContact O-CA 3.31Å; E95-S112 WeakPolarHBondContact O-CA 3.48Å; E95-S112 WeakPolarHBondContact O-CB 3.22Å; E95-S112 PolarHBondContact O-OG 3.32Å; S112-D114 VanDerWaalsContact CB-OD1 3.31Å; S112-D114 WeakPolarHBondContact CB-OD1 3.44Å; S112-D114 PolarHBondContact O-N 2.87Å; S112-D114 VanDerWaalsContact O-N 3.14Å; S112-D114 PolarHBondContact OG-N 3.49Å; S112-D114 PolarHBondContact OG-OD1 3.39Å; S112-F115 PolarHBondContact O-N 2.7Å; S112-S116 PolarHBondContact N-O 3.16Å; S112-V140 PolarHBondContact O-N 3.1Å; S112-V140 VanDerWaalsContact O-N 3.13Å
113	S	88.3	Confident	89.7	Confident	20 Å²	20	25.2 Å²	25.2	14%	0.14	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-4.1	168.5	-62.8	0	0	0	0	113.6	E95 N97 F115	E95-S113 PolarHBondContact O-N 2.86Å; N97-S113 PolarHBondContact ND2-N 3.47Å; N97-S113 PolarHBondContact ND2-OG 2.87Å; N97-S113 PolarHBondContact OD1-OG 3.42Å; S113-F115 VanDerWaalsContact C-N 3.3Å; S113-F115 VanDerWaalsContact O-CD1 3.27Å; S113-F115 WeakPolarHBondContact O-CD1 3.32Å; S113-F115 WeakPolarHBondContact O-CE1 3.22Å
114	D	84.6	Confident	88.5	Confident	19 Å²	19	21.1 Å²	21.1	10%	0.102	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	8.2	172.2	71.3	11.5	0	0	0	114.9	T93 A94 S112 S116	T93-D114 PolarHBondContact N-OD2 3.39Å; T93-D114 WeakPolarHBondContact OG1-CB 3.48Å; T93-D114 VanDerWaalsContact OG1-CG 3.28Å; T93-D114 PolarHBondContact OG1-OD2 3.44Å; A94-D114 HydrophobicContact CB-CB 3.88Å; S112-D114 VanDerWaalsContact CB-OD1 3.31Å; S112-D114 WeakPolarHBondContact CB-OD1 3.44Å; S112-D114 PolarHBondContact O-N 2.87Å; S112-D114 VanDerWaalsContact O-N 3.14Å; S112-D114 PolarHBondContact OG-N 3.49Å; S112-D114 PolarHBondContact OG-OD1 3.39Å; D114-S116 PolarHBondContact O-N 3.3Å; D114-S116 VanDerWaalsContact OD1-CB 3.27Å; D114-S116 WeakPolarHBondContact OD1-CB 3.15Å; D114-S116 PolarHBondContact OD1-N 3.26Å; D114-S116 PolarHBondContact OD1-OG 3.5Å
115	F	89.1	Confident	87	Confident	21 Å²	21	26.1 Å²	26.1	9%	0.092	15%	0.147	C	C	.	.	S	Bend	trans	77.2	4	174.4	-41.8	-16	0	0	0	113.5	S112 S113 H136 G138 A139 F429	S112-F115 PolarHBondContact O-N 2.7Å; S113-F115 VanDerWaalsContact C-N 3.3Å; S113-F115 VanDerWaalsContact O-CD1 3.27Å; S113-F115 WeakPolarHBondContact O-CD1 3.32Å; S113-F115 WeakPolarHBondContact O-CE1 3.22Å; F115-H136 HydrophobicContact CB-CB 4.46Å; F115-G138 WeakPolarHBondContact CD1-O 3.16Å; F115-G138 WeakPolarHBondContact CG-O 3.34Å; F115-A139 HydrophobicContact CD1-CB 4.5Å; F115-A139 HydrophobicContact CE1-CB 4.36Å; F115-F429 HydrophobicContact CD2-CE2 4.37Å; F115-F429 HydrophobicContact CD2-CZ 4.34Å; F115-F429 HydrophobicContact CE2-CD1 4.33Å; F115-F429 AromaticContact CE2-CD2 3.92Å; F115-F429 HydrophobicContact CE2-CD2 3.92Å; F115-F429 HydrophobicContact CE2-CE1 4.28Å; F115-F429 AromaticContact CE2-CE2 3.86Å; F115-F429 HydrophobicContact CE2-CE2 3.86Å; F115-F429 HydrophobicContact CE2-CG 4.14Å; F115-F429 HydrophobicContact CE2-CZ 4.04Å; F115-F429 AromaticContact CZ-CD1 3.98Å; F115-F429 HydrophobicContact CZ-CD1 3.98Å; F115-F429 HydrophobicContact CZ-CD2 4.27Å; F115-F429 HydrophobicContact CZ-CE1 4.17Å; F115-F429 HydrophobicContact CZ-CE2 4.45Å; F115-F429 HydrophobicContact CZ-CG 4.01Å; F115-F429 HydrophobicContact CZ-CZ 4.4Å
116	S	88.9	Confident	85.2	Confident	7 Å²	7	30.3 Å²	30.3	5%	0.049	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	149	177.5	75.2	0	0	0	0	112.2	F92 S112 D114	F92-S116 WeakPolarHBondContact CD1-OG 3.44Å; F92-S116 VanDerWaalsContact CE1-OG 3.3Å; F92-S116 WeakPolarHBondContact CE1-OG 3.07Å; S112-S116 PolarHBondContact N-O 3.16Å; D114-S116 PolarHBondContact O-N 3.3Å; D114-S116 VanDerWaalsContact OD1-CB 3.27Å; D114-S116 WeakPolarHBondContact OD1-CB 3.15Å; D114-S116 PolarHBondContact OD1-N 3.26Å; D114-S116 PolarHBondContact OD1-OG 3.5Å
117	V	93.1	Very high	83.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.9	165	178.6	0	0	0	0	107.1	L110 C111 F133 V140 V143 I152	L110-V117 CarbonylContact O-C 3.57Å; L110-V117 WeakPolarHBondContact O-CA 3.38Å; C111-V117 HydrophobicContact CB-CG2 4.2Å; V117-F133 HydrophobicContact CB-CB 4.16Å; V117-F133 HydrophobicContact CB-CD2 4.49Å; V117-F133 HydrophobicContact CG1-CD2 4.34Å; V117-F133 PolarHBondContact N-O 3.43Å; V117-F133 VanDerWaalsContact N-O 3.07Å; V117-F133 PolarHBondContact O-N 2.9Å; V117-V140 HydrophobicContact CG2-CB 4.48Å; V117-V140 HydrophobicContact CG2-CG1 3.92Å; V117-V140 HydrophobicContact CG2-CG2 4.13Å; V117-V143 HydrophobicContact CG1-CG2 3.95Å; V117-I152 HydrophobicContact CG1-CG2 4.17Å
118	K	91	Very high	81.6	Confident	6 Å²	6	35.4 Å²	35.4	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	143.2	175.6	-63.8	-170.1	174.1	-162.7	0	110.8	T90 R91 F92 A109 L110 E130 L131 V132	T90-K118 HydrophobicContact CG2-CD 4.36Å; R91-K118 PolarHBondContact O-NZ 3.34Å; F92-K118 HydrophobicContact CD1-CD 4.33Å; F92-K118 HydrophobicContact CE1-CB 4.19Å; F92-K118 HydrophobicContact CE1-CD 3.79Å; F92-K118 HydrophobicContact CE1-CG 3.59Å; F92-K118 HydrophobicContact CE2-CB 4.47Å; F92-K118 HydrophobicContact CE2-CD 4.08Å; F92-K118 HydrophobicContact CE2-CG 4.41Å; F92-K118 HydrophobicContact CZ-CB 3.66Å; F92-K118 HydrophobicContact CZ-CD 3.66Å; F92-K118 HydrophobicContact CZ-CG 3.54Å; A109-K118 CarbonylContact C-O 3.48Å; A109-K118 WeakPolarHBondContact CA-O 3.13Å; L110-K118 PolarHBondContact N-O 3.05Å; L110-K118 PolarHBondContact O-N 3.35Å; K118-E130 IonicContact NZ-OE1 3.93Å; K118-E130 PolarHBondContact NZ-OE1 3Å; K118-E130 IonicContact NZ-OE2 3.96Å; K118-L131 CarbonylContact C-O 3.48Å; K118-L131 VanDerWaalsContact CA-O 3.23Å; K118-L131 WeakPolarHBondContact CA-O 3.4Å; K118-V132 HydrophobicContact CD-CG2 4.29Å; K118-V132 HydrophobicContact CG-CG1 4.24Å; K118-V132 HydrophobicContact CG-CG2 4.09Å
119	V	92.4	Very high	80.4	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.024	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.3	166.4	175.3	0	0	0	0	107.9	K107 I108 A109 E130 L131 F133 F145 I152 L166	K107-V119 HydrophobicContact CB-CG1 4.22Å; K107-V119 HydrophobicContact CD-CG1 4.24Å; I108-V119 CarbonylContact O-C 3.55Å; I108-V119 VanDerWaalsContact O-CA 3.27Å; I108-V119 WeakPolarHBondContact O-CA 3.27Å; A109-V119 HydrophobicContact CB-CG2 4.09Å; V119-E130 CarbonylContact O-C 3.58Å; V119-E130 VanDerWaalsContact O-CA 3.24Å; V119-E130 WeakPolarHBondContact O-CA 3.44Å; V119-L131 HydrophobicContact CB-CB 4.33Å; V119-L131 PolarHBondContact N-O 3.36Å; V119-L131 PolarHBondContact O-N 3.04Å; V119-F133 HydrophobicContact CB-CE2 4.32Å; V119-F133 HydrophobicContact CG2-CD2 4.43Å; V119-F133 HydrophobicContact CG2-CE2 3.74Å; V119-F145 HydrophobicContact CG1-CE2 4.21Å; V119-F145 HydrophobicContact CG1-CZ 3.7Å; V119-F145 HydrophobicContact CG2-CZ 4.39Å; V119-I152 HydrophobicContact CG2-CD1 4.07Å; V119-I152 HydrophobicContact CG2-CG1 3.77Å; V119-L166 HydrophobicContact CB-CD2 4.29Å; V119-L166 HydrophobicContact CG1-CD2 4.08Å; V119-L166 HydrophobicContact CG2-CD2 3.9Å
120	V	90	Very high	79.8	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.6	-175.2	-177.9	0	0	0	0	109.1	T90 K107 I108 L110 L122 R129 E130	T90-V120 HydrophobicContact CG2-CG2 3.79Å; K107-V120 CarbonylContact C-O 3.52Å; K107-V120 VanDerWaalsContact CA-O 3.25Å; K107-V120 WeakPolarHBondContact CA-O 3.44Å; I108-V120 HydrophobicContact CG2-CB 3.81Å; I108-V120 HydrophobicContact CG2-CG2 4.46Å; I108-V120 PolarHBondContact N-O 3.14Å; I108-V120 PolarHBondContact O-N 3.24Å; L110-V120 HydrophobicContact CD1-CG2 4.15Å; V120-L122 HydrophobicContact CG1-CD2 4.2Å; V120-R129 WeakPolarHBondContact CA-O 3.37Å; V120-R129 HydrophobicContact CG1-CB 4.44Å; V120-E130 HydrophobicContact CG2-CB 4.11Å
121	D	87.4	Confident	79.2	Confident	50 Å²	50	42.7 Å²	42.7	27%	0.267	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	124.3	167.6	-169.1	-14.9	0	0	0	110	S123 R129	D121-S123 VanDerWaalsContact OD1-CB 3.3Å; D121-S123 WeakPolarHBondContact OD1-CB 3.42Å; D121-S123 PolarHBondContact OD1-N 2.71Å; D121-S123 PolarHBondContact OD1-OG 3.18Å; D121-S123 PolarHBondContact OD2-OG 3.06Å; D121-R129 PolarHBondContact N-O 3Å; D121-R129 VanDerWaalsContact O-CD 3.29Å; D121-R129 WeakPolarHBondContact O-CD 3.41Å; D121-R129 VanDerWaalsContact O-CG 3.25Å; D121-R129 WeakPolarHBondContact O-CG 3.46Å
122	L	84.3	Confident	78.7	Confident	15 Å²	15	44.8 Å²	44.8	8%	0.079	25%	0.249	C	C	.	.			trans	-94.9	-4.2	-178	-58.7	174.8	0	0	0	112.4	I67 I77 A89 M101 S106 I108 V120	I67-L122 HydrophobicContact CD1-CD1 3.56Å; I77-L122 HydrophobicContact CD1-CD2 4.27Å; A89-L122 HydrophobicContact CB-CD2 4.31Å; M101-L122 HydrophobicContact CE-CD1 3.98Å; M101-L122 HydrophobicContact SD-CD1 4.23Å; S106-L122 WeakPolarHBondContact O-CB 3.35Å; S106-L122 PolarHBondContact O-N 2.91Å; I108-L122 HydrophobicContact CB-CD1 4.33Å; I108-L122 HydrophobicContact CG2-CD1 4.23Å; I108-L122 HydrophobicContact CG2-CD2 4.17Å; I108-L122 HydrophobicContact CG2-CG 4.3Å; V120-L122 HydrophobicContact CG1-CD2 4.2Å
123	S	77.7	Confident	78.4	Confident	78 Å²	78	45 Å²	45	55%	0.545	25%	0.25	S	C	.	.	S	Bend	trans	-88.1	-34.3	-169.8	68.8	0	0	0	0	116.2	D121	D121-S123 VanDerWaalsContact OD1-CB 3.3Å; D121-S123 WeakPolarHBondContact OD1-CB 3.42Å; D121-S123 PolarHBondContact OD1-N 2.71Å; D121-S123 PolarHBondContact OD1-OG 3.18Å; D121-S123 PolarHBondContact OD2-OG 3.06Å
124	G	63.1	Low	78.1	Confident	33 Å²	33	46.8 Å²	46.8	34%	0.34	26%	0.257	S	S	.	.	S	Bend	trans	-121.9	138.5	-167	0	0	0	0	0	115.2	D126 R129	G124-D126 PolarHBondContact O-N 3.43Å; G124-R129 PolarHBondContact O-NE 2.86Å; G124-R129 PolarHBondContact O-NH2 3.05Å
125	H	56.4	Low	77.7	Confident	189 Å²	189	46.8 Å²	46.8	88%	0.875	26%	0.262	S	S	*	.	S	Bend	trans	-66	10	-169.5	-64.5	-72.4	0	0	0	119.3	R129	H125-R129 VanDerWaalsContact CA-NH2 3.33Å
126	D	51.2	Low	77.6	Confident	114 Å²	114	46 Å²	46	61%	0.61	26%	0.259	S	S	*	.	S	Bend	trans	-96.7	160.3	-170.5	-142.9	-24.1	0	0	0	114.3	G124 D128 R129	G124-D126 PolarHBondContact O-N 3.43Å; D126-D128 PolarHBondContact O-N 3.23Å; D126-R129 WeakPolarHBondContact O-CD 3.4Å; D126-R129 VanDerWaalsContact O-CG 3.23Å; D126-R129 WeakPolarHBondContact O-CG 3.43Å
127	S	50.7	Low	77.3	Confident	82 Å²	82	49.8 Å²	49.8	57%	0.573	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-8.9	175.5	60	0	0	0	0	114	R129	S127-R129 VanDerWaalsContact C-N 3.28Å; S127-R129 PolarHBondContact O-N 2.99Å
128	D	53	Low	76.8	Confident	103 Å²	103	50 Å²	50	55%	0.551	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	10.1	-175.7	-141.8	28.1	0	0	0	114.5	D126 E130 R749	D126-D128 PolarHBondContact O-N 3.23Å; D128-E130 VanDerWaalsContact C-N 3.35Å; D128-E130 PolarHBondContact O-N 3.25Å; D128-R749 VanDerWaalsContact CA-NH1 3.3Å; D128-R749 PolarHBondContact O-NH1 3.01Å; D128-R749 IonicContact OD1-CZ 3.99Å; D128-R749 IonicContact OD1-NE 3.81Å; D128-R749 IonicContact OD1-NH1 3.94Å; D128-R749 PolarHBondContact OD1-NH1 3.36Å
129	R	70.5	Confident	76.8	Confident	85 Å²	85	50 Å²	50	32%	0.321	28%	0.278	S	S	.	.			trans	-63.2	-16.9	-171.7	-80.1	172.3	-174	-130.2	-6.3	117.6	V120 D121 G124 H125 D126 S127	V120-R129 WeakPolarHBondContact CA-O 3.37Å; V120-R129 HydrophobicContact CG1-CB 4.44Å; D121-R129 PolarHBondContact N-O 3Å; D121-R129 VanDerWaalsContact O-CD 3.29Å; D121-R129 WeakPolarHBondContact O-CD 3.41Å; D121-R129 VanDerWaalsContact O-CG 3.25Å; D121-R129 WeakPolarHBondContact O-CG 3.46Å; G124-R129 PolarHBondContact O-NE 2.86Å; G124-R129 PolarHBondContact O-NH2 3.05Å; H125-R129 VanDerWaalsContact CA-NH2 3.33Å; D126-R129 WeakPolarHBondContact O-CD 3.4Å; D126-R129 VanDerWaalsContact O-CG 3.23Å; D126-R129 WeakPolarHBondContact O-CG 3.43Å; S127-R129 VanDerWaalsContact C-N 3.28Å; S127-R129 PolarHBondContact O-N 2.99Å
130	E	81	Confident	76.9	Confident	23 Å²	23	49.8 Å²	49.8	11%	0.107	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	140.3	-168.2	72.4	174.5	-144.8	0	0	116.1	T90 K118 V119 V120 D128 V132 R749 T750	T90-E130 PolarHBondContact OG1-OE2 3.48Å; K118-E130 IonicContact NZ-OE1 3.93Å; K118-E130 PolarHBondContact NZ-OE1 3Å; K118-E130 IonicContact NZ-OE2 3.96Å; V119-E130 CarbonylContact O-C 3.58Å; V119-E130 VanDerWaalsContact O-CA 3.24Å; V119-E130 WeakPolarHBondContact O-CA 3.44Å; V120-E130 HydrophobicContact CG2-CB 4.11Å; D128-E130 VanDerWaalsContact C-N 3.35Å; D128-E130 PolarHBondContact O-N 3.25Å; E130-V132 HydrophobicContact CG-CG2 4.45Å; E130-R749 PolarHBondContact O-NH1 3.12Å; E130-R749 PolarHBondContact O-NH2 3.28Å; E130-T750 WeakPolarHBondContact OE1-CG2 3.36Å
131	L	84.2	Confident	77.2	Confident	45 Å²	45	50.1 Å²	50.1	24%	0.236	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133	165.2	-62.6	174.8	0	0	0	108.7	K118 V119 F133 L166	K118-L131 CarbonylContact C-O 3.48Å; K118-L131 VanDerWaalsContact CA-O 3.23Å; K118-L131 WeakPolarHBondContact CA-O 3.4Å; V119-L131 HydrophobicContact CB-CB 4.33Å; V119-L131 PolarHBondContact N-O 3.36Å; V119-L131 PolarHBondContact O-N 3.04Å; L131-F133 HydrophobicContact CB-CE2 4.03Å; L131-F133 HydrophobicContact CB-CZ 4.21Å; L131-F133 HydrophobicContact CD1-CZ 4.26Å; L131-L166 HydrophobicContact CD1-CD2 4.29Å
132	V	84.7	Confident	77.6	Confident	45 Å²	45	47.7 Å²	47.7	27%	0.273	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	113.1	178.3	-171.7	0	0	0	0	109.5	K118 E130	K118-V132 HydrophobicContact CD-CG2 4.29Å; K118-V132 HydrophobicContact CG-CG1 4.24Å; K118-V132 HydrophobicContact CG-CG2 4.09Å; E130-V132 HydrophobicContact CG-CG2 4.45Å
133	F	84.6	Confident	78.2	Confident	5 Å²	5	47 Å²	47	2%	0.022	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.5	175.8	-58.5	-79.7	0	0	0	109.8	V117 V119 L131 W164 L166	V117-F133 HydrophobicContact CB-CB 4.16Å; V117-F133 HydrophobicContact CB-CD2 4.49Å; V117-F133 HydrophobicContact CG1-CD2 4.34Å; V117-F133 PolarHBondContact N-O 3.43Å; V117-F133 VanDerWaalsContact N-O 3.07Å; V117-F133 PolarHBondContact O-N 2.9Å; V119-F133 HydrophobicContact CB-CE2 4.32Å; V119-F133 HydrophobicContact CG2-CD2 4.43Å; V119-F133 HydrophobicContact CG2-CE2 3.74Å; L131-F133 HydrophobicContact CB-CE2 4.03Å; L131-F133 HydrophobicContact CB-CZ 4.21Å; L131-F133 HydrophobicContact CD1-CZ 4.26Å; F133-W164 HydrophobicContact CB-CD2 3.72Å; F133-W164 HydrophobicContact CB-CE3 3.61Å; F133-W164 HydrophobicContact CB-CG 4.26Å; F133-W164 HydrophobicContact CB-CH2 4.29Å; F133-W164 HydrophobicContact CB-CZ2 4.4Å; F133-W164 HydrophobicContact CB-CZ3 3.9Å; F133-W164 HydrophobicContact CD1-CB 3.68Å; F133-W164 AromaticContact CD1-CD2 3.96Å; F133-W164 HydrophobicContact CD1-CD2 3.96Å; F133-W164 AromaticContact CD1-CE3 3.68Å; F133-W164 HydrophobicContact CD1-CE3 3.68Å; F133-W164 AromaticContact CD1-CG 3.99Å; F133-W164 HydrophobicContact CD1-CG 3.99Å; F133-W164 HydrophobicContact CD2-CB 4.46Å; F133-W164 HydrophobicContact CE1-CB 3.68Å; F133-W164 HydrophobicContact CE1-CG 4.46Å; F133-W164 HydrophobicContact CE2-CB 4.5Å; F133-W164 HydrophobicContact CG-CB 4.07Å; F133-W164 AromaticContact CG-CD2 3.94Å; F133-W164 HydrophobicContact CG-CD2 3.94Å; F133-W164 AromaticContact CG-CE3 3.94Å; F133-W164 HydrophobicContact CG-CE3 3.94Å; F133-W164 HydrophobicContact CG-CG 4.01Å; F133-W164 HydrophobicContact CZ-CB 4.13Å; F133-L166 HydrophobicContact CE2-CD2 4.36Å; F133-L166 HydrophobicContact CZ-CD2 4.15Å
134	N	81.9	Confident	79.1	Confident	56 Å²	56	43.8 Å²	43.8	30%	0.299	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.8	175.8	-61.3	-94.4	0	0	0	107.6	K795	N134-K795 PolarHBondContact ND2-NZ 3.03Å
135	G	77.4	Confident	80.7	Confident	19 Å²	19	43 Å²	43	20%	0.196	23%	0.228	C	C	.	.			trans	170.5	-31.7	177.9	0	0	0	0	0	112.8	Q137 R162	G135-Q137 PolarHBondContact O-NE2 3.35Å; G135-R162 VanDerWaalsContact O-CZ 3.25Å; G135-R162 PolarHBondContact O-NH2 3.07Å
136	H	86.8	Confident	82.5	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.028	19%	0.187	C	C	.	.			trans	-59.3	148.4	168.6	-79.5	-61.3	0	0	0	112	F115 V140 S154 S156 D158 R162 W164	F115-H136 HydrophobicContact CB-CB 4.46Å; H136-V140 HydrophobicContact CB-CG2 4.14Å; H136-S154 PolarHBondContact CD2-OG 3.03Å; H136-S154 PolarHBondContact NE2-OG 3.26Å; H136-S156 WeakPolarHBondContact CE1-CB 3.14Å; H136-S156 WeakPolarHBondContact ND1-CB 3.44Å; H136-D158 WeakPolarHBondContact CA-OD2 3.49Å; H136-D158 IonicContact CE1-OD1 2.71Å; H136-D158 IonicContact CG-OD2 3.14Å; H136-D158 IonicContact ND1-OD1 3.71Å; H136-D158 PolarHBondContact ND1-OD1 3.44Å; H136-D158 IonicContact ND1-OD2 2.71Å; H136-D158 PolarHBondContact ND1-OD2 3.43Å; H136-R162 VanDerWaalsContact CE1-CD 3.49Å; H136-R162 WeakPolarHBondContact CE1-CD 3.47Å; H136-R162 VanDerWaalsContact CE1-CG 3.44Å; H136-R162 WeakPolarHBondContact CE1-CG 3.26Å; H136-R162 PolarHBondContact ND1-NE 3.22Å; H136-W164 AromaticContact CD2-CZ2 3.7Å; H136-W164 AromaticContact NE2-CZ2 3.95Å
137	Q	81.3	Confident	84.4	Confident	85 Å²	85	29.5 Å²	29.5	40%	0.397	16%	0.163	S	C	.	.	S	Bend	trans	-111.9	15.8	-179	-55.3	-60.3	-60.5	0	0	112.1	G135 D158 G428	G135-Q137 PolarHBondContact O-NE2 3.35Å; Q137-D158 HydrophobicContact CB-CB 4.05Å; Q137-D158 PolarHBondContact N-OD2 2.98Å; Q137-G428 WeakPolarHBondContact O-CA 3.29Å
138	G	84.3	Confident	86.4	Confident	5 Å²	5	29.7 Å²	29.7	5%	0.052	16%	0.157	C	C	.	.	S	Bend	trans	-163.1	168.2	-176.2	0	0	0	0	0	110.4	F115 V140 S156	F115-G138 WeakPolarHBondContact CD1-O 3.16Å; F115-G138 WeakPolarHBondContact CG-O 3.34Å; G138-V140 PolarHBondContact O-N 3.28Å; G138-S156 PolarHBondContact O-OG 2.76Å
139	A	89.5	Confident	88.2	Confident	5 Å²	5	26.8 Å²	26.8	4%	0.041	14%	0.141	C	C	.	.			trans	-55	131.8	-176.9	0	0	0	0	0	111	F115 L141 S156 C157 P184	F115-A139 HydrophobicContact CD1-CB 4.5Å; F115-A139 HydrophobicContact CE1-CB 4.36Å; A139-L141 PolarHBondContact O-N 3.43Å; A139-S156 CarbonylContact O-C 3.5Å; A139-S156 VanDerWaalsContact O-CA 3.29Å; A139-S156 WeakPolarHBondContact O-CA 3.15Å; A139-S156 PolarHBondContact O-OG 2.85Å; A139-C157 HydrophobicContact CB-CB 4.46Å; A139-C157 PolarHBondContact O-N 3.27Å; A139-P184 HydrophobicContact CB-CG 3.35Å
140	V	95.2	Very high	89.2	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	119.1	-179.5	-169	0	0	0	0	107.8	N97 C111 S112 V117 H136 G138 A155	N97-V140 WeakPolarHBondContact CB-O 3.49Å; N97-V140 PolarHBondContact ND2-O 3.02Å; C111-V140 HydrophobicContact CB-CB 3.79Å; C111-V140 HydrophobicContact CB-CG1 3.53Å; S112-V140 PolarHBondContact O-N 3.1Å; S112-V140 VanDerWaalsContact O-N 3.13Å; V117-V140 HydrophobicContact CG2-CB 4.48Å; V117-V140 HydrophobicContact CG2-CG1 3.92Å; V117-V140 HydrophobicContact CG2-CG2 4.13Å; H136-V140 HydrophobicContact CB-CG2 4.14Å; G138-V140 PolarHBondContact O-N 3.28Å; V140-A155 CarbonylContact C-O 3.56Å; V140-A155 VanDerWaalsContact CG1-O 3.29Å; V140-A155 WeakPolarHBondContact CG1-O 3.13Å
141	L	95.3	Very high	89.8	Confident	9 Å²	9	25 Å²	25	5%	0.047	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-44.7	-173.5	-64.5	173.2	0	0	0	111.5	A139 A155 C157 P184 A187 R192	A139-L141 PolarHBondContact O-N 3.43Å; L141-A155 PolarHBondContact N-O 2.81Å; L141-C157 VanDerWaalsContact CD2-SG 3.52Å; L141-P184 HydrophobicContact CD2-CB 3.69Å; L141-P184 HydrophobicContact CD2-CG 4.05Å; L141-A187 HydrophobicContact CD1-CB 3.95Å; L141-A187 HydrophobicContact CD2-CB 3.91Å; L141-R192 PolarHBondContact O-NH1 3.14Å
142	S	96.5	Very high	90.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	160.9	-174.2	72.6	0	0	0	0	111.9	S154 A155 C191 L193	S142-S154 VanDerWaalsContact O-CA 3.24Å; S142-S154 WeakPolarHBondContact O-CA 3.32Å; S142-S154 WeakPolarHBondContact O-CB 3.48Å; S142-A155 PolarHBondContact N-O 2.59Å; S142-A155 PolarHBondContact O-N 2.9Å; S142-C191 VanDerWaalsContact CB-O 3.26Å; S142-C191 WeakPolarHBondContact CB-O 3.48Å; S142-C191 PolarHBondContact OG-O 3.17Å; S142-L193 WeakPolarHBondContact OG-CD2 3.46Å
143	V	97.6	Very high	91	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.4	178.8	68.2	0	0	0	0	109.4	H98 A100 A109 C111 V117 I152 A153	H98-V143 PolarHBondContact ND1-O 2.74Å; A100-V143 HydrophobicContact CB-CG1 4.34Å; A109-V143 HydrophobicContact CB-CG1 4.26Å; A109-V143 HydrophobicContact CB-CG2 3.74Å; C111-V143 HydrophobicContact CB-CB 4.06Å; C111-V143 HydrophobicContact CB-CG1 4.24Å; V117-V143 HydrophobicContact CG1-CG2 3.95Å; V143-I152 HydrophobicContact CG2-CG2 3.35Å; V143-A153 CarbonylContact C-O 3.55Å; V143-A153 VanDerWaalsContact CA-O 3.27Å; V143-A153 WeakPolarHBondContact CA-O 3.23Å
144	A	96.8	Very high	91.6	Very high	9 Å²	9	20.5 Å²	20.5	7%	0.074	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	139.9	173.2	0	0	0	0	0	111.9	A153 L193 W195	A144-A153 PolarHBondContact N-O 3.45Å; A144-A153 PolarHBondContact O-N 3.13Å; A144-L193 HydrophobicContact CB-CD1 3.33Å; A144-L193 HydrophobicContact CB-CG 4.43Å; A144-L193 WeakPolarHBondContact CB-O 3.45Å; A144-W195 PolarHBondContact O-NE1 2.87Å
145	F	95	Very high	92.3	Very high	18 Å²	18	17.9 Å²	17.9	8%	0.079	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	133.1	177.7	-118	-73.6	0	0	0	111.2	N102 K107 A109 V119 I152 L166 W195	N102-F145 HydrophobicContact CB-CB 4.46Å; N102-F145 HydrophobicContact CB-CD1 3.67Å; N102-F145 HydrophobicContact CB-CD2 4.04Å; N102-F145 HydrophobicContact CB-CE1 3.77Å; N102-F145 HydrophobicContact CB-CE2 4.11Å; N102-F145 HydrophobicContact CB-CG 3.81Å; N102-F145 HydrophobicContact CB-CZ 4Å; K107-F145 HydrophobicContact CB-CE2 4.16Å; K107-F145 HydrophobicContact CB-CZ 3.73Å; K107-F145 HydrophobicContact CD-CZ 4.44Å; A109-F145 HydrophobicContact CB-CD2 3.46Å; A109-F145 VanDerWaalsContact CB-CD2 3.46Å; A109-F145 HydrophobicContact CB-CE2 3.47Å; A109-F145 VanDerWaalsContact CB-CE2 3.47Å; V119-F145 HydrophobicContact CG1-CE2 4.21Å; V119-F145 HydrophobicContact CG1-CZ 3.7Å; V119-F145 HydrophobicContact CG2-CZ 4.39Å; F145-I152 HydrophobicContact CB-CD1 4.24Å; F145-I152 HydrophobicContact CD1-CD1 3.37Å; F145-I152 HydrophobicContact CD2-CD1 3.59Å; F145-I152 HydrophobicContact CE1-CD1 3.46Å; F145-I152 VanDerWaalsContact CE1-CD1 3.46Å; F145-I152 HydrophobicContact CE2-CD1 3.68Å; F145-I152 HydrophobicContact CG-CD1 3.44Å; F145-I152 VanDerWaalsContact CG-CD1 3.44Å; F145-I152 HydrophobicContact CZ-CD1 3.61Å; F145-L166 HydrophobicContact CD1-CD1 4.29Å; F145-L166 HydrophobicContact CE1-CD1 3.6Å; F145-L166 HydrophobicContact CZ-CD1 4.42Å; F145-W195 VanDerWaalsContact C-CD1 3.45Å
146	D	94.5	Very high	93.1	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.091	C	C	.	.			trans	-63.8	129.6	166.7	172.7	14.2	0	0	0	109.7	L148 D149 V150 F151 W195 R216	D146-L148 PolarHBondContact O-N 3.13Å; D146-L148 PolarHBondContact OD1-N 2.97Å; D146-D149 PolarHBondContact O-N 2.85Å; D146-V150 WeakPolarHBondContact OD2-CB 3.34Å; D146-V150 PolarHBondContact OD2-N 3.38Å; D146-F151 HydrophobicContact CB-CB 4.03Å; D146-F151 WeakPolarHBondContact CB-O 3.43Å; D146-F151 PolarHBondContact N-O 3.02Å; D146-F151 PolarHBondContact OD2-N 2.91Å; D146-W195 HydrophobicContact CB-CD2 4.42Å; D146-W195 HydrophobicContact CB-CZ2 4.26Å; D146-R216 IonicContact OD1-CZ 3.59Å; D146-R216 IonicContact OD1-NH1 3.78Å; D146-R216 PolarHBondContact OD1-NH1 3.44Å; D146-R216 IonicContact OD1-NH2 3.13Å; D146-R216 IonicContact OD2-CZ 3.81Å; D146-R216 VanDerWaalsContact OD2-CZ 3.24Å; D146-R216 IonicContact OD2-NH1 2.64Å; D146-R216 PolarHBondContact OD2-NH1 3.3Å; D146-R216 IonicContact OD2-NH2 2.69Å; D146-R216 PolarHBondContact OD2-NH2 2.89Å
147	P	92.2	Very high	93.3	Very high	18 Å²	18	16.8 Å²	16.8	12%	0.117	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.1	176.2	26.5	-40.1	0	0	0	115.2	K103 E196 G200	K103-P147 HydrophobicContact CD-CB 3.96Å; P147-E196 WeakPolarHBondContact CG-O 3.43Å; P147-G200 VanDerWaalsContact CG-CA 3.47Å; P147-G200 VanDerWaalsContact CG-N 3.31Å
148	L	92	Very high	93.5	Very high	86 Å²	86	13.9 Å²	13.9	45%	0.45	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	4.7	175.9	-58.7	-172.8	0	0	0	113.7	D146 V150 V199	D146-L148 PolarHBondContact O-N 3.13Å; D146-L148 PolarHBondContact OD1-N 2.97Å; L148-V150 HydrophobicContact CB-CG2 4.07Å; L148-V150 PolarHBondContact O-N 3.4Å; L148-V199 WeakPolarHBondContact CD1-O 3.36Å
149	D	90.5	Very high	93.6	Very high	41 Å²	41	13.7 Å²	13.7	22%	0.219	8%	0.076	C	C	.	.	S	Bend	trans	55.9	28.7	-177.4	-78	7.2	0	0	0	114.2	N102 K107 D146 L166	N102-D149 WeakPolarHBondContact CB-OD1 3.26Å; N102-D149 PolarHBondContact ND2-OD2 3.12Å; K107-D149 IonicContact NZ-OD2 3.34Å; D146-D149 PolarHBondContact O-N 2.85Å; D149-L166 VanDerWaalsContact O-CD1 3.28Å; D149-L166 WeakPolarHBondContact O-CD1 3.37Å
150	V	91.9	Very high	93.8	Very high	47 Å²	47	13.6 Å²	13.6	29%	0.285	8%	0.075	S	C	.	.	S	Bend	trans	-97.3	-40.9	175.2	-173.1	0	0	0	0	111.2	D146 L148 L166	D146-V150 WeakPolarHBondContact OD2-CB 3.34Å; D146-V150 PolarHBondContact OD2-N 3.38Å; L148-V150 HydrophobicContact CB-CG2 4.07Å; L148-V150 PolarHBondContact O-N 3.4Å; V150-L166 WeakPolarHBondContact O-CB 3.4Å; V150-L166 PolarHBondContact O-N 3.22Å
151	F	94.5	Very high	93.8	Very high	25 Å²	25	13.6 Å²	13.6	11%	0.11	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	157.8	-174.9	-57.4	-69.5	0	0	0	114.6	D146 W164 D165 T172 W195 W219	D146-F151 HydrophobicContact CB-CB 4.03Å; D146-F151 WeakPolarHBondContact CB-O 3.43Å; D146-F151 PolarHBondContact N-O 3.02Å; D146-F151 PolarHBondContact OD2-N 2.91Å; F151-W164 CarbonylContact C-O 3.58Å; F151-W164 WeakPolarHBondContact CA-O 3.5Å; F151-D165 HydrophobicContact CD1-CB 4.29Å; F151-D165 HydrophobicContact CE1-CB 4.14Å; F151-T172 HydrophobicContact CE1-CG2 4.29Å; F151-W195 HydrophobicContact CB-CH2 4.15Å; F151-W195 HydrophobicContact CB-CZ2 4.06Å; F151-W219 HydrophobicContact CD1-CZ2 4.47Å; F151-W219 AromaticContact CD2-CH2 3.92Å; F151-W219 HydrophobicContact CD2-CH2 3.92Å; F151-W219 HydrophobicContact CD2-CZ2 4.03Å; F151-W219 HydrophobicContact CE1-CZ2 4.38Å; F151-W219 HydrophobicContact CE2-CH2 4.16Å; F151-W219 AromaticContact CE2-CZ2 3.91Å; F151-W219 HydrophobicContact CE2-CZ2 3.91Å; F151-W219 HydrophobicContact CG-CH2 4.3Å; F151-W219 HydrophobicContact CG-CZ2 4.31Å; F151-W219 HydrophobicContact CZ-CZ2 4.11Å
152	I	95.8	Very high	93.8	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	140.2	159.7	-62.5	-62	0	0	0	108	A109 V117 V119 V143 F145 L163 W164 L166	A109-I152 HydrophobicContact CB-CD1 3.84Å; V117-I152 HydrophobicContact CG1-CG2 4.17Å; V119-I152 HydrophobicContact CG2-CD1 4.07Å; V119-I152 HydrophobicContact CG2-CG1 3.77Å; V143-I152 HydrophobicContact CG2-CG2 3.35Å; F145-I152 HydrophobicContact CB-CD1 4.24Å; F145-I152 HydrophobicContact CD1-CD1 3.37Å; F145-I152 HydrophobicContact CD2-CD1 3.59Å; F145-I152 HydrophobicContact CE1-CD1 3.46Å; F145-I152 VanDerWaalsContact CE1-CD1 3.46Å; F145-I152 HydrophobicContact CE2-CD1 3.68Å; F145-I152 HydrophobicContact CG-CD1 3.44Å; F145-I152 VanDerWaalsContact CG-CD1 3.44Å; F145-I152 HydrophobicContact CZ-CD1 3.61Å; I152-L163 CarbonylContact O-C 3.45Å; I152-L163 WeakPolarHBondContact O-CA 3.36Å; I152-W164 HydrophobicContact CB-CB 4.27Å; I152-W164 PolarHBondContact N-O 3.4Å; I152-W164 VanDerWaalsContact O-CD1 3.31Å; I152-W164 PolarHBondContact O-N 3.25Å; I152-L166 HydrophobicContact CD1-CD1 4.28Å; I152-L166 HydrophobicContact CD1-CD2 4.3Å; I152-L166 HydrophobicContact CG1-CD1 4.27Å; I152-L166 HydrophobicContact CG1-CD2 3.73Å; I152-L166 HydrophobicContact CG1-CG 4.09Å
153	A	97	Very high	93.8	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	139.4	168.2	0	0	0	0	0	109.8	V143 A144 R162 L163 L193 W195 L203	V143-A153 CarbonylContact C-O 3.55Å; V143-A153 VanDerWaalsContact CA-O 3.27Å; V143-A153 WeakPolarHBondContact CA-O 3.23Å; A144-A153 PolarHBondContact N-O 3.45Å; A144-A153 PolarHBondContact O-N 3.13Å; A153-R162 CarbonylContact C-O 3.53Å; A153-R162 WeakPolarHBondContact CA-O 3.19Å; A153-L163 HydrophobicContact CB-CD1 3.73Å; A153-L193 HydrophobicContact CB-CD1 3.51Å; A153-W195 HydrophobicContact CB-CZ2 3.91Å; A153-L203 HydrophobicContact CB-CD1 3.81Å; A153-L203 HydrophobicContact CB-CD2 3.64Å; A153-L203 HydrophobicContact CB-CG 4.4Å
154	S	97.8	Very high	93.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	142.1	174.5	59.9	0	0	0	0	112.1	H136 S142 V161 R162 W164	H136-S154 PolarHBondContact CD2-OG 3.03Å; H136-S154 PolarHBondContact NE2-OG 3.26Å; S142-S154 VanDerWaalsContact O-CA 3.24Å; S142-S154 WeakPolarHBondContact O-CA 3.32Å; S142-S154 WeakPolarHBondContact O-CB 3.48Å; S154-V161 CarbonylContact O-C 3.56Å; S154-V161 WeakPolarHBondContact O-CA 3.32Å; S154-R162 PolarHBondContact N-O 2.69Å; S154-R162 PolarHBondContact O-N 2.84Å; S154-W164 PolarHBondContact OG-NE1 3.34Å
155	A	97.1	Very high	93.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.1	173.5	0	0	0	0	0	110.4	V140 L141 S142 V161 L178 C191 L193	V140-A155 CarbonylContact C-O 3.56Å; V140-A155 VanDerWaalsContact CG1-O 3.29Å; V140-A155 WeakPolarHBondContact CG1-O 3.13Å; L141-A155 PolarHBondContact N-O 2.81Å; S142-A155 PolarHBondContact N-O 2.59Å; S142-A155 PolarHBondContact O-N 2.9Å; A155-V161 HydrophobicContact CB-CG2 4.16Å; A155-L178 HydrophobicContact CB-CD1 3.7Å; A155-C191 HydrophobicContact CB-CB 4.1Å; A155-L193 HydrophobicContact CB-CD2 3.56Å
156	S	94.5	Very high	92.8	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.007	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	158	-175.7	171.3	0	0	0	0	112.8	H136 G138 A139 D158 G159 S160	H136-S156 WeakPolarHBondContact CE1-CB 3.14Å; H136-S156 WeakPolarHBondContact ND1-CB 3.44Å; G138-S156 PolarHBondContact O-OG 2.76Å; A139-S156 CarbonylContact O-C 3.5Å; A139-S156 VanDerWaalsContact O-CA 3.29Å; A139-S156 WeakPolarHBondContact O-CA 3.15Å; A139-S156 PolarHBondContact O-OG 2.85Å; S156-D158 VanDerWaalsContact CB-OD1 3.26Å; S156-D158 WeakPolarHBondContact CB-OD1 3.44Å; S156-D158 PolarHBondContact O-N 3.42Å; S156-D158 VanDerWaalsContact O-N 3.16Å; S156-D158 PolarHBondContact OG-N 3.25Å; S156-D158 VanDerWaalsContact OG-N 3.12Å; S156-D158 PolarHBondContact OG-OD1 3.35Å; S156-G159 PolarHBondContact O-N 2.92Å; S156-G159 VanDerWaalsContact O-N 3.17Å; S156-S160 PolarHBondContact N-O 2.88Å
157	C	89.1	Confident	92.2	Very high	1 Å²	1	21 Å²	21	1%	0.007	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-17.2	167.1	-65.2	0	0	0	0	113.4	A139 L141 G159 K180 C181	A139-C157 HydrophobicContact CB-CB 4.46Å; A139-C157 PolarHBondContact O-N 3.27Å; L141-C157 VanDerWaalsContact CD2-SG 3.52Å; C157-G159 PolarHBondContact O-N 3.37Å; C157-G159 VanDerWaalsContact O-N 3.12Å; C157-K180 CarbonylContact O-C 3.43Å; C157-K180 VanDerWaalsContact O-CA 3.32Å; C157-K180 WeakPolarHBondContact O-CA 3.39Å; C157-C181 WeakPolarHBondContact CB-O 3.26Å; C157-C181 VanDerWaalsContact CB-SG 3.57Å; C157-C181 PolarHBondContact O-N 3.16Å; C157-C181 VanDerWaalsContact O-O 3.05Å; C157-C181 PolarHBondContact SG-SG 3.45Å
158	D	86.2	Confident	91.5	Very high	24 Å²	24	24 Å²	24	13%	0.128	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	0.5	173.5	74.3	-0.9	0	0	0	114.4	H136 Q137 S156 S160 R162 K180	H136-D158 WeakPolarHBondContact CA-OD2 3.49Å; H136-D158 IonicContact CE1-OD1 2.71Å; H136-D158 IonicContact CG-OD2 3.14Å; H136-D158 IonicContact ND1-OD1 3.71Å; H136-D158 PolarHBondContact ND1-OD1 3.44Å; H136-D158 IonicContact ND1-OD2 2.71Å; H136-D158 PolarHBondContact ND1-OD2 3.43Å; Q137-D158 HydrophobicContact CB-CB 4.05Å; Q137-D158 PolarHBondContact N-OD2 2.98Å; S156-D158 VanDerWaalsContact CB-OD1 3.26Å; S156-D158 WeakPolarHBondContact CB-OD1 3.44Å; S156-D158 PolarHBondContact O-N 3.42Å; S156-D158 VanDerWaalsContact O-N 3.16Å; S156-D158 PolarHBondContact OG-N 3.25Å; S156-D158 VanDerWaalsContact OG-N 3.12Å; S156-D158 PolarHBondContact OG-OD1 3.35Å; D158-S160 VanDerWaalsContact C-N 3.34Å; D158-S160 PolarHBondContact OD1-N 3.13Å; D158-S160 PolarHBondContact OD1-OG 3.2Å; D158-R162 IonicContact OD2-NE 3.69Å; D158-R162 IonicContact OD2-NH2 2.68Å; D158-R162 PolarHBondContact OD2-NH2 3.22Å; D158-K180 WeakPolarHBondContact O-CE 3.35Å; D158-K180 WeakPolarHBondContact O-CG 3.21Å
159	G	87.5	Confident	90.7	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.01	11%	0.111	C	C	.	.	S	Bend	trans	84.9	5.6	178.3	0	0	0	0	0	113.6	S156 C157 T177 L178	S156-G159 PolarHBondContact O-N 2.92Å; S156-G159 VanDerWaalsContact O-N 3.17Å; C157-G159 PolarHBondContact O-N 3.37Å; C157-G159 VanDerWaalsContact O-N 3.12Å; G159-T177 PolarHBondContact O-N 3.38Å; G159-L178 WeakPolarHBondContact CA-O 3.49Å; G159-L178 PolarHBondContact O-N 3.13Å
160	S	92.4	Very high	90	Very high	3 Å²	3	21 Å²	21	2%	0.021	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	152.2	-177.5	87.8	0	0	0	0	114.3	S156 D158 R162 C174 I175	S156-S160 PolarHBondContact N-O 2.88Å; D158-S160 VanDerWaalsContact C-N 3.34Å; D158-S160 PolarHBondContact OD1-N 3.13Å; D158-S160 PolarHBondContact OD1-OG 3.2Å; S160-R162 PolarHBondContact OG-NE 3.1Å; S160-C174 VanDerWaalsContact CB-SG 3.55Å; S160-I175 CarbonylContact C-O 3.49Å; S160-I175 VanDerWaalsContact CA-O 3.3Å; S160-I175 WeakPolarHBondContact CA-O 3.21Å
161	V	95.7	Very high	89.7	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.7	161.4	-179.4	0	0	0	0	107.6	S154 A155 L163 I175 T177 L178 L193 L203 V205	S154-V161 CarbonylContact O-C 3.56Å; S154-V161 WeakPolarHBondContact O-CA 3.32Å; A155-V161 HydrophobicContact CB-CG2 4.16Å; V161-L163 HydrophobicContact CG1-CD2 4.43Å; V161-I175 HydrophobicContact CB-CB 4.44Å; V161-I175 PolarHBondContact N-O 3.49Å; V161-I175 PolarHBondContact O-N 3.3Å; V161-T177 HydrophobicContact CG2-CG2 4.07Å; V161-L178 HydrophobicContact CG2-CD1 3.89Å; V161-L178 HydrophobicContact CG2-CG 4.22Å; V161-L193 HydrophobicContact CG1-CD2 4.32Å; V161-L203 HydrophobicContact CG1-CD2 4.18Å; V161-V205 HydrophobicContact CG1-CG2 4.43Å; V161-V205 HydrophobicContact CG2-CG1 3.78Å; V161-V205 HydrophobicContact CG2-CG2 4.35Å
162	R	95.9	Very high	89.3	Confident	31 Å²	31	23.7 Å²	23.7	12%	0.117	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.7	178	-68.2	-179.1	-166.1	-97.5	-5.1	111.1	G135 H136 A153 S154 D158 S160 W164 E171 K173	G135-R162 VanDerWaalsContact O-CZ 3.25Å; G135-R162 PolarHBondContact O-NH2 3.07Å; H136-R162 VanDerWaalsContact CE1-CD 3.49Å; H136-R162 WeakPolarHBondContact CE1-CD 3.47Å; H136-R162 VanDerWaalsContact CE1-CG 3.44Å; H136-R162 WeakPolarHBondContact CE1-CG 3.26Å; H136-R162 PolarHBondContact ND1-NE 3.22Å; A153-R162 CarbonylContact C-O 3.53Å; A153-R162 WeakPolarHBondContact CA-O 3.19Å; S154-R162 PolarHBondContact N-O 2.69Å; S154-R162 PolarHBondContact O-N 2.84Å; D158-R162 IonicContact OD2-NE 3.69Å; D158-R162 IonicContact OD2-NH2 2.68Å; D158-R162 PolarHBondContact OD2-NH2 3.22Å; S160-R162 PolarHBondContact OG-NE 3.1Å; R162-W164 HydrophobicContact CB-CH2 4.31Å; R162-W164 HydrophobicContact CB-CZ2 3.6Å; R162-W164 HydrophobicContact CG-CZ2 4.21Å; R162-E171 IonicContact CZ-OE1 2.84Å; R162-E171 IonicContact CZ-OE2 2.94Å; R162-E171 IonicContact NH1-OE1 3.73Å; R162-E171 PolarHBondContact NH1-OE1 3.06Å; R162-E171 IonicContact NH1-OE2 3.43Å; R162-E171 PolarHBondContact NH1-OE2 2.87Å; R162-K173 WeakPolarHBondContact CA-O 3.03Å
163	L	95.5	Very high	89	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.9	175.9	-68.8	-60.2	0	0	0	107.7	I152 A153 V161 E171 T172 K173 I175 W195 L203 W219	I152-L163 CarbonylContact O-C 3.45Å; I152-L163 WeakPolarHBondContact O-CA 3.36Å; A153-L163 HydrophobicContact CB-CD1 3.73Å; V161-L163 HydrophobicContact CG1-CD2 4.43Å; L163-E171 CarbonylContact O-C 3.52Å; L163-E171 WeakPolarHBondContact O-CA 3.16Å; L163-T172 PolarHBondContact O-N 3.11Å; L163-K173 HydrophobicContact CB-CB 4.17Å; L163-K173 HydrophobicContact CD2-CB 4.22Å; L163-K173 HydrophobicContact CG-CB 4.39Å; L163-K173 PolarHBondContact N-O 3.38Å; L163-K173 PolarHBondContact O-N 2.65Å; L163-I175 HydrophobicContact CD2-CD1 3.92Å; L163-I175 HydrophobicContact CD2-CG1 4.33Å; L163-W195 HydrophobicContact CD1-CH2 3.99Å; L163-W195 HydrophobicContact CD1-CZ2 3.84Å; L163-L203 HydrophobicContact CD1-CD2 3.98Å; L163-W219 HydrophobicContact CD1-CE3 4.17Å; L163-W219 HydrophobicContact CD1-CH2 4.12Å; L163-W219 HydrophobicContact CD1-CZ3 3.84Å; L163-W219 HydrophobicContact CD2-CE3 4.47Å; L163-W219 HydrophobicContact CG-CD2 4.04Å; L163-W219 HydrophobicContact CG-CE3 3.91Å; L163-W219 HydrophobicContact CG-CH2 4.22Å; L163-W219 HydrophobicContact CG-CZ2 4.27Å; L163-W219 HydrophobicContact CG-CZ3 4.01Å
164	W	94.1	Very high	88.7	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.015	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.3	-176.5	-43.7	91	0	0	0	110.2	F133 H136 F151 I152 S154 R162 K170 E171	F133-W164 HydrophobicContact CB-CD2 3.72Å; F133-W164 HydrophobicContact CB-CE3 3.61Å; F133-W164 HydrophobicContact CB-CG 4.26Å; F133-W164 HydrophobicContact CB-CH2 4.29Å; F133-W164 HydrophobicContact CB-CZ2 4.4Å; F133-W164 HydrophobicContact CB-CZ3 3.9Å; F133-W164 HydrophobicContact CD1-CB 3.68Å; F133-W164 AromaticContact CD1-CD2 3.96Å; F133-W164 HydrophobicContact CD1-CD2 3.96Å; F133-W164 AromaticContact CD1-CE3 3.68Å; F133-W164 HydrophobicContact CD1-CE3 3.68Å; F133-W164 AromaticContact CD1-CG 3.99Å; F133-W164 HydrophobicContact CD1-CG 3.99Å; F133-W164 HydrophobicContact CD2-CB 4.46Å; F133-W164 HydrophobicContact CE1-CB 3.68Å; F133-W164 HydrophobicContact CE1-CG 4.46Å; F133-W164 HydrophobicContact CE2-CB 4.5Å; F133-W164 HydrophobicContact CG-CB 4.07Å; F133-W164 AromaticContact CG-CD2 3.94Å; F133-W164 HydrophobicContact CG-CD2 3.94Å; F133-W164 AromaticContact CG-CE3 3.94Å; F133-W164 HydrophobicContact CG-CE3 3.94Å; F133-W164 HydrophobicContact CG-CG 4.01Å; F133-W164 HydrophobicContact CZ-CB 4.13Å; H136-W164 AromaticContact CD2-CZ2 3.7Å; H136-W164 AromaticContact NE2-CZ2 3.95Å; F151-W164 CarbonylContact C-O 3.58Å; F151-W164 WeakPolarHBondContact CA-O 3.5Å; I152-W164 HydrophobicContact CB-CB 4.27Å; I152-W164 PolarHBondContact N-O 3.4Å; I152-W164 VanDerWaalsContact O-CD1 3.31Å; I152-W164 PolarHBondContact O-N 3.25Å; S154-W164 PolarHBondContact OG-NE1 3.34Å; R162-W164 HydrophobicContact CB-CH2 4.31Å; R162-W164 HydrophobicContact CB-CZ2 3.6Å; R162-W164 HydrophobicContact CG-CZ2 4.21Å; W164-K170 CarbonylContact C-O 3.58Å; W164-K170 WeakPolarHBondContact CA-O 3.32Å; W164-E171 HydrophobicContact CE3-CB 3.76Å; W164-E171 HydrophobicContact CE3-CG 4.48Å; W164-E171 HydrophobicContact CZ3-CB 3.73Å; W164-E171 HydrophobicContact CZ3-CG 4.43Å
165	D	88.4	Confident	88.5	Confident	21 Å²	21	31 Å²	31	11%	0.112	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	123.1	173.3	-169.8	-57.7	0	0	0	110	F151 V167 I168 G169 K170 T172	F151-D165 HydrophobicContact CD1-CB 4.29Å; F151-D165 HydrophobicContact CE1-CB 4.14Å; D165-V167 VanDerWaalsContact C-N 3.34Å; D165-V167 WeakPolarHBondContact OD1-CA 3.39Å; D165-V167 WeakPolarHBondContact OD1-CB 3.27Å; D165-V167 PolarHBondContact OD1-N 3.37Å; D165-I168 HydrophobicContact CB-CB 4.11Å; D165-I168 HydrophobicContact CB-CD1 4.34Å; D165-I168 HydrophobicContact CB-CG1 4.34Å; D165-I168 PolarHBondContact OD1-N 2.88Å; D165-G169 VanDerWaalsContact O-CA 3.3Å; D165-G169 WeakPolarHBondContact O-CA 3.47Å; D165-G169 PolarHBondContact O-N 3.26Å; D165-K170 PolarHBondContact N-O 3.42Å; D165-K170 PolarHBondContact O-N 3.06Å; D165-T172 WeakPolarHBondContact CB-OG1 3.5Å
166	L	86.2	Confident	88.1	Confident	24 Å²	24	36 Å²	36	13%	0.126	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-25.4	-178.6	-74.6	167.2	0	0	0	113.1	V119 L131 F133 F145 D149 V150 I152	V119-L166 HydrophobicContact CB-CD2 4.29Å; V119-L166 HydrophobicContact CG1-CD2 4.08Å; V119-L166 HydrophobicContact CG2-CD2 3.9Å; L131-L166 HydrophobicContact CD1-CD2 4.29Å; F133-L166 HydrophobicContact CE2-CD2 4.36Å; F133-L166 HydrophobicContact CZ-CD2 4.15Å; F145-L166 HydrophobicContact CD1-CD1 4.29Å; F145-L166 HydrophobicContact CE1-CD1 3.6Å; F145-L166 HydrophobicContact CZ-CD1 4.42Å; D149-L166 VanDerWaalsContact O-CD1 3.28Å; D149-L166 WeakPolarHBondContact O-CD1 3.37Å; V150-L166 WeakPolarHBondContact O-CB 3.4Å; V150-L166 PolarHBondContact O-N 3.22Å; I152-L166 HydrophobicContact CD1-CD1 4.28Å; I152-L166 HydrophobicContact CD1-CD2 4.3Å; I152-L166 HydrophobicContact CG1-CD1 4.27Å; I152-L166 HydrophobicContact CG1-CD2 3.73Å; I152-L166 HydrophobicContact CG1-CG 4.09Å
167	V	82.8	Confident	87.8	Confident	115 Å²	115	36.9 Å²	36.9	70%	0.697	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-46	179.3	-177.5	0	0	0	0	110.3	D165	D165-V167 VanDerWaalsContact C-N 3.34Å; D165-V167 WeakPolarHBondContact OD1-CA 3.39Å; D165-V167 WeakPolarHBondContact OD1-CB 3.27Å; D165-V167 PolarHBondContact OD1-N 3.37Å
168	I	76.2	Confident	87.9	Confident	79 Å²	79	38.4 Å²	38.4	41%	0.405	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-23.6	-178.4	-53.3	173	0	0	0	111.3	D165 K170 T688 L690	D165-I168 HydrophobicContact CB-CB 4.11Å; D165-I168 HydrophobicContact CB-CD1 4.34Å; D165-I168 HydrophobicContact CB-CG1 4.34Å; D165-I168 PolarHBondContact OD1-N 2.88Å; I168-K170 HydrophobicContact CG2-CB 3.97Å; I168-K170 HydrophobicContact CG2-CD 4.44Å; I168-K170 HydrophobicContact CG2-CG 4.3Å; I168-T688 VanDerWaalsContact O-O 3.13Å; I168-L690 HydrophobicContact CG2-CB 4.32Å; I168-L690 HydrophobicContact CG2-CD1 4.48Å; I168-L690 PolarHBondContact O-N 3.12Å
169	G	74.9	Confident	87.9	Confident	6 Å²	6	42.4 Å²	42.4	6%	0.062	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	34.7	-177.3	0	0	0	0	0	112.7	D165 S689	D165-G169 VanDerWaalsContact O-CA 3.3Å; D165-G169 WeakPolarHBondContact O-CA 3.47Å; D165-G169 PolarHBondContact O-N 3.26Å; G169-S689 PolarHBondContact O-OG 3.33Å
170	K	77	Confident	87.8	Confident	59 Å²	59	50.1 Å²	50.1	26%	0.257	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	160.7	-173.9	-92.5	-160.6	165.3	156.7	0	112.9	W164 D165 I168 L690 D691	W164-K170 CarbonylContact C-O 3.58Å; W164-K170 WeakPolarHBondContact CA-O 3.32Å; D165-K170 PolarHBondContact N-O 3.42Å; D165-K170 PolarHBondContact O-N 3.06Å; I168-K170 HydrophobicContact CG2-CB 3.97Å; I168-K170 HydrophobicContact CG2-CD 4.44Å; I168-K170 HydrophobicContact CG2-CG 4.3Å; K170-L690 HydrophobicContact CD-CB 3.78Å; K170-L690 WeakPolarHBondContact CE-O 3.18Å; K170-L690 HydrophobicContact CG-CB 4.1Å; K170-L690 PolarHBondContact NZ-O 3.12Å; K170-D691 HydrophobicContact CG-CB 4.22Å
171	E	84.5	Confident	87.3	Confident	64 Å²	64	51.3 Å²	51.3	30%	0.299	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	128.2	166.4	-175.1	179.1	168.9	0	0	111.6	R162 L163 W164 C174	R162-E171 IonicContact CZ-OE1 2.84Å; R162-E171 IonicContact CZ-OE2 2.94Å; R162-E171 IonicContact NH1-OE1 3.73Å; R162-E171 PolarHBondContact NH1-OE1 3.06Å; R162-E171 IonicContact NH1-OE2 3.43Å; R162-E171 PolarHBondContact NH1-OE2 2.87Å; L163-E171 CarbonylContact O-C 3.52Å; L163-E171 WeakPolarHBondContact O-CA 3.16Å; W164-E171 HydrophobicContact CE3-CB 3.76Å; W164-E171 HydrophobicContact CE3-CG 4.48Å; W164-E171 HydrophobicContact CZ3-CB 3.73Å; W164-E171 HydrophobicContact CZ3-CG 4.43Å; E171-C174 WeakPolarHBondContact OE1-CA 3.23Å; E171-C174 WeakPolarHBondContact OE1-CB 3.43Å; E171-C174 PolarHBondContact OE1-N 3.22Å
172	T	86.4	Confident	86.3	Confident	65 Å²	65	54.9 Å²	54.9	40%	0.399	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-37.6	172.3	-49.2	0	0	0	0	111.3	F151 L163 D165	F151-T172 HydrophobicContact CE1-CG2 4.29Å; L163-T172 PolarHBondContact O-N 3.11Å; D165-T172 WeakPolarHBondContact CB-OG1 3.5Å
173	K	89.8	Confident	85.4	Confident	86 Å²	86	54.8 Å²	54.8	37%	0.374	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	137.6	-174.2	-172.1	71.6	177.9	-174.4	0	112.1	R162 L163 I175 W219	R162-K173 WeakPolarHBondContact CA-O 3.03Å; L163-K173 HydrophobicContact CB-CB 4.17Å; L163-K173 HydrophobicContact CD2-CB 4.22Å; L163-K173 HydrophobicContact CG-CB 4.39Å; L163-K173 PolarHBondContact N-O 3.38Å; L163-K173 PolarHBondContact O-N 2.65Å; K173-I175 HydrophobicContact CG-CD1 4.46Å; K173-I175 HydrophobicContact CG-CG1 3.9Å; K173-W219 HydrophobicContact CB-CG 4.04Å; K173-W219 HydrophobicContact CD-CB 4.33Å; K173-W219 HydrophobicContact CG-CB 3.84Å; K173-W219 HydrophobicContact CG-CG 3.87Å
174	C	91.6	Very high	84.9	Confident	48 Å²	48	55.6 Å²	55.6	32%	0.324	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131.4	164.4	-166.1	0	0	0	0	109.4	S160 E171	S160-C174 VanDerWaalsContact CB-SG 3.55Å; E171-C174 WeakPolarHBondContact OE1-CA 3.23Å; E171-C174 WeakPolarHBondContact OE1-CB 3.43Å; E171-C174 PolarHBondContact OE1-N 3.22Å
175	I	92.2	Very high	84.4	Confident	20 Å²	20	61.4 Å²	61.4	10%	0.103	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	103.7	174.9	-52.6	175.7	0	0	0	108	S160 V161 L163 K173 T177 F214 W219	S160-I175 CarbonylContact C-O 3.49Å; S160-I175 VanDerWaalsContact CA-O 3.3Å; S160-I175 WeakPolarHBondContact CA-O 3.21Å; V161-I175 HydrophobicContact CB-CB 4.44Å; V161-I175 PolarHBondContact N-O 3.49Å; V161-I175 PolarHBondContact O-N 3.3Å; L163-I175 HydrophobicContact CD2-CD1 3.92Å; L163-I175 HydrophobicContact CD2-CG1 4.33Å; K173-I175 HydrophobicContact CG-CD1 4.46Å; K173-I175 HydrophobicContact CG-CG1 3.9Å; I175-T177 HydrophobicContact CG2-CG2 4.08Å; I175-T177 PolarHBondContact O-N 3.44Å; I175-T177 VanDerWaalsContact O-N 3.08Å; I175-F214 HydrophobicContact CD1-CD1 3.94Å; I175-F214 HydrophobicContact CD1-CE1 4.18Å; I175-F214 HydrophobicContact CD1-CG 4.15Å; I175-F214 HydrophobicContact CG2-CE1 3.85Å; I175-F214 HydrophobicContact CG2-CZ 3.85Å; I175-W219 HydrophobicContact CD1-CB 4.28Å
176	S	89.3	Confident	84	Confident	105 Å²	105	64.5 Å²	64.5	73%	0.734	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	82.7	177.5	-57.1	0	0	0	0	110.2
177	T	88.1	Confident	84	Confident	19 Å²	19	63.6 Å²	63.6	12%	0.117	35%	0.345	C	S	.	.			trans	-120.8	-8.4	-175.2	-171.3	0	0	0	0	114.1	G159 V161 I175 V205 V207 R212 F214	G159-T177 PolarHBondContact O-N 3.38Å; V161-T177 HydrophobicContact CG2-CG2 4.07Å; I175-T177 HydrophobicContact CG2-CG2 4.08Å; I175-T177 PolarHBondContact O-N 3.44Å; I175-T177 VanDerWaalsContact O-N 3.08Å; T177-V205 HydrophobicContact CG2-CG1 4.33Å; T177-V207 HydrophobicContact CG2-CG2 4.09Å; T177-V207 VanDerWaalsContact O-CG1 3.26Å; T177-V207 WeakPolarHBondContact O-CG1 3.49Å; T177-R212 WeakPolarHBondContact OG1-CD 3.4Å; T177-R212 PolarHBondContact OG1-NH1 3.5Å; T177-F214 HydrophobicContact CG2-CZ 4.42Å
178	L	91.1	Very high	84.1	Confident	32 Å²	32	61.4 Å²	61.4	17%	0.168	33%	0.333	C	S	.	.	S	Bend	trans	-103.7	160.4	-176.3	-56.3	174.5	0	0	0	110.7	A155 G159 V161 C191 V205 V207	A155-L178 HydrophobicContact CB-CD1 3.7Å; G159-L178 WeakPolarHBondContact CA-O 3.49Å; G159-L178 PolarHBondContact O-N 3.13Å; V161-L178 HydrophobicContact CG2-CD1 3.89Å; V161-L178 HydrophobicContact CG2-CG 4.22Å; L178-C191 HydrophobicContact CD1-CB 4.43Å; L178-V205 HydrophobicContact CD2-CG1 4.24Å; L178-V207 HydrophobicContact CD2-CG2 3.86Å
179	V	86.8	Confident	84.8	Confident	108 Å²	108	58.1 Å²	58.1	66%	0.655	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-76.7	131.2	171.6	-179.4	0	0	0	0	109.2	P188	V179-P188 HydrophobicContact CB-CG 4.33Å
180	K	85.4	Confident	85.6	Confident	164 Å²	164	59.7 Å²	59.7	71%	0.713	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-69.1	139.1	177.1	-62.3	-174	179.2	168.1	0	110.5	C157 D158	C157-K180 CarbonylContact O-C 3.43Å; C157-K180 VanDerWaalsContact O-CA 3.32Å; C157-K180 WeakPolarHBondContact O-CA 3.39Å; D158-K180 WeakPolarHBondContact O-CE 3.35Å; D158-K180 WeakPolarHBondContact O-CG 3.21Å
181	C	81.5	Confident	86.5	Confident	27 Å²	27	57 Å²	57	18%	0.182	31%	0.31	C	S	.	.			trans	-142.1	166.4	172.4	54.5	0	0	0	0	110	C157	C157-C181 WeakPolarHBondContact CB-O 3.26Å; C157-C181 VanDerWaalsContact CB-SG 3.57Å; C157-C181 PolarHBondContact O-N 3.16Å; C157-C181 VanDerWaalsContact O-O 3.05Å; C157-C181 PolarHBondContact SG-SG 3.45Å
182	N	74.6	Confident	87	Confident	76 Å²	76	54.8 Å²	54.8	41%	0.406	30%	0.299	S	S	.	.	S	Bend	trans	-94.1	-23.3	-176.3	-72.3	-42.6	0	0	0	113.5	R446	N182-R446 PolarHBondContact OD1-NH1 3.31Å
183	D	77.2	Confident	87.6	Confident	29 Å²	29	52.1 Å²	52.1	16%	0.155	28%	0.282	C	S	.	.			trans	-145.3	138.6	-172.2	-165.7	-56	0	0	0	109.9	L185 F186 A187	D183-L185 PolarHBondContact O-N 3.16Å; D183-L185 VanDerWaalsContact O-N 3.16Å; D183-L185 VanDerWaalsContact OD1-CB 3.28Å; D183-L185 WeakPolarHBondContact OD1-CB 3.46Å; D183-L185 PolarHBondContact OD1-N 3Å; D183-F186 HydrophobicContact CB-CD2 3.76Å; D183-F186 HydrophobicContact CB-CE2 4.22Å; D183-F186 PolarHBondContact O-N 3.42Å; D183-F186 VanDerWaalsContact O-N 3.08Å; D183-A187 PolarHBondContact O-N 3.09Å
184	P	85.2	Confident	87.8	Confident	17 Å²	17	49.5 Å²	49.5	11%	0.11	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-52.7	-30.1	172.8	-29.2	37.6	0	0	0	114.9	A139 L141 F186 A187	A139-P184 HydrophobicContact CB-CG 3.35Å; L141-P184 HydrophobicContact CD2-CB 3.69Å; L141-P184 HydrophobicContact CD2-CG 4.05Å; P184-F186 VanDerWaalsContact C-N 3.27Å; P184-F186 PolarHBondContact O-N 2.93Å; P184-A187 WeakPolarHBondContact O-CB 3.45Å; P184-A187 PolarHBondContact O-N 3.35Å
185	L	83	Confident	88.1	Confident	126 Å²	126	47.5 Å²	47.5	66%	0.66	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-64.3	-31.9	178.9	-167.7	75.7	0	0	0	112.5	D183	D183-L185 PolarHBondContact O-N 3.16Å; D183-L185 VanDerWaalsContact O-N 3.16Å; D183-L185 VanDerWaalsContact OD1-CB 3.28Å; D183-L185 WeakPolarHBondContact OD1-CB 3.46Å; D183-L185 PolarHBondContact OD1-N 3Å
186	F	80.2	Confident	88.1	Confident	85 Å²	85	46.8 Å²	46.8	37%	0.373	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-104.1	7.4	-179.7	-52.2	-62	0	0	0	112.8	D183 P184 T448	D183-F186 HydrophobicContact CB-CD2 3.76Å; D183-F186 HydrophobicContact CB-CE2 4.22Å; D183-F186 PolarHBondContact O-N 3.42Å; D183-F186 VanDerWaalsContact O-N 3.08Å; P184-F186 VanDerWaalsContact C-N 3.27Å; P184-F186 PolarHBondContact O-N 2.93Å; F186-T448 HydrophobicContact CE2-CG2 4.11Å; F186-T448 WeakPolarHBondContact CE2-O 3.2Å; F186-T448 WeakPolarHBondContact CZ-O 3.5Å
187	A	85.7	Confident	88.1	Confident	6 Å²	6	43.3 Å²	43.3	5%	0.05	23%	0.232	C	C	.	.			trans	-61.6	134.1	176.1	0	0	0	0	0	109.5	L141 D183 P184 S189	L141-A187 HydrophobicContact CD1-CB 3.95Å; L141-A187 HydrophobicContact CD2-CB 3.91Å; D183-A187 PolarHBondContact O-N 3.09Å; P184-A187 WeakPolarHBondContact O-CB 3.45Å; P184-A187 PolarHBondContact O-N 3.35Å; A187-S189 PolarHBondContact O-N 3.47Å; A187-S189 VanDerWaalsContact O-N 3.09Å
188	P	85.3	Confident	88.1	Confident	68 Å²	68	44.8 Å²	44.8	44%	0.442	24%	0.241	S	C	.	.	S	Bend	trans	-62	-22.3	179.9	25.7	-34.6	0	0	0	111.9	V179 L251	V179-P188 HydrophobicContact CB-CG 4.33Å; P188-L251 WeakPolarHBondContact O-CD1 3.08Å
189	S	91.1	Very high	88	Confident	10 Å²	10	46.4 Å²	46.4	7%	0.07	25%	0.252	C	S	.	.			trans	-154.7	147.9	176.3	167	0	0	0	0	108.4	A187 C191 Y234 N235	A187-S189 PolarHBondContact O-N 3.47Å; A187-S189 VanDerWaalsContact O-N 3.09Å; S189-C191 PolarHBondContact O-N 3.11Å; S189-C191 PolarHBondContact OG-N 2.91Å; S189-Y234 WeakPolarHBondContact CB-O 3.47Å; S189-Y234 PolarHBondContact OG-O 3.12Å; S189-N235 WeakPolarHBondContact OG-CA 3.47Å
190	Y	91.9	Very high	88.1	Confident	40 Å²	40	41.3 Å²	41.3	16%	0.157	22%	0.221	C	C	.	.			trans	-69.5	-7.7	168.6	-65.2	-33.3	0	0	0	112.9	L15 R192 N235	L15-Y190 HydrophobicContact CD1-CD2 4.15Å; L15-Y190 HydrophobicContact CD1-CE2 3.62Å; Y190-R192 VanDerWaalsContact C-N 3.31Å; Y190-R192 PolarHBondContact O-N 3.46Å; Y190-R192 PolarHBondContact O-NH1 2.94Å; Y190-R192 VanDerWaalsContact O-NH1 3.16Å; Y190-N235 WeakPolarHBondContact CB-OD1 3.25Å; Y190-N235 WeakPolarHBondContact CD2-ND2 3.36Å; Y190-N235 PolarHBondContact N-OD1 3.44Å
191	C	95.4	Very high	88.3	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.02	22%	0.215	C	C	.	.			trans	44.2	53.4	176.5	-168.2	0	0	0	0	111.7	S142 A155 L178 S189 L193 P206 N235	S142-C191 VanDerWaalsContact CB-O 3.26Å; S142-C191 WeakPolarHBondContact CB-O 3.48Å; S142-C191 PolarHBondContact OG-O 3.17Å; A155-C191 HydrophobicContact CB-CB 4.1Å; L178-C191 HydrophobicContact CD1-CB 4.43Å; S189-C191 PolarHBondContact O-N 3.11Å; S189-C191 PolarHBondContact OG-N 2.91Å; C191-L193 PolarHBondContact O-N 2.92Å; C191-P206 PolarHBondContact SG-O 3.11Å; C191-N235 PolarHBondContact N-O 3.45Å
192	R	96.2	Very high	88.9	Confident	16 Å²	16	39.3 Å²	39.3	6%	0.06	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-72.6	85.5	179.8	-61.1	-80.4	-175.8	-104.2	15.2	108.9	N97 H98 L141 Y190 N235 I236 C237	N97-R192 PolarHBondContact O-NH2 2.89Å; N97-R192 VanDerWaalsContact O-NH2 3.07Å; H98-R192 VanDerWaalsContact CD2-CD 3.44Å; H98-R192 WeakPolarHBondContact CD2-CD 3.36Å; H98-R192 PolarHBondContact CD2-NE 2.82Å; H98-R192 WeakPolarHBondContact NE2-CD 3.01Å; L141-R192 PolarHBondContact O-NH1 3.14Å; Y190-R192 VanDerWaalsContact C-N 3.31Å; Y190-R192 PolarHBondContact O-N 3.46Å; Y190-R192 PolarHBondContact O-NH1 2.94Å; Y190-R192 VanDerWaalsContact O-NH1 3.16Å; R192-N235 PolarHBondContact N-O 2.72Å; R192-I236 HydrophobicContact CB-CB 3.68Å; R192-I236 HydrophobicContact CB-CD1 3.74Å; R192-I236 HydrophobicContact CB-CG1 3.48Å; R192-I236 VanDerWaalsContact CB-CG1 3.48Å; R192-I236 HydrophobicContact CG-CB 4.14Å; R192-I236 HydrophobicContact CG-CD1 4.01Å; R192-I236 HydrophobicContact CG-CG1 4.18Å; R192-C237 PolarHBondContact O-N 3.31Å; R192-C237 PolarHBondContact O-SG 2.75Å
193	L	97.2	Very high	90	Very high	9 Å²	9	35.7 Å²	35.7	5%	0.047	19%	0.19	C	C	.	.			trans	-71.9	153.1	178.7	62.8	94.1	0	0	0	111	S142 A144 A153 A155 V161 C191 L203 L204	S142-L193 WeakPolarHBondContact OG-CD2 3.46Å; A144-L193 HydrophobicContact CB-CD1 3.33Å; A144-L193 HydrophobicContact CB-CG 4.43Å; A144-L193 WeakPolarHBondContact CB-O 3.45Å; A153-L193 HydrophobicContact CB-CD1 3.51Å; A155-L193 HydrophobicContact CB-CD2 3.56Å; V161-L193 HydrophobicContact CG1-CD2 4.32Å; C191-L193 PolarHBondContact O-N 2.92Å; L193-L203 HydrophobicContact CD1-CD1 3.83Å; L193-L204 VanDerWaalsContact CA-O 3.26Å; L193-L204 WeakPolarHBondContact CA-O 3.48Å; L193-L204 VanDerWaalsContact CB-O 3.24Å; L193-L204 WeakPolarHBondContact CB-O 3.42Å
194	C	95.7	Very high	90.9	Very high	31 Å²	31	34.3 Å²	34.3	21%	0.209	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	143.8	-175	-173.4	0	0	0	0	110.7	L204 C237	C194-L204 PolarHBondContact N-O 3.11Å; C194-L204 VanDerWaalsContact N-O 3.09Å; C194-L204 VanDerWaalsContact O-CB 3.28Å; C194-L204 WeakPolarHBondContact O-CB 3.22Å; C194-L204 PolarHBondContact O-N 3.43Å; C194-C237 WeakPolarHBondContact CB-O 3.18Å
195	W	96.1	Very high	91.5	Very high	7 Å²	7	33.5 Å²	33.5	3%	0.027	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	154.2	172.3	-67.8	86.2	0	0	0	111.1	A144 F145 D146 F151 A153 L163 S197 L203 R216 W219	A144-W195 PolarHBondContact O-NE1 2.87Å; F145-W195 VanDerWaalsContact C-CD1 3.45Å; D146-W195 HydrophobicContact CB-CD2 4.42Å; D146-W195 HydrophobicContact CB-CZ2 4.26Å; F151-W195 HydrophobicContact CB-CH2 4.15Å; F151-W195 HydrophobicContact CB-CZ2 4.06Å; A153-W195 HydrophobicContact CB-CZ2 3.91Å; L163-W195 HydrophobicContact CD1-CH2 3.99Å; L163-W195 HydrophobicContact CD1-CZ2 3.84Å; W195-S197 PolarHBondContact O-N 2.86Å; W195-L203 HydrophobicContact CD2-CB 4.41Å; W195-L203 HydrophobicContact CD2-CD1 3.83Å; W195-L203 HydrophobicContact CE3-CB 4.22Å; W195-L203 HydrophobicContact CE3-CD1 4.46Å; W195-L203 HydrophobicContact CG-CD1 3.96Å; W195-L203 HydrophobicContact CZ2-CD1 4.27Å; W195-L203 HydrophobicContact CZ3-CB 4.27Å; W195-R216 HydrophobicContact CZ3-CG 4.46Å; W195-W219 AromaticContact CH2-CH2 3.44Å; W195-W219 HydrophobicContact CH2-CH2 3.44Å; W195-W219 VanDerWaalsContact CH2-CH2 3.44Å; W195-W219 AromaticContact CH2-CZ3 3.44Å; W195-W219 HydrophobicContact CH2-CZ3 3.44Å; W195-W219 VanDerWaalsContact CH2-CZ3 3.44Å; W195-W219 AromaticContact CZ3-CH2 3.98Å; W195-W219 HydrophobicContact CZ3-CH2 3.98Å; W195-W219 AromaticContact CZ3-CZ3 3.81Å; W195-W219 HydrophobicContact CZ3-CZ3 3.81Å
196	E	93.8	Very high	92.2	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.019	15%	0.146	C	C	.	.			trans	-57.1	126.8	163.7	-174.4	-79.2	132.3	0	0	110.2	P147 T198 V199 G200 K201 F202 G243	P147-E196 WeakPolarHBondContact CG-O 3.43Å; E196-T198 VanDerWaalsContact C-N 3.35Å; E196-T198 PolarHBondContact O-N 3.46Å; E196-T198 WeakPolarHBondContact OE1-CA 3.16Å; E196-T198 VanDerWaalsContact OE1-CB 3.23Å; E196-T198 WeakPolarHBondContact OE1-CB 3.29Å; E196-T198 WeakPolarHBondContact OE1-CG2 3.19Å; E196-T198 PolarHBondContact OE1-N 3.41Å; E196-T198 PolarHBondContact OE1-OG1 3.01Å; E196-T198 PolarHBondContact OE2-N 3.4Å; E196-T198 PolarHBondContact OE2-OG1 2.83Å; E196-T198 VanDerWaalsContact OE2-OG1 3.07Å; E196-V199 PolarHBondContact OE2-N 3.36Å; E196-G200 VanDerWaalsContact O-CA 3.29Å; E196-G200 WeakPolarHBondContact O-CA 3.38Å; E196-G200 PolarHBondContact O-N 3.21Å; E196-G200 PolarHBondContact OE2-N 3.03Å; E196-K201 PolarHBondContact OE2-N 2.72Å; E196-F202 HydrophobicContact CB-CD2 3.9Å; E196-F202 HydrophobicContact CB-CE1 4.35Å; E196-F202 HydrophobicContact CB-CE2 3.63Å; E196-F202 HydrophobicContact CB-CG 4.35Å; E196-F202 HydrophobicContact CB-CZ 3.88Å; E196-F202 HydrophobicContact CG-CE1 4.01Å; E196-F202 HydrophobicContact CG-CE2 3.87Å; E196-F202 HydrophobicContact CG-CZ 3.58Å; E196-F202 PolarHBondContact N-O 3.21Å; E196-G243 WeakPolarHBondContact OE1-CA 3.34Å
197	S	88.4	Confident	92.8	Very high	32 Å²	32	24.1 Å²	24.1	22%	0.224	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.6	-162.9	-60.2	0	0	0	0	115.5	K103 W195 S239 S240	K103-S197 WeakPolarHBondContact CE-O 3.5Å; K103-S197 PolarHBondContact NZ-O 2.99Å; W195-S197 PolarHBondContact O-N 2.86Å; S197-S239 PolarHBondContact N-OG 2.79Å; S197-S239 WeakPolarHBondContact OG-CB 3.41Å; S197-S239 PolarHBondContact OG-O 3.44Å; S197-S239 VanDerWaalsContact OG-O 3.08Å; S197-S239 PolarHBondContact OG-OG 2.62Å; S197-S240 WeakPolarHBondContact CB-O 3.04Å; S197-S240 PolarHBondContact OG-O 3.05Å
198	T	88.1	Confident	93.2	Very high	51 Å²	51	28.6 Å²	28.6	31%	0.313	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-70	-176	65.2	0	0	0	0	112.3	K103 E196 R241	K103-T198 PolarHBondContact NZ-O 3.31Å; E196-T198 VanDerWaalsContact C-N 3.35Å; E196-T198 PolarHBondContact O-N 3.46Å; E196-T198 WeakPolarHBondContact OE1-CA 3.16Å; E196-T198 VanDerWaalsContact OE1-CB 3.23Å; E196-T198 WeakPolarHBondContact OE1-CB 3.29Å; E196-T198 WeakPolarHBondContact OE1-CG2 3.19Å; E196-T198 PolarHBondContact OE1-N 3.41Å; E196-T198 PolarHBondContact OE1-OG1 3.01Å; E196-T198 PolarHBondContact OE2-N 3.4Å; E196-T198 PolarHBondContact OE2-OG1 2.83Å; E196-T198 VanDerWaalsContact OE2-OG1 3.07Å; T198-R241 WeakPolarHBondContact CG2-O 3.26Å
199	V	88.6	Confident	93.6	Very high	66 Å²	66	30 Å²	30	40%	0.4	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	0.1	-175.4	-82.9	0	0	0	0	112.1	L148 E196 K201 R216	L148-V199 WeakPolarHBondContact CD1-O 3.36Å; E196-V199 PolarHBondContact OE2-N 3.36Å; V199-K201 HydrophobicContact CG2-CD 4.18Å; V199-K201 HydrophobicContact CG2-CG 3.65Å; V199-R216 PolarHBondContact O-NH1 3.49Å
200	G	89.3	Confident	93.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.			trans	67.1	41.4	179.3	0	0	0	0	0	111.2	P147 E196 F202 R216	P147-G200 VanDerWaalsContact CG-CA 3.47Å; P147-G200 VanDerWaalsContact CG-N 3.31Å; E196-G200 VanDerWaalsContact O-CA 3.29Å; E196-G200 WeakPolarHBondContact O-CA 3.38Å; E196-G200 PolarHBondContact O-N 3.21Å; E196-G200 PolarHBondContact OE2-N 3.03Å; G200-F202 PolarHBondContact O-N 3.47Å; G200-R216 WeakPolarHBondContact O-CD 3.43Å
201	K	90.5	Very high	93.9	Very high	134 Å²	134	29.9 Å²	29.9	58%	0.583	15%	0.154	S	C	*	.			trans	-54.9	-35.9	-179.7	-70.2	175.9	-173.4	173.2	0	112	E196 V199 R216	E196-K201 PolarHBondContact OE2-N 2.72Å; V199-K201 HydrophobicContact CG2-CD 4.18Å; V199-K201 HydrophobicContact CG2-CG 3.65Å; K201-R216 WeakPolarHBondContact O-CB 3.04Å; K201-R216 PolarHBondContact O-N 3.47Å
202	F	93.6	Very high	94	Very high	15 Å²	15	33 Å²	33	7%	0.066	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	156.7	179.7	48	-99.8	0	0	0	111.7	E196 G200 L204 M213 F214 L222 I246 V260	E196-F202 HydrophobicContact CB-CD2 3.9Å; E196-F202 HydrophobicContact CB-CE1 4.35Å; E196-F202 HydrophobicContact CB-CE2 3.63Å; E196-F202 HydrophobicContact CB-CG 4.35Å; E196-F202 HydrophobicContact CB-CZ 3.88Å; E196-F202 HydrophobicContact CG-CE1 4.01Å; E196-F202 HydrophobicContact CG-CE2 3.87Å; E196-F202 HydrophobicContact CG-CZ 3.58Å; E196-F202 PolarHBondContact N-O 3.21Å; G200-F202 PolarHBondContact O-N 3.47Å; F202-L204 HydrophobicContact CD2-CD2 3.75Å; F202-L204 HydrophobicContact CD2-CG 4.23Å; F202-L204 HydrophobicContact CE2-CD2 3.85Å; F202-L204 HydrophobicContact CE2-CG 4.32Å; F202-M213 HydrophobicContact CD1-CE 3.95Å; F202-M213 HydrophobicContact CD2-CE 3.53Å; F202-M213 HydrophobicContact CE1-CE 3.86Å; F202-M213 HydrophobicContact CE2-CE 3.43Å; F202-M213 VanDerWaalsContact CE2-CE 3.43Å; F202-M213 HydrophobicContact CG-CE 3.8Å; F202-M213 HydrophobicContact CZ-CE 3.61Å; F202-F214 CarbonylContact C-O 3.5Å; F202-F214 WeakPolarHBondContact CA-O 3.41Å; F202-F214 WeakPolarHBondContact CB-O 3.43Å; F202-L222 HydrophobicContact CB-CD1 3.91Å; F202-L222 HydrophobicContact CD1-CD1 4.43Å; F202-I246 HydrophobicContact CE2-CD1 4.05Å; F202-I246 HydrophobicContact CZ-CD1 4.45Å; F202-V260 HydrophobicContact CE1-CG1 3.9Å; F202-V260 HydrophobicContact CZ-CG1 3.66Å; F202-V260 HydrophobicContact CZ-CG2 4.21Å
203	L	96.5	Very high	93.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	132.6	171.8	177.1	69.3	0	0	0	109.7	A153 V161 L163 L193 W195 V205 M213 F214	A153-L203 HydrophobicContact CB-CD1 3.81Å; A153-L203 HydrophobicContact CB-CD2 3.64Å; A153-L203 HydrophobicContact CB-CG 4.4Å; V161-L203 HydrophobicContact CG1-CD2 4.18Å; L163-L203 HydrophobicContact CD1-CD2 3.98Å; L193-L203 HydrophobicContact CD1-CD1 3.83Å; W195-L203 HydrophobicContact CD2-CB 4.41Å; W195-L203 HydrophobicContact CD2-CD1 3.83Å; W195-L203 HydrophobicContact CE3-CB 4.22Å; W195-L203 HydrophobicContact CE3-CD1 4.46Å; W195-L203 HydrophobicContact CG-CD1 3.96Å; W195-L203 HydrophobicContact CZ2-CD1 4.27Å; W195-L203 HydrophobicContact CZ3-CB 4.27Å; L203-V205 HydrophobicContact CD2-CG2 3.96Å; L203-V205 HydrophobicContact CG-CG2 4.03Å; L203-M213 CarbonylContact O-C 3.59Å; L203-M213 WeakPolarHBondContact O-CA 3.11Å; L203-F214 PolarHBondContact N-O 2.52Å; L203-F214 PolarHBondContact O-N 3.12Å
204	L	96.8	Very high	93.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	125.5	176.1	-55	173.4	0	0	0	109.7	L193 C194 F202 I211 M213 C237 I246	L193-L204 VanDerWaalsContact CA-O 3.26Å; L193-L204 WeakPolarHBondContact CA-O 3.48Å; L193-L204 VanDerWaalsContact CB-O 3.24Å; L193-L204 WeakPolarHBondContact CB-O 3.42Å; C194-L204 PolarHBondContact N-O 3.11Å; C194-L204 VanDerWaalsContact N-O 3.09Å; C194-L204 VanDerWaalsContact O-CB 3.28Å; C194-L204 WeakPolarHBondContact O-CB 3.22Å; C194-L204 PolarHBondContact O-N 3.43Å; F202-L204 HydrophobicContact CD2-CD2 3.75Å; F202-L204 HydrophobicContact CD2-CG 4.23Å; F202-L204 HydrophobicContact CE2-CD2 3.85Å; F202-L204 HydrophobicContact CE2-CG 4.32Å; L204-I211 HydrophobicContact CB-CG2 4.02Å; L204-I211 HydrophobicContact CD2-CG2 4.25Å; L204-M213 HydrophobicContact CD2-CB 4.37Å; L204-M213 HydrophobicContact CD2-CE 4.18Å; L204-M213 HydrophobicContact CD2-CG 3.63Å; L204-M213 HydrophobicContact CD2-SD 4.35Å; L204-C237 HydrophobicContact CB-CB 4.48Å; L204-C237 VanDerWaalsContact CB-SG 3.54Å; L204-I246 HydrophobicContact CD1-CB 4.43Å; L204-I246 HydrophobicContact CD1-CD1 4.08Å; L204-I246 HydrophobicContact CD1-CG1 3.86Å; L204-I246 HydrophobicContact CD1-CG2 3.79Å; L204-I246 HydrophobicContact CD2-CD1 3.7Å; L204-I246 HydrophobicContact CD2-CG1 4.42Å
205	V	97.6	Very high	93.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	115.5	-179.9	-177.1	0	0	0	0	108.9	V161 T177 L178 L203 V207 R212 F214	V161-V205 HydrophobicContact CG1-CG2 4.43Å; V161-V205 HydrophobicContact CG2-CG1 3.78Å; V161-V205 HydrophobicContact CG2-CG2 4.35Å; T177-V205 HydrophobicContact CG2-CG1 4.33Å; L178-V205 HydrophobicContact CD2-CG1 4.24Å; L203-V205 HydrophobicContact CD2-CG2 3.96Å; L203-V205 HydrophobicContact CG-CG2 4.03Å; V205-V207 HydrophobicContact CB-CG2 4.36Å; V205-V207 HydrophobicContact CG1-CG2 3.72Å; V205-V207 PolarHBondContact O-N 3.39Å; V205-R212 PolarHBondContact N-O 3.29Å; V205-R212 PolarHBondContact O-N 3.41Å; V205-F214 HydrophobicContact CB-CD2 4.37Å; V205-F214 HydrophobicContact CB-CE2 4.04Å; V205-F214 HydrophobicContact CG2-CD2 3.79Å; V205-F214 HydrophobicContact CG2-CE2 3.84Å
206	P	97.5	Very high	93.5	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	120.3	169.2	-18.5	31.4	0	0	0	110.8	C191 I211 Y234 C237	C191-P206 PolarHBondContact SG-O 3.11Å; P206-I211 HydrophobicContact CB-CD1 3.78Å; P206-I211 HydrophobicContact CG-CD1 4.01Å; P206-Y234 WeakPolarHBondContact CB-O 3.2Å; P206-C237 HydrophobicContact CG-CB 4.12Å
207	V	94.1	Very high	93.2	Very high	14 Å²	14	41.3 Å²	41.3	9%	0.085	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	106.7	179.4	-175.5	0	0	0	0	108.5	T177 L178 V205 K209 E210 R212	T177-V207 HydrophobicContact CG2-CG2 4.09Å; T177-V207 VanDerWaalsContact O-CG1 3.26Å; T177-V207 WeakPolarHBondContact O-CG1 3.49Å; L178-V207 HydrophobicContact CD2-CG2 3.86Å; V205-V207 HydrophobicContact CB-CG2 4.36Å; V205-V207 HydrophobicContact CG1-CG2 3.72Å; V205-V207 PolarHBondContact O-N 3.39Å; V207-K209 PolarHBondContact O-N 3.34Å; V207-E210 CarbonylContact C-O 3.53Å; V207-E210 HydrophobicContact CB-CG 4.44Å; V207-E210 PolarHBondContact N-O 3.49Å; V207-E210 WeakPolarHBondContact O-CG 3.22Å; V207-E210 PolarHBondContact O-N 3.14Å; V207-R212 HydrophobicContact CB-CG 4.25Å; V207-R212 HydrophobicContact CG2-CB 4.34Å; V207-R212 HydrophobicContact CG2-CG 4.02Å
208	D	92.6	Very high	93	Very high	100 Å²	100	43 Å²	43	54%	0.535	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.7	-125.1	-174.8	-170.8	29.4	0	0	0	111.4	E210 A233 Y234	D208-E210 VanDerWaalsContact C-N 3.26Å; D208-E210 PolarHBondContact O-N 3.37Å; D208-A233 CarbonylContact O-C 3.57Å; D208-A233 WeakPolarHBondContact O-CA 3.41Å; D208-A233 WeakPolarHBondContact O-CB 3.33Å; D208-Y234 PolarHBondContact O-N 3.45Å
209	K	93.7	Very high	93.2	Very high	98 Å²	98	41.7 Å²	41.7	43%	0.426	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	17.8	-176.9	-51.5	-175.3	-161	-168.6	0	114.2	V207 A231 Y234	V207-K209 PolarHBondContact O-N 3.34Å; K209-A231 WeakPolarHBondContact CE-O 3.31Å; K209-A231 PolarHBondContact NZ-O 3.37Å; K209-Y234 VanDerWaalsContact O-CE2 3.25Å; K209-Y234 WeakPolarHBondContact O-CE2 3.44Å
210	E	94.6	Very high	93.3	Very high	46 Å²	46	41 Å²	41	22%	0.215	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	155.6	179	56.4	176.8	-170.9	0	0	112.9	V207 D208 R212 S224 L225	V207-E210 CarbonylContact C-O 3.53Å; V207-E210 HydrophobicContact CB-CG 4.44Å; V207-E210 PolarHBondContact N-O 3.49Å; V207-E210 WeakPolarHBondContact O-CG 3.22Å; V207-E210 PolarHBondContact O-N 3.14Å; D208-E210 VanDerWaalsContact C-N 3.26Å; D208-E210 PolarHBondContact O-N 3.37Å; E210-R212 HydrophobicContact CG-CG 4.4Å; E210-R212 IonicContact OE1-CZ 3.18Å; E210-R212 IonicContact OE1-NE 2.74Å; E210-R212 PolarHBondContact OE1-NE 3.47Å; E210-R212 IonicContact OE1-NH2 2.81Å; E210-R212 PolarHBondContact OE1-NH2 3.13Å; E210-S224 WeakPolarHBondContact OE2-CB 3.49Å; E210-S224 PolarHBondContact OE2-OG 3.3Å; E210-L225 CarbonylContact C-O 3.58Å; E210-L225 VanDerWaalsContact CA-O 3.26Å; E210-L225 WeakPolarHBondContact CA-O 3.44Å
211	I	96	Very high	93.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	110.5	166.9	-53.6	-57.2	0	0	0	107.9	L204 P206 S224 L225 Y234 C237 A248 W258	L204-I211 HydrophobicContact CB-CG2 4.02Å; L204-I211 HydrophobicContact CD2-CG2 4.25Å; P206-I211 HydrophobicContact CB-CD1 3.78Å; P206-I211 HydrophobicContact CG-CD1 4.01Å; I211-S224 CarbonylContact O-C 3.52Å; I211-S224 WeakPolarHBondContact O-CA 3.27Å; I211-L225 HydrophobicContact CB-CB 4.27Å; I211-L225 PolarHBondContact N-O 3.46Å; I211-L225 PolarHBondContact O-N 2.97Å; I211-Y234 HydrophobicContact CD1-CD1 4.38Å; I211-Y234 HydrophobicContact CD1-CD2 3.78Å; I211-Y234 HydrophobicContact CD1-CG 3.65Å; I211-Y234 HydrophobicContact CG1-CD2 4.1Å; I211-Y234 HydrophobicContact CG1-CE2 4.46Å; I211-Y234 HydrophobicContact CG1-CG 4.3Å; I211-C237 HydrophobicContact CD1-CB 4.2Å; I211-C237 HydrophobicContact CG2-CB 4.4Å; I211-A248 HydrophobicContact CD1-CB 3.78Å; I211-A248 HydrophobicContact CG1-CB 3.82Å; I211-W258 HydrophobicContact CG1-CH2 4.34Å
212	R	96.7	Very high	93.4	Very high	70 Å²	70	42.4 Å²	42.4	26%	0.264	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.8	176.9	-68.6	-169.9	-176.8	-171.3	-6.9	110.5	T177 V205 V207 E210 F214 L221	T177-R212 WeakPolarHBondContact OG1-CD 3.4Å; T177-R212 PolarHBondContact OG1-NH1 3.5Å; V205-R212 PolarHBondContact N-O 3.29Å; V205-R212 PolarHBondContact O-N 3.41Å; V207-R212 HydrophobicContact CB-CG 4.25Å; V207-R212 HydrophobicContact CG2-CB 4.34Å; V207-R212 HydrophobicContact CG2-CG 4.02Å; E210-R212 HydrophobicContact CG-CG 4.4Å; E210-R212 IonicContact OE1-CZ 3.18Å; E210-R212 IonicContact OE1-NE 2.74Å; E210-R212 PolarHBondContact OE1-NE 3.47Å; E210-R212 IonicContact OE1-NH2 2.81Å; E210-R212 PolarHBondContact OE1-NH2 3.13Å; R212-F214 HydrophobicContact CB-CD2 4.36Å; R212-F214 HydrophobicContact CB-CE2 3.62Å; R212-F214 HydrophobicContact CB-CZ 4.05Å; R212-L221 HydrophobicContact CB-CD1 3.7Å; R212-L221 HydrophobicContact CG-CD1 4.01Å
213	M	95	Very high	93.3	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	115.8	179.2	-56.8	-176.8	58.4	0	0	109.6	F202 L203 L204 L222 C223 L225 I246	F202-M213 HydrophobicContact CD1-CE 3.95Å; F202-M213 HydrophobicContact CD2-CE 3.53Å; F202-M213 HydrophobicContact CE1-CE 3.86Å; F202-M213 HydrophobicContact CE2-CE 3.43Å; F202-M213 VanDerWaalsContact CE2-CE 3.43Å; F202-M213 HydrophobicContact CG-CE 3.8Å; F202-M213 HydrophobicContact CZ-CE 3.61Å; L203-M213 CarbonylContact O-C 3.59Å; L203-M213 WeakPolarHBondContact O-CA 3.11Å; L204-M213 HydrophobicContact CD2-CB 4.37Å; L204-M213 HydrophobicContact CD2-CE 4.18Å; L204-M213 HydrophobicContact CD2-CG 3.63Å; L204-M213 HydrophobicContact CD2-SD 4.35Å; M213-L222 HydrophobicContact CB-CB 4.33Å; M213-L222 WeakPolarHBondContact O-CB 3.45Å; M213-L222 PolarHBondContact O-N 3.1Å; M213-C223 PolarHBondContact N-O 2.95Å; M213-C223 PolarHBondContact SD-SG 3.43Å; M213-L225 HydrophobicContact CG-CD1 4.46Å; M213-L225 HydrophobicContact CG-CG 4.4Å; M213-L225 HydrophobicContact SD-CD1 3.83Å; M213-L225 HydrophobicContact SD-CD2 4.07Å; M213-L225 HydrophobicContact SD-CG 3.88Å; M213-I246 HydrophobicContact CE-CD1 3.87Å; M213-I246 HydrophobicContact SD-CD1 4.09Å
214	F	95.2	Very high	93.2	Very high	12 Å²	12	45 Å²	45	5%	0.053	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	132.3	-179.9	-66.8	-84.3	0	0	0	111.7	I175 T177 F202 L203 V205 R212 S220 L221	I175-F214 HydrophobicContact CD1-CD1 3.94Å; I175-F214 HydrophobicContact CD1-CE1 4.18Å; I175-F214 HydrophobicContact CD1-CG 4.15Å; I175-F214 HydrophobicContact CG2-CE1 3.85Å; I175-F214 HydrophobicContact CG2-CZ 3.85Å; T177-F214 HydrophobicContact CG2-CZ 4.42Å; F202-F214 CarbonylContact C-O 3.5Å; F202-F214 WeakPolarHBondContact CA-O 3.41Å; F202-F214 WeakPolarHBondContact CB-O 3.43Å; L203-F214 PolarHBondContact N-O 2.52Å; L203-F214 PolarHBondContact O-N 3.12Å; V205-F214 HydrophobicContact CB-CD2 4.37Å; V205-F214 HydrophobicContact CB-CE2 4.04Å; V205-F214 HydrophobicContact CG2-CD2 3.79Å; V205-F214 HydrophobicContact CG2-CE2 3.84Å; R212-F214 HydrophobicContact CB-CD2 4.36Å; R212-F214 HydrophobicContact CB-CE2 3.62Å; R212-F214 HydrophobicContact CB-CZ 4.05Å; F214-S220 CarbonylContact C-O 3.49Å; F214-S220 WeakPolarHBondContact CA-O 3.38Å; F214-L221 HydrophobicContact CD1-CB 4.34Å; F214-L221 HydrophobicContact CD1-CD1 4.48Å; F214-L221 HydrophobicContact CE1-CB 4.07Å; F214-L221 HydrophobicContact CE1-CD1 4.11Å; F214-L221 HydrophobicContact CZ-CD1 4.16Å
215	E	93.3	Very high	93	Very high	65 Å²	65	45.2 Å²	45.2	30%	0.304	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	137	177.9	-166.7	-171.2	-167.6	0	0	111.9	V217 C218 W219 S220 L222	E215-V217 VanDerWaalsContact C-N 3.32Å; E215-V217 PolarHBondContact O-N 3.25Å; E215-C218 PolarHBondContact OE2-SG 2.92Å; E215-W219 WeakPolarHBondContact O-CA 3.26Å; E215-W219 PolarHBondContact O-N 2.99Å; E215-S220 PolarHBondContact N-O 3.48Å; E215-L222 HydrophobicContact CB-CD1 4.03Å; E215-L222 HydrophobicContact CB-CD2 3.87Å; E215-L222 HydrophobicContact CB-CG 3.84Å; E215-L222 HydrophobicContact CG-CD1 4.47Å; E215-L222 HydrophobicContact CG-CD2 4.25Å
216	R	90.9	Very high	92.8	Very high	42 Å²	42	48.7 Å²	48.7	16%	0.158	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-35.5	177.7	-175	-168.2	178.9	102.6	10.1	114.5	D146 W195 V199 G200 K201 W219	D146-R216 IonicContact OD1-CZ 3.59Å; D146-R216 IonicContact OD1-NH1 3.78Å; D146-R216 PolarHBondContact OD1-NH1 3.44Å; D146-R216 IonicContact OD1-NH2 3.13Å; D146-R216 IonicContact OD2-CZ 3.81Å; D146-R216 VanDerWaalsContact OD2-CZ 3.24Å; D146-R216 IonicContact OD2-NH1 2.64Å; D146-R216 PolarHBondContact OD2-NH1 3.3Å; D146-R216 IonicContact OD2-NH2 2.69Å; D146-R216 PolarHBondContact OD2-NH2 2.89Å; W195-R216 HydrophobicContact CZ3-CG 4.46Å; V199-R216 PolarHBondContact O-NH1 3.49Å; G200-R216 WeakPolarHBondContact O-CD 3.43Å; K201-R216 WeakPolarHBondContact O-CB 3.04Å; K201-R216 PolarHBondContact O-N 3.47Å; R216-W219 HydrophobicContact CB-CH2 4.49Å; R216-W219 HydrophobicContact CG-CH2 4.03Å; R216-W219 WeakPolarHBondContact O-CH2 3.27Å; R216-W219 VanDerWaalsContact O-CZ2 3.25Å; R216-W219 WeakPolarHBondContact O-CZ2 3.4Å
217	V	87.6	Confident	92.5	Very high	120 Å²	120	49 Å²	49	73%	0.727	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-53.8	-168.3	-178.3	0	0	0	0	111.9	E215	E215-V217 VanDerWaalsContact C-N 3.32Å; E215-V217 PolarHBondContact O-N 3.25Å
218	C	85.4	Confident	92.2	Very high	67 Å²	67	54.1 Å²	54.1	45%	0.453	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-1.1	-176.3	68	0	0	0	0	113.8	E215 S220	E215-C218 PolarHBondContact OE2-SG 2.92Å; C218-S220 PolarHBondContact O-N 3.43Å; C218-S220 WeakPolarHBondContact SG-CB 3.3Å; C218-S220 PolarHBondContact SG-OG 3.39Å
219	W	91.5	Very high	91.9	Very high	23 Å²	23	51.4 Å²	51.4	9%	0.087	29%	0.289	C	S	.	.			trans	57.7	27.9	-175.6	-46.9	106.6	0	0	0	113.2	F151 L163 K173 I175 W195 E215 R216	F151-W219 HydrophobicContact CD1-CZ2 4.47Å; F151-W219 AromaticContact CD2-CH2 3.92Å; F151-W219 HydrophobicContact CD2-CH2 3.92Å; F151-W219 HydrophobicContact CD2-CZ2 4.03Å; F151-W219 HydrophobicContact CE1-CZ2 4.38Å; F151-W219 HydrophobicContact CE2-CH2 4.16Å; F151-W219 AromaticContact CE2-CZ2 3.91Å; F151-W219 HydrophobicContact CE2-CZ2 3.91Å; F151-W219 HydrophobicContact CG-CH2 4.3Å; F151-W219 HydrophobicContact CG-CZ2 4.31Å; F151-W219 HydrophobicContact CZ-CZ2 4.11Å; L163-W219 HydrophobicContact CD1-CE3 4.17Å; L163-W219 HydrophobicContact CD1-CH2 4.12Å; L163-W219 HydrophobicContact CD1-CZ3 3.84Å; L163-W219 HydrophobicContact CD2-CE3 4.47Å; L163-W219 HydrophobicContact CG-CD2 4.04Å; L163-W219 HydrophobicContact CG-CE3 3.91Å; L163-W219 HydrophobicContact CG-CH2 4.22Å; L163-W219 HydrophobicContact CG-CZ2 4.27Å; L163-W219 HydrophobicContact CG-CZ3 4.01Å; K173-W219 HydrophobicContact CB-CG 4.04Å; K173-W219 HydrophobicContact CD-CB 4.33Å; K173-W219 HydrophobicContact CG-CB 3.84Å; K173-W219 HydrophobicContact CG-CG 3.87Å; I175-W219 HydrophobicContact CD1-CB 4.28Å; W195-W219 AromaticContact CH2-CH2 3.44Å; W195-W219 HydrophobicContact CH2-CH2 3.44Å; W195-W219 VanDerWaalsContact CH2-CH2 3.44Å; W195-W219 AromaticContact CH2-CZ3 3.44Å; W195-W219 HydrophobicContact CH2-CZ3 3.44Å; W195-W219 VanDerWaalsContact CH2-CZ3 3.44Å; W195-W219 AromaticContact CZ3-CH2 3.98Å; W195-W219 HydrophobicContact CZ3-CH2 3.98Å; W195-W219 AromaticContact CZ3-CZ3 3.81Å; W195-W219 HydrophobicContact CZ3-CZ3 3.81Å; E215-W219 WeakPolarHBondContact O-CA 3.26Å; E215-W219 PolarHBondContact O-N 2.99Å; R216-W219 HydrophobicContact CB-CH2 4.49Å; R216-W219 HydrophobicContact CG-CH2 4.03Å; R216-W219 WeakPolarHBondContact O-CH2 3.27Å; R216-W219 VanDerWaalsContact O-CZ2 3.25Å; R216-W219 WeakPolarHBondContact O-CZ2 3.4Å
220	S	90.5	Very high	91.8	Very high	53 Å²	53	47.1 Å²	47.1	37%	0.371	27%	0.271	S	S	.	.			trans	-78.4	151.6	173.1	70.5	0	0	0	0	110.6	F214 E215 C218 L222	F214-S220 CarbonylContact C-O 3.49Å; F214-S220 WeakPolarHBondContact CA-O 3.38Å; E215-S220 PolarHBondContact N-O 3.48Å; C218-S220 PolarHBondContact O-N 3.43Å; C218-S220 WeakPolarHBondContact SG-CB 3.3Å; C218-S220 PolarHBondContact SG-OG 3.39Å; S220-L222 PolarHBondContact O-N 3.19Å
221	L	92.6	Very high	91.5	Very high	83 Å²	83	47.8 Å²	47.8	44%	0.435	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	115.7	174.4	179.4	66.6	0	0	0	109	R212 F214 C223	R212-L221 HydrophobicContact CB-CD1 3.7Å; R212-L221 HydrophobicContact CG-CD1 4.01Å; F214-L221 HydrophobicContact CD1-CB 4.34Å; F214-L221 HydrophobicContact CD1-CD1 4.48Å; F214-L221 HydrophobicContact CE1-CB 4.07Å; F214-L221 HydrophobicContact CE1-CD1 4.11Å; F214-L221 HydrophobicContact CZ-CD1 4.16Å; L221-C223 WeakPolarHBondContact CD1-O 3.2Å
222	L	89.7	Confident	91.3	Very high	79 Å²	79	52.5 Å²	52.5	41%	0.414	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-49.3	174.4	-68.2	173.1	0	0	0	111	F202 M213 E215 S220	F202-L222 HydrophobicContact CB-CD1 3.91Å; F202-L222 HydrophobicContact CD1-CD1 4.43Å; M213-L222 HydrophobicContact CB-CB 4.33Å; M213-L222 WeakPolarHBondContact O-CB 3.45Å; M213-L222 PolarHBondContact O-N 3.1Å; E215-L222 HydrophobicContact CB-CD1 4.03Å; E215-L222 HydrophobicContact CB-CD2 3.87Å; E215-L222 HydrophobicContact CB-CG 3.84Å; E215-L222 HydrophobicContact CG-CD1 4.47Å; E215-L222 HydrophobicContact CG-CD2 4.25Å; S220-L222 PolarHBondContact O-N 3.19Å
223	C	92	Very high	91.2	Very high	26 Å²	26	49.6 Å²	49.6	18%	0.176	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	173.7	176.8	64.8	0	0	0	0	111.2	M213 L221 R263	M213-C223 PolarHBondContact N-O 2.95Å; M213-C223 PolarHBondContact SD-SG 3.43Å; L221-C223 WeakPolarHBondContact CD1-O 3.2Å; C223-R263 PolarHBondContact SG-NH1 3.11Å
224	S	93.1	Very high	91.3	Very high	44 Å²	44	49.5 Å²	49.5	31%	0.308	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	133.6	168.2	-69.4	0	0	0	0	110.4	E210 I211	E210-S224 WeakPolarHBondContact OE2-CB 3.49Å; E210-S224 PolarHBondContact OE2-OG 3.3Å; I211-S224 CarbonylContact O-C 3.52Å; I211-S224 WeakPolarHBondContact O-CA 3.27Å
225	L	94.2	Very high	91.3	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	123.8	171.3	-53.1	175.6	0	0	0	108.9	E210 I211 M213 I246 W258 R263	E210-L225 CarbonylContact C-O 3.58Å; E210-L225 VanDerWaalsContact CA-O 3.26Å; E210-L225 WeakPolarHBondContact CA-O 3.44Å; I211-L225 HydrophobicContact CB-CB 4.27Å; I211-L225 PolarHBondContact N-O 3.46Å; I211-L225 PolarHBondContact O-N 2.97Å; M213-L225 HydrophobicContact CG-CD1 4.46Å; M213-L225 HydrophobicContact CG-CG 4.4Å; M213-L225 HydrophobicContact SD-CD1 3.83Å; M213-L225 HydrophobicContact SD-CD2 4.07Å; M213-L225 HydrophobicContact SD-CG 3.88Å; L225-I246 HydrophobicContact CD1-CB 4.38Å; L225-I246 HydrophobicContact CD1-CD1 3.78Å; L225-I246 HydrophobicContact CD1-CG2 4.16Å; L225-W258 HydrophobicContact CB-CD2 4.26Å; L225-W258 HydrophobicContact CB-CG 4.46Å; L225-W258 HydrophobicContact CB-CZ2 4.32Å; L225-W258 HydrophobicContact CD1-CB 4.27Å; L225-W258 HydrophobicContact CD1-CD2 4.24Å; L225-W258 HydrophobicContact CD1-CE3 4.48Å; L225-W258 HydrophobicContact CD1-CG 4.15Å; L225-R263 HydrophobicContact CD2-CB 3.84Å; L225-R263 HydrophobicContact CD2-CG 4.3Å
226	S	92.5	Very high	91.4	Very high	73 Å²	73	46.5 Å²	46.5	51%	0.51	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	164.7	175.5	64.8	0	0	0	0	110.4	W258	S226-W258 PolarHBondContact O-NE1 3.3Å
227	C	91	Very high	91.7	Very high	6 Å²	6	44.7 Å²	44.7	4%	0.041	28%	0.277	C	S	.	.			trans	-140.3	122.7	174.6	-174.8	0	0	0	0	108.5	S229 V230 I256 W258 R268	C227-S229 PolarHBondContact O-N 3.13Å; C227-V230 HydrophobicContact CB-CG2 4.17Å; C227-V230 PolarHBondContact O-N 2.98Å; C227-V230 VanDerWaalsContact O-N 3.09Å; C227-I256 HydrophobicContact CB-CD1 4.48Å; C227-I256 HydrophobicContact CB-CG1 4.26Å; C227-I256 HydrophobicContact CB-CG2 4.19Å; C227-W258 HydrophobicContact CB-CZ2 4.27Å; C227-R268 VanDerWaalsContact SG-CD 3.6Å; C227-R268 PolarHBondContact SG-NE 2.68Å
228	P	87.5	Confident	92	Very high	123 Å²	123	39.4 Å²	39.4	80%	0.799	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.3	-177.4	-27.8	35.1	0	0	0	114.8	V230	P228-V230 VanDerWaalsContact C-N 3.27Å; P228-V230 PolarHBondContact O-N 2.82Å
229	S	86.7	Confident	92.4	Very high	43 Å²	43	36.6 Å²	36.6	30%	0.301	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-18.3	-179.8	-53.9	0	0	0	0	113.9	C227 W254 R268	C227-S229 PolarHBondContact O-N 3.13Å; S229-W254 PolarHBondContact O-NE1 3.05Å; S229-R268 PolarHBondContact OG-NH1 3.33Å; S229-R268 VanDerWaalsContact OG-NH1 3.17Å
230	V	91	Very high	92.4	Very high	7 Å²	7	35.7 Å²	35.7	4%	0.042	22%	0.224	C	C	.	.			trans	-92.2	115.3	-174.5	178.7	0	0	0	0	109.6	C227 P228 Q232 Y234 W254 I256	C227-V230 HydrophobicContact CB-CG2 4.17Å; C227-V230 PolarHBondContact O-N 2.98Å; C227-V230 VanDerWaalsContact O-N 3.09Å; P228-V230 VanDerWaalsContact C-N 3.27Å; P228-V230 PolarHBondContact O-N 2.82Å; V230-Q232 WeakPolarHBondContact CG1-O 3.36Å; V230-Y234 HydrophobicContact CG1-CE1 4.11Å; V230-Y234 HydrophobicContact CG2-CE1 4.14Å; V230-Y234 WeakPolarHBondContact CG2-OH 3.27Å; V230-W254 HydrophobicContact CG2-CB 3.75Å; V230-W254 HydrophobicContact CG2-CG 3.85Å; V230-I256 HydrophobicContact CG2-CD1 3.9Å; V230-I256 HydrophobicContact CG2-CG1 3.71Å
231	A	89.2	Confident	92.2	Very high	60 Å²	60	41.2 Å²	41.2	50%	0.496	24%	0.237	S	C	.	.			trans	-91.6	-24.7	-174.3	0	0	0	0	0	113.1	K209 D252	K209-A231 WeakPolarHBondContact CE-O 3.31Å; K209-A231 PolarHBondContact NZ-O 3.37Å; A231-D252 PolarHBondContact N-OD2 3.21Å; A231-D252 VanDerWaalsContact N-OD2 3.15Å
232	Q	92.4	Very high	91.8	Very high	100 Å²	100	40.2 Å²	40.2	47%	0.467	23%	0.232	S	C	.	.	S	Bend	trans	-117.6	170.4	-177.9	-62.3	-170.5	3.1	0	0	112.4	V230 L251 D252	V230-Q232 WeakPolarHBondContact CG1-O 3.36Å; Q232-L251 HydrophobicContact CB-CB 3.91Å; Q232-L251 HydrophobicContact CB-CD1 4.42Å; Q232-D252 HydrophobicContact CB-CB 4.13Å; Q232-D252 HydrophobicContact CG-CB 3.99Å
233	A	93.7	Very high	91.6	Very high	8 Å²	8	36.8 Å²	36.8	7%	0.066	22%	0.216	C	C	.	.			trans	-61.3	152	-174.7	0	0	0	0	0	113.8	D208 S250 L251	D208-A233 CarbonylContact O-C 3.57Å; D208-A233 WeakPolarHBondContact O-CA 3.41Å; D208-A233 WeakPolarHBondContact O-CB 3.33Å; A233-S250 WeakPolarHBondContact O-CA 3.41Å; A233-L251 HydrophobicContact CB-CD1 4.03Å; A233-L251 HydrophobicContact CB-CG 4.44Å; A233-L251 WeakPolarHBondContact O-CG 3.36Å; A233-L251 PolarHBondContact O-N 3.46Å
234	Y	96.4	Very high	91.3	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	130.2	166.4	-70.3	-69.5	0	0	0	110.6	S189 P206 D208 K209 I211 V230 A248 I256 W258	S189-Y234 WeakPolarHBondContact CB-O 3.47Å; S189-Y234 PolarHBondContact OG-O 3.12Å; P206-Y234 WeakPolarHBondContact CB-O 3.2Å; D208-Y234 PolarHBondContact O-N 3.45Å; K209-Y234 VanDerWaalsContact O-CE2 3.25Å; K209-Y234 WeakPolarHBondContact O-CE2 3.44Å; I211-Y234 HydrophobicContact CD1-CD1 4.38Å; I211-Y234 HydrophobicContact CD1-CD2 3.78Å; I211-Y234 HydrophobicContact CD1-CG 3.65Å; I211-Y234 HydrophobicContact CG1-CD2 4.1Å; I211-Y234 HydrophobicContact CG1-CE2 4.46Å; I211-Y234 HydrophobicContact CG1-CG 4.3Å; V230-Y234 HydrophobicContact CG1-CE1 4.11Å; V230-Y234 HydrophobicContact CG2-CE1 4.14Å; V230-Y234 WeakPolarHBondContact CG2-OH 3.27Å; Y234-A248 HydrophobicContact CD1-CB 3.59Å; Y234-A248 HydrophobicContact CE1-CB 3.89Å; Y234-A248 HydrophobicContact CG-CB 4.21Å; Y234-I256 HydrophobicContact CE1-CG1 4.14Å; Y234-W258 AromaticContact CE1-CH2 3.92Å; Y234-W258 HydrophobicContact CE1-CH2 3.92Å; Y234-W258 HydrophobicContact CE2-CH2 4.31Å; Y234-W258 AromaticContact CZ-CH2 3.65Å; Y234-W258 WeakPolarHBondContact OH-CH2 3.44Å; Y234-W258 WeakPolarHBondContact OH-CZ2 3.43Å
235	N	95.8	Very high	91.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-34.6	-178.7	-162	44.9	0	0	0	112.5	S189 Y190 C191 R192 G249 L251 I277	S189-N235 WeakPolarHBondContact OG-CA 3.47Å; Y190-N235 WeakPolarHBondContact CB-OD1 3.25Å; Y190-N235 WeakPolarHBondContact CD2-ND2 3.36Å; Y190-N235 PolarHBondContact N-OD1 3.44Å; C191-N235 PolarHBondContact N-O 3.45Å; R192-N235 PolarHBondContact N-O 2.72Å; N235-G249 PolarHBondContact N-O 3.34Å; N235-L251 HydrophobicContact CB-CD2 4.06Å; N235-I277 WeakPolarHBondContact CB-O 3.25Å; N235-I277 PolarHBondContact ND2-O 3.18Å
236	I	96.9	Very high	91.1	Very high	14 Å²	14	37.6 Å²	37.6	7%	0.072	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	147.7	-173.6	-179.1	157.1	0	0	0	112.2	R192 A248 G249 I277 L280	R192-I236 HydrophobicContact CB-CB 3.68Å; R192-I236 HydrophobicContact CB-CD1 3.74Å; R192-I236 HydrophobicContact CB-CG1 3.48Å; R192-I236 VanDerWaalsContact CB-CG1 3.48Å; R192-I236 HydrophobicContact CG-CB 4.14Å; R192-I236 HydrophobicContact CG-CD1 4.01Å; R192-I236 HydrophobicContact CG-CG1 4.18Å; I236-A248 CarbonylContact O-C 3.52Å; I236-A248 WeakPolarHBondContact O-CA 3.3Å; I236-A248 WeakPolarHBondContact O-CB 3.45Å; I236-G249 PolarHBondContact N-O 3.21Å; I236-G249 PolarHBondContact O-N 2.87Å; I236-I277 HydrophobicContact CG2-CG2 4.05Å; I236-L280 HydrophobicContact CD1-CB 3.87Å; I236-L280 HydrophobicContact CG1-CB 3.89Å; I236-L280 HydrophobicContact CG2-CB 3.86Å; I236-L280 HydrophobicContact CG2-CD2 4.38Å
237	C	96.2	Very high	91.2	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.034	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	152.7	169.7	66.3	0	0	0	0	111.4	R192 C194 L204 P206 I211 S247 A248	R192-C237 PolarHBondContact O-N 3.31Å; R192-C237 PolarHBondContact O-SG 2.75Å; C194-C237 WeakPolarHBondContact CB-O 3.18Å; L204-C237 HydrophobicContact CB-CB 4.48Å; L204-C237 VanDerWaalsContact CB-SG 3.54Å; P206-C237 HydrophobicContact CG-CB 4.12Å; I211-C237 HydrophobicContact CD1-CB 4.2Å; I211-C237 HydrophobicContact CG2-CB 4.4Å; C237-S247 CarbonylContact C-O 3.57Å; C237-S247 WeakPolarHBondContact CA-O 3.49Å; C237-A248 HydrophobicContact CB-CB 4.36Å
238	A	94.4	Very high	91.5	Very high	9 Å²	9	33.9 Å²	33.9	7%	0.074	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	138.5	176.8	0	0	0	0	0	111.1	S247 L280 W282	A238-S247 PolarHBondContact N-O 2.77Å; A238-S247 PolarHBondContact O-N 3.38Å; A238-S247 PolarHBondContact O-OG 2.68Å; A238-L280 HydrophobicContact CB-CG 4.48Å; A238-W282 PolarHBondContact O-NE1 3.38Å; A238-W282 VanDerWaalsContact O-NE1 3.16Å
239	S	93.4	Very high	91.9	Very high	7 Å²	7	28 Å²	28	5%	0.049	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	139.8	175.7	178.4	0	0	0	0	111.1	S197 W282	S197-S239 PolarHBondContact N-OG 2.79Å; S197-S239 WeakPolarHBondContact OG-CB 3.41Å; S197-S239 PolarHBondContact OG-O 3.44Å; S197-S239 VanDerWaalsContact OG-O 3.08Å; S197-S239 PolarHBondContact OG-OG 2.62Å; S239-W282 VanDerWaalsContact C-CD1 3.44Å; S239-W282 VanDerWaalsContact O-CD1 3.28Å
240	S	91	Very high	92.4	Very high	5 Å²	5	26 Å²	26	4%	0.035	14%	0.137	C	C	.	.			trans	-63.8	158.2	168.7	62.6	0	0	0	0	110.8	S197 D242 G243 N244 L245	S197-S240 WeakPolarHBondContact CB-O 3.04Å; S197-S240 PolarHBondContact OG-O 3.05Å; S240-D242 VanDerWaalsContact C-N 3.27Å; S240-D242 VanDerWaalsContact CB-OD1 3.29Å; S240-D242 WeakPolarHBondContact CB-OD1 3.17Å; S240-D242 PolarHBondContact O-N 3.38Å; S240-D242 PolarHBondContact OG-OD1 2.88Å; S240-G243 PolarHBondContact O-N 3.41Å; S240-N244 PolarHBondContact OG-N 3.38Å; S240-L245 PolarHBondContact N-O 3.47Å; S240-L245 PolarHBondContact OG-N 2.78Å; S240-L245 PolarHBondContact OG-O 3.26Å
241	R	85.8	Confident	92.5	Very high	168 Å²	168	26.8 Å²	26.8	63%	0.634	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.2	-176.2	-175.9	172.9	-179.9	-146.3	0.2	113.8	T198 G243 P284	T198-R241 WeakPolarHBondContact CG2-O 3.26Å; R241-G243 VanDerWaalsContact C-N 3.28Å; R241-P284 WeakPolarHBondContact CD-O 3.48Å; R241-P284 PolarHBondContact NH1-O 3.24Å; R241-P284 VanDerWaalsContact NH1-O 3.07Å
242	D	84.6	Confident	92.7	Very high	62 Å²	62	24.5 Å²	24.5	33%	0.332	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-6.9	176.2	63.3	-12.7	0	0	0	113.3	S240 N244	S240-D242 VanDerWaalsContact C-N 3.27Å; S240-D242 VanDerWaalsContact CB-OD1 3.29Å; S240-D242 WeakPolarHBondContact CB-OD1 3.17Å; S240-D242 PolarHBondContact O-N 3.38Å; S240-D242 PolarHBondContact OG-OD1 2.88Å; D242-N244 VanDerWaalsContact CG-ND2 3.3Å; D242-N244 PolarHBondContact O-N 2.94Å; D242-N244 PolarHBondContact OD1-N 3.12Å; D242-N244 PolarHBondContact OD2-ND2 3.28Å
243	G	85	Confident	92.7	Very high	7 Å²	7	19.8 Å²	19.8	7%	0.072	10%	0.098	C	C	.	.	S	Bend	trans	72.8	5.9	-179.1	0	0	0	0	0	114.5	E196 S240 R241 V260	E196-G243 WeakPolarHBondContact OE1-CA 3.34Å; S240-G243 PolarHBondContact O-N 3.41Å; R241-G243 VanDerWaalsContact C-N 3.28Å; G243-V260 WeakPolarHBondContact O-CG2 3.32Å
244	N	86.8	Confident	92.7	Very high	74 Å²	74	21.7 Å²	21.7	40%	0.396	10%	0.104	S	C	.	.	S	Bend	trans	-88.5	-22.2	-174.9	-67.1	-34.4	0	0	0	113.5	S240 D242 V260	S240-N244 PolarHBondContact OG-N 3.38Å; D242-N244 VanDerWaalsContact CG-ND2 3.3Å; D242-N244 PolarHBondContact O-N 2.94Å; D242-N244 PolarHBondContact OD1-N 3.12Å; D242-N244 PolarHBondContact OD2-ND2 3.28Å; N244-V260 WeakPolarHBondContact O-CG2 3.08Å; N244-V260 PolarHBondContact O-N 3.45Å
245	L	90.6	Very high	92.6	Very high	19 Å²	19	21.7 Å²	21.7	10%	0.099	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.4	-178.8	-56.8	176.1	0	0	0	110.5	S240 V257 W258 I266 W282	S240-L245 PolarHBondContact N-O 3.47Å; S240-L245 PolarHBondContact OG-N 2.78Å; S240-L245 PolarHBondContact OG-O 3.26Å; L245-V257 HydrophobicContact CB-CG1 4.13Å; L245-V257 HydrophobicContact CD2-CG1 4.42Å; L245-W258 WeakPolarHBondContact CA-O 3.47Å; L245-I266 HydrophobicContact CD2-CD1 3.53Å; L245-W282 HydrophobicContact CB-CH2 4.18Å; L245-W282 HydrophobicContact CB-CZ2 4.1Å; L245-W282 HydrophobicContact CD1-CH2 3.95Å; L245-W282 HydrophobicContact CD1-CZ3 4.42Å
246	I	92.8	Very high	92.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.7	171.3	-67.7	166.4	0	0	0	107.3	F202 L204 M213 L225 V257 W258 V260	F202-I246 HydrophobicContact CE2-CD1 4.05Å; F202-I246 HydrophobicContact CZ-CD1 4.45Å; L204-I246 HydrophobicContact CD1-CB 4.43Å; L204-I246 HydrophobicContact CD1-CD1 4.08Å; L204-I246 HydrophobicContact CD1-CG1 3.86Å; L204-I246 HydrophobicContact CD1-CG2 3.79Å; L204-I246 HydrophobicContact CD2-CD1 3.7Å; L204-I246 HydrophobicContact CD2-CG1 4.42Å; M213-I246 HydrophobicContact CE-CD1 3.87Å; M213-I246 HydrophobicContact SD-CD1 4.09Å; L225-I246 HydrophobicContact CD1-CB 4.38Å; L225-I246 HydrophobicContact CD1-CD1 3.78Å; L225-I246 HydrophobicContact CD1-CG2 4.16Å; I246-V257 CarbonylContact O-C 3.56Å; I246-V257 WeakPolarHBondContact O-CA 3.32Å; I246-W258 HydrophobicContact CG2-CE3 4.26Å; I246-W258 PolarHBondContact N-O 2.7Å; I246-W258 PolarHBondContact O-N 3.31Å; I246-V260 HydrophobicContact CD1-CG2 3.58Å; I246-V260 HydrophobicContact CG1-CG2 3.62Å
247	S	94.4	Very high	92.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	148.7	171.6	62.4	0	0	0	0	110.8	C237 A238 I256 L280 W282	C237-S247 CarbonylContact C-O 3.57Å; C237-S247 WeakPolarHBondContact CA-O 3.49Å; A238-S247 PolarHBondContact N-O 2.77Å; A238-S247 PolarHBondContact O-N 3.38Å; A238-S247 PolarHBondContact O-OG 2.68Å; S247-I256 CarbonylContact C-O 3.47Å; S247-I256 VanDerWaalsContact CA-O 3.23Å; S247-I256 WeakPolarHBondContact CA-O 3.32Å; S247-L280 WeakPolarHBondContact OG-CD2 3.12Å; S247-W282 PolarHBondContact OG-NE1 3.29Å
248	A	96.6	Very high	92.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	147.2	169.4	0	0	0	0	0	111.8	I211 Y234 I236 C237 I255 I256 W258	I211-A248 HydrophobicContact CD1-CB 3.78Å; I211-A248 HydrophobicContact CG1-CB 3.82Å; Y234-A248 HydrophobicContact CD1-CB 3.59Å; Y234-A248 HydrophobicContact CE1-CB 3.89Å; Y234-A248 HydrophobicContact CG-CB 4.21Å; I236-A248 CarbonylContact O-C 3.52Å; I236-A248 WeakPolarHBondContact O-CA 3.3Å; I236-A248 WeakPolarHBondContact O-CB 3.45Å; C237-A248 HydrophobicContact CB-CB 4.36Å; A248-I255 CarbonylContact O-C 3.48Å; A248-I255 VanDerWaalsContact O-CA 3.28Å; A248-I255 WeakPolarHBondContact O-CA 3.42Å; A248-I256 PolarHBondContact N-O 2.83Å; A248-I256 PolarHBondContact O-N 3.39Å; A248-W258 HydrophobicContact CB-CH2 3.86Å; A248-W258 HydrophobicContact CB-CZ3 3.54Å
249	G	96	Very high	91.9	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.9	175.7	0	0	0	0	0	110.9	N235 I236 W254	N235-G249 PolarHBondContact N-O 3.34Å; I236-G249 PolarHBondContact N-O 3.21Å; I236-G249 PolarHBondContact O-N 2.87Å; G249-W254 CarbonylContact C-O 3.59Å; G249-W254 VanDerWaalsContact CA-O 3.27Å; G249-W254 WeakPolarHBondContact CA-O 3.38Å
250	S	97	Very high	91.6	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	171.9	-178.7	73.8	0	0	0	0	113.7	A233 D252 G253 W254 I277	A233-S250 WeakPolarHBondContact O-CA 3.41Å; S250-D252 VanDerWaalsContact CB-OD1 3.23Å; S250-D252 WeakPolarHBondContact CB-OD1 3.29Å; S250-D252 PolarHBondContact OG-OD1 3.08Å; S250-G253 PolarHBondContact OG-N 3.07Å; S250-W254 PolarHBondContact N-O 3.26Å; S250-W254 WeakPolarHBondContact OG-CA 3.32Å; S250-W254 VanDerWaalsContact OG-CB 3.31Å; S250-W254 WeakPolarHBondContact OG-CB 3.5Å; S250-W254 PolarHBondContact OG-N 2.97Å; S250-W254 PolarHBondContact OG-O 3.14Å; S250-I277 PolarHBondContact O-N 2.99Å
251	L	94.2	Very high	91.2	Very high	25 Å²	25	30.9 Å²	30.9	13%	0.131	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-29	174.5	-60.9	179	0	0	0	113.5	P188 Q232 A233 N235 G253 R276	P188-L251 WeakPolarHBondContact O-CD1 3.08Å; Q232-L251 HydrophobicContact CB-CB 3.91Å; Q232-L251 HydrophobicContact CB-CD1 4.42Å; A233-L251 HydrophobicContact CB-CD1 4.03Å; A233-L251 HydrophobicContact CB-CG 4.44Å; A233-L251 WeakPolarHBondContact O-CG 3.36Å; A233-L251 PolarHBondContact O-N 3.46Å; N235-L251 HydrophobicContact CB-CD2 4.06Å; L251-G253 VanDerWaalsContact C-N 3.31Å; L251-R276 HydrophobicContact CD2-CG 3.77Å; L251-R276 WeakPolarHBondContact O-CA 3.21Å; L251-R276 PolarHBondContact O-N 3.32Å
252	D	92.7	Very high	91	Very high	12 Å²	12	27 Å²	27	6%	0.064	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	16.9	179.6	60.9	-22.1	0	0	0	113.6	A231 Q232 S250 W254 R270	A231-D252 PolarHBondContact N-OD2 3.21Å; A231-D252 VanDerWaalsContact N-OD2 3.15Å; Q232-D252 HydrophobicContact CB-CB 4.13Å; Q232-D252 HydrophobicContact CG-CB 3.99Å; S250-D252 VanDerWaalsContact CB-OD1 3.23Å; S250-D252 WeakPolarHBondContact CB-OD1 3.29Å; S250-D252 PolarHBondContact OG-OD1 3.08Å; D252-W254 VanDerWaalsContact OD2-CD1 3.29Å; D252-R270 PolarHBondContact O-NE 3.07Å; D252-R270 VanDerWaalsContact O-NE 3.13Å; D252-R270 PolarHBondContact O-NH2 3.31Å
253	G	91.8	Very high	91	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	83.5	11.5	171.2	0	0	0	0	0	115.8	S250 L251 R270 D271 S275	S250-G253 PolarHBondContact OG-N 3.07Å; L251-G253 VanDerWaalsContact C-N 3.31Å; G253-R270 WeakPolarHBondContact O-CA 3.19Å; G253-D271 PolarHBondContact O-N 3.3Å; G253-S275 WeakPolarHBondContact CA-O 3.48Å; G253-S275 PolarHBondContact N-O 3.27Å
254	W	94.8	Very high	90.9	Very high	48 Å²	48	35.5 Å²	35.5	18%	0.182	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	140.5	173.6	-70.7	102.7	0	0	0	111.6	S229 V230 G249 S250 D252 I256 R268 I269 R270	S229-W254 PolarHBondContact O-NE1 3.05Å; V230-W254 HydrophobicContact CG2-CB 3.75Å; V230-W254 HydrophobicContact CG2-CG 3.85Å; G249-W254 CarbonylContact C-O 3.59Å; G249-W254 VanDerWaalsContact CA-O 3.27Å; G249-W254 WeakPolarHBondContact CA-O 3.38Å; S250-W254 PolarHBondContact N-O 3.26Å; S250-W254 WeakPolarHBondContact OG-CA 3.32Å; S250-W254 VanDerWaalsContact OG-CB 3.31Å; S250-W254 WeakPolarHBondContact OG-CB 3.5Å; S250-W254 PolarHBondContact OG-N 2.97Å; S250-W254 PolarHBondContact OG-O 3.14Å; D252-W254 VanDerWaalsContact OD2-CD1 3.29Å; W254-I256 HydrophobicContact CB-CD1 4.12Å; W254-I256 HydrophobicContact CB-CG1 4.38Å; W254-I256 HydrophobicContact CD2-CD1 4.49Å; W254-I256 HydrophobicContact CE3-CD1 4.01Å; W254-R268 HydrophobicContact CE3-CB 4.43Å; W254-R268 HydrophobicContact CZ3-CB 4.07Å; W254-I269 CarbonylContact C-O 3.48Å; W254-I269 WeakPolarHBondContact CA-O 3.15Å; W254-I269 VanDerWaalsContact CE3-O 3.31Å; W254-R270 HydrophobicContact CD2-CB 4Å; W254-R270 HydrophobicContact CD2-CG 3.85Å; W254-R270 HydrophobicContact CE3-CB 3.78Å; W254-R270 HydrophobicContact CE3-CG 4.17Å; W254-R270 HydrophobicContact CG-CG 4.2Å; W254-R270 HydrophobicContact CH2-CB 4.18Å; W254-R270 HydrophobicContact CZ2-CB 4.41Å; W254-R270 HydrophobicContact CZ2-CG 4.36Å; W254-R270 HydrophobicContact CZ3-CB 3.87Å
255	I	94.5	Very high	90.8	Very high	1 Å²	1	33 Å²	33	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	112.3	167.9	-57.7	170.2	0	0	0	106.3	A248 I269 I277 L280 L289 F291	A248-I255 CarbonylContact O-C 3.48Å; A248-I255 VanDerWaalsContact O-CA 3.28Å; A248-I255 WeakPolarHBondContact O-CA 3.42Å; I255-I269 HydrophobicContact CB-CB 4.43Å; I255-I269 PolarHBondContact N-O 2.84Å; I255-I269 PolarHBondContact O-N 2.94Å; I255-I277 HydrophobicContact CD1-CD1 4.26Å; I255-I277 HydrophobicContact CG1-CD1 4.18Å; I255-I277 HydrophobicContact CG1-CG1 4.08Å; I255-L280 HydrophobicContact CG2-CD1 4.22Å; I255-L289 HydrophobicContact CG2-CD2 3.75Å; I255-F291 HydrophobicContact CD1-CB 3.73Å; I255-F291 HydrophobicContact CD1-CD1 3.64Å; I255-F291 HydrophobicContact CD1-CD2 3.74Å; I255-F291 HydrophobicContact CD1-CE1 4.14Å; I255-F291 HydrophobicContact CD1-CE2 4.23Å; I255-F291 HydrophobicContact CD1-CG 3.41Å; I255-F291 VanDerWaalsContact CD1-CG 3.41Å; I255-F291 HydrophobicContact CD1-CZ 4.4Å
256	I	93.8	Very high	90.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.9	-178	-50.1	-58.6	0	0	0	108.8	C227 V230 Y234 S247 A248 W254 W258 P265 H267 R268	C227-I256 HydrophobicContact CB-CD1 4.48Å; C227-I256 HydrophobicContact CB-CG1 4.26Å; C227-I256 HydrophobicContact CB-CG2 4.19Å; V230-I256 HydrophobicContact CG2-CD1 3.9Å; V230-I256 HydrophobicContact CG2-CG1 3.71Å; Y234-I256 HydrophobicContact CE1-CG1 4.14Å; S247-I256 CarbonylContact C-O 3.47Å; S247-I256 VanDerWaalsContact CA-O 3.23Å; S247-I256 WeakPolarHBondContact CA-O 3.32Å; A248-I256 PolarHBondContact N-O 2.83Å; A248-I256 PolarHBondContact O-N 3.39Å; W254-I256 HydrophobicContact CB-CD1 4.12Å; W254-I256 HydrophobicContact CB-CG1 4.38Å; W254-I256 HydrophobicContact CD2-CD1 4.49Å; W254-I256 HydrophobicContact CE3-CD1 4.01Å; I256-W258 HydrophobicContact CB-CE3 4.31Å; I256-W258 HydrophobicContact CB-CH2 3.43Å; I256-W258 VanDerWaalsContact CB-CH2 3.43Å; I256-W258 HydrophobicContact CB-CZ2 3.82Å; I256-W258 HydrophobicContact CB-CZ3 3.69Å; I256-W258 HydrophobicContact CG1-CH2 4.24Å; I256-W258 HydrophobicContact CG2-CD2 3.85Å; I256-W258 HydrophobicContact CG2-CE3 3.96Å; I256-W258 HydrophobicContact CG2-CH2 3.48Å; I256-W258 VanDerWaalsContact CG2-CH2 3.48Å; I256-W258 HydrophobicContact CG2-CZ2 3.33Å; I256-W258 HydrophobicContact CG2-CZ3 3.78Å; I256-W258 WeakPolarHBondContact O-CZ3 3.13Å; I256-P265 HydrophobicContact CG2-CB 3.76Å; I256-H267 WeakPolarHBondContact CA-O 3.49Å; I256-R268 HydrophobicContact CD1-CB 3.86Å; I256-R268 HydrophobicContact CD1-CG 4.02Å
257	V	93.1	Very high	90.2	Very high	1 Å²	1	36 Å²	36	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.1	174.8	-178.4	0	0	0	0	110.3	M1 L245 I246 P265 I266 H267 W282 L289	M1-V257 HydrophobicContact CE-CB 3.96Å; M1-V257 HydrophobicContact CE-CG1 4.11Å; M1-V257 HydrophobicContact CE-CG2 3.57Å; M1-V257 HydrophobicContact SD-CG2 4.16Å; L245-V257 HydrophobicContact CB-CG1 4.13Å; L245-V257 HydrophobicContact CD2-CG1 4.42Å; I246-V257 CarbonylContact O-C 3.56Å; I246-V257 WeakPolarHBondContact O-CA 3.32Å; V257-P265 CarbonylContact O-C 3.5Å; V257-I266 PolarHBondContact O-N 3.2Å; V257-H267 HydrophobicContact CB-CB 4.29Å; V257-H267 PolarHBondContact N-O 3.37Å; V257-H267 PolarHBondContact O-N 3.14Å; V257-W282 HydrophobicContact CG1-CH2 4.09Å; V257-W282 HydrophobicContact CG1-CZ2 4.15Å; V257-W282 HydrophobicContact CG2-CH2 4.47Å; V257-W282 HydrophobicContact CG2-CZ2 4.43Å; V257-L289 HydrophobicContact CG2-CD2 4.3Å
258	W	92.1	Very high	89.9	Confident	1 Å²	1	42 Å²	42	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	152.8	177.4	-61.6	-101.9	0	0	0	111	I211 L225 S226 C227 Y234 L245 I246 A248 I256 Q264 P265	I211-W258 HydrophobicContact CG1-CH2 4.34Å; L225-W258 HydrophobicContact CB-CD2 4.26Å; L225-W258 HydrophobicContact CB-CG 4.46Å; L225-W258 HydrophobicContact CB-CZ2 4.32Å; L225-W258 HydrophobicContact CD1-CB 4.27Å; L225-W258 HydrophobicContact CD1-CD2 4.24Å; L225-W258 HydrophobicContact CD1-CE3 4.48Å; L225-W258 HydrophobicContact CD1-CG 4.15Å; S226-W258 PolarHBondContact O-NE1 3.3Å; C227-W258 HydrophobicContact CB-CZ2 4.27Å; Y234-W258 AromaticContact CE1-CH2 3.92Å; Y234-W258 HydrophobicContact CE1-CH2 3.92Å; Y234-W258 HydrophobicContact CE2-CH2 4.31Å; Y234-W258 AromaticContact CZ-CH2 3.65Å; Y234-W258 WeakPolarHBondContact OH-CH2 3.44Å; Y234-W258 WeakPolarHBondContact OH-CZ2 3.43Å; L245-W258 WeakPolarHBondContact CA-O 3.47Å; I246-W258 HydrophobicContact CG2-CE3 4.26Å; I246-W258 PolarHBondContact N-O 2.7Å; I246-W258 PolarHBondContact O-N 3.31Å; A248-W258 HydrophobicContact CB-CH2 3.86Å; A248-W258 HydrophobicContact CB-CZ3 3.54Å; I256-W258 HydrophobicContact CB-CE3 4.31Å; I256-W258 HydrophobicContact CB-CH2 3.43Å; I256-W258 VanDerWaalsContact CB-CH2 3.43Å; I256-W258 HydrophobicContact CB-CZ2 3.82Å; I256-W258 HydrophobicContact CB-CZ3 3.69Å; I256-W258 HydrophobicContact CG1-CH2 4.24Å; I256-W258 HydrophobicContact CG2-CD2 3.85Å; I256-W258 HydrophobicContact CG2-CE3 3.96Å; I256-W258 HydrophobicContact CG2-CH2 3.48Å; I256-W258 VanDerWaalsContact CG2-CH2 3.48Å; I256-W258 HydrophobicContact CG2-CZ2 3.33Å; I256-W258 HydrophobicContact CG2-CZ3 3.78Å; I256-W258 WeakPolarHBondContact O-CZ3 3.13Å; W258-Q264 WeakPolarHBondContact CA-O 3.21Å; W258-Q264 VanDerWaalsContact CD1-C 3.49Å; W258-P265 VanDerWaalsContact CD1-N 3.32Å
259	R	89	Confident	89.5	Confident	54 Å²	54	42.7 Å²	42.7	20%	0.204	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	134.2	161.6	-161.6	167	-68.8	141.2	-9	108.7	E261 D262 R263 Q264 I266	R259-E261 VanDerWaalsContact C-N 3.33Å; R259-E261 HydrophobicContact CG-CB 4.44Å; R259-E261 PolarHBondContact O-N 3.35Å; R259-D262 HydrophobicContact CB-CB 4.24Å; R259-D262 WeakPolarHBondContact CD-OD2 3.37Å; R259-D262 IonicContact CZ-OD2 3.67Å; R259-D262 IonicContact NE-OD2 3.86Å; R259-D262 IonicContact NH1-OD2 2.73Å; R259-D262 PolarHBondContact NH1-OD2 3.25Å; R259-R263 VanDerWaalsContact O-CA 3.29Å; R259-R263 WeakPolarHBondContact O-CA 3.23Å; R259-R263 PolarHBondContact O-N 2.67Å; R259-Q264 PolarHBondContact N-O 3.46Å; R259-I266 HydrophobicContact CB-CD1 3.66Å; R259-I266 HydrophobicContact CB-CG1 4.05Å; R259-I266 HydrophobicContact CG-CD1 4.4Å
260	V	86.3	Confident	89.2	Confident	26 Å²	26	47 Å²	47	16%	0.158	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-39.5	178.6	176.4	0	0	0	0	111.9	F202 G243 N244 I246	F202-V260 HydrophobicContact CE1-CG1 3.9Å; F202-V260 HydrophobicContact CZ-CG1 3.66Å; F202-V260 HydrophobicContact CZ-CG2 4.21Å; G243-V260 WeakPolarHBondContact O-CG2 3.32Å; N244-V260 WeakPolarHBondContact O-CG2 3.08Å; N244-V260 PolarHBondContact O-N 3.45Å; I246-V260 HydrophobicContact CD1-CG2 3.58Å; I246-V260 HydrophobicContact CG1-CG2 3.62Å
261	E	83.9	Confident	88.9	Confident	150 Å²	150	47 Å²	47	70%	0.701	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-53.6	-179.8	-64.6	-178.2	161.6	0	0	112.1	R259	R259-E261 VanDerWaalsContact C-N 3.33Å; R259-E261 HydrophobicContact CG-CB 4.44Å; R259-E261 PolarHBondContact O-N 3.35Å
262	D	82	Confident	88.5	Confident	86 Å²	86	49.8 Å²	49.8	46%	0.46	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-19.7	-174.3	-56.7	-30.1	0	0	0	112.9	R259 Q264	R259-D262 HydrophobicContact CB-CB 4.24Å; R259-D262 WeakPolarHBondContact CD-OD2 3.37Å; R259-D262 IonicContact CZ-OD2 3.67Å; R259-D262 IonicContact NE-OD2 3.86Å; R259-D262 IonicContact NH1-OD2 2.73Å; R259-D262 PolarHBondContact NH1-OD2 3.25Å; D262-Q264 HydrophobicContact CB-CB 4.45Å; D262-Q264 PolarHBondContact O-N 3.14Å
263	R	84.7	Confident	88.2	Confident	121 Å²	121	51.8 Å²	51.8	46%	0.457	24%	0.244	S	C	.	.			trans	55.9	15.7	-173.5	-51.4	179	-156.2	-95.4	-2.4	114.6	C223 L225 R259	C223-R263 PolarHBondContact SG-NH1 3.11Å; L225-R263 HydrophobicContact CD2-CB 3.84Å; L225-R263 HydrophobicContact CD2-CG 4.3Å; R259-R263 VanDerWaalsContact O-CA 3.29Å; R259-R263 WeakPolarHBondContact O-CA 3.23Å; R259-R263 PolarHBondContact O-N 2.67Å
264	Q	82.1	Confident	88.1	Confident	128 Å²	128	56.2 Å²	56.2	60%	0.598	27%	0.265	S	S	*	.	S	Bend	trans	-98.1	143.2	178.5	-67.8	-61.2	-25.7	0	0	111.3	W258 R259 D262 I266	W258-Q264 WeakPolarHBondContact CA-O 3.21Å; W258-Q264 VanDerWaalsContact CD1-C 3.49Å; R259-Q264 PolarHBondContact N-O 3.46Å; D262-Q264 HydrophobicContact CB-CB 4.45Å; D262-Q264 PolarHBondContact O-N 3.14Å; Q264-I266 PolarHBondContact O-N 2.61Å; Q264-I266 VanDerWaalsContact O-N 3.14Å
265	P	85.5	Confident	87.9	Confident	21 Å²	21	54.6 Å²	54.6	14%	0.136	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	109.7	175.4	27.9	-31.9	0	0	0	109.5	I256 V257 W258	I256-P265 HydrophobicContact CG2-CB 3.76Å; V257-P265 CarbonylContact O-C 3.5Å; W258-P265 VanDerWaalsContact CD1-N 3.32Å
266	I	85	Confident	87.9	Confident	46 Å²	46	57.4 Å²	57.4	24%	0.236	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	-41	177.2	-45.6	176.6	0	0	0	110.2	L245 V257 R259 Q264	L245-I266 HydrophobicContact CD2-CD1 3.53Å; V257-I266 PolarHBondContact O-N 3.2Å; R259-I266 HydrophobicContact CB-CD1 3.66Å; R259-I266 HydrophobicContact CB-CG1 4.05Å; R259-I266 HydrophobicContact CG-CD1 4.4Å; Q264-I266 PolarHBondContact O-N 2.61Å; Q264-I266 VanDerWaalsContact O-N 3.14Å
267	H	84.7	Confident	88	Confident	36 Å²	36	57.4 Å²	57.4	17%	0.167	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.8	-175.7	-62.9	-47.4	0	0	0	111.1	M1 I256 V257	M1-H267 HydrophobicContact CB-CB 4.49Å; M1-H267 HydrophobicContact CE-CB 4.2Å; M1-H267 WeakPolarHBondContact CE-CD2 3.33Å; M1-H267 HydrophobicContact CG-CB 4.19Å; M1-H267 VanDerWaalsContact CG-CD2 3.48Å; M1-H267 WeakPolarHBondContact CG-CD2 3.48Å; M1-H267 PolarHBondContact N-CE1 3.1Å; M1-H267 VanDerWaalsContact N-CE1 3.33Å; M1-H267 PolarHBondContact N-ND1 3.22Å; M1-H267 HydrophobicContact SD-CB 3.5Å; M1-H267 VanDerWaalsContact SD-CB 3.5Å; M1-H267 VanDerWaalsContact SD-CD2 3.52Å; I256-H267 WeakPolarHBondContact CA-O 3.49Å; V257-H267 HydrophobicContact CB-CB 4.29Å; V257-H267 PolarHBondContact N-O 3.37Å; V257-H267 PolarHBondContact O-N 3.14Å
268	R	88.7	Confident	88	Confident	125 Å²	125	57.6 Å²	57.6	47%	0.472	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	113.5	177	-50	-178.4	-170.1	177.4	5.1	107.2	C227 S229 W254 I256	C227-R268 VanDerWaalsContact SG-CD 3.6Å; C227-R268 PolarHBondContact SG-NE 2.68Å; S229-R268 PolarHBondContact OG-NH1 3.33Å; S229-R268 VanDerWaalsContact OG-NH1 3.17Å; W254-R268 HydrophobicContact CE3-CB 4.43Å; W254-R268 HydrophobicContact CZ3-CB 4.07Å; I256-R268 HydrophobicContact CD1-CB 3.86Å; I256-R268 HydrophobicContact CD1-CG 4.02Å
269	I	88.4	Confident	88.2	Confident	16 Å²	16	58.1 Å²	58.1	8%	0.082	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	140.2	-177.9	-61.5	166.2	0	0	0	107.1	M1 I3 W254 I255 V301	M1-I269 HydrophobicContact CB-CD1 3.62Å; M1-I269 HydrophobicContact CB-CG1 4.43Å; M1-I269 HydrophobicContact CG-CD1 4.1Å; M1-I269 HydrophobicContact SD-CD1 3.43Å; M1-I269 WeakPolarHBondContact SD-CD1 3.38Å; I3-I269 HydrophobicContact CD1-CG2 4.09Å; I3-I269 HydrophobicContact CG1-CG2 3.87Å; W254-I269 CarbonylContact C-O 3.48Å; W254-I269 WeakPolarHBondContact CA-O 3.15Å; W254-I269 VanDerWaalsContact CE3-O 3.31Å; I255-I269 HydrophobicContact CB-CB 4.43Å; I255-I269 PolarHBondContact N-O 2.84Å; I255-I269 PolarHBondContact O-N 2.94Å; I269-V301 HydrophobicContact CD1-CB 4.24Å; I269-V301 HydrophobicContact CD1-CG1 3.2Å; I269-V301 HydrophobicContact CD1-CG2 3.99Å
270	R	89.5	Confident	88.4	Confident	90 Å²	90	55.9 Å²	55.9	34%	0.34	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128	173.1	-155.3	175	-177.6	-144.7	-5.9	109.2	D252 G253 W254 H274	D252-R270 PolarHBondContact O-NE 3.07Å; D252-R270 VanDerWaalsContact O-NE 3.13Å; D252-R270 PolarHBondContact O-NH2 3.31Å; G253-R270 WeakPolarHBondContact O-CA 3.19Å; W254-R270 HydrophobicContact CD2-CB 4Å; W254-R270 HydrophobicContact CD2-CG 3.85Å; W254-R270 HydrophobicContact CE3-CB 3.78Å; W254-R270 HydrophobicContact CE3-CG 4.17Å; W254-R270 HydrophobicContact CG-CG 4.2Å; W254-R270 HydrophobicContact CH2-CB 4.18Å; W254-R270 HydrophobicContact CZ2-CB 4.41Å; W254-R270 HydrophobicContact CZ2-CG 4.36Å; W254-R270 HydrophobicContact CZ3-CB 3.87Å; R270-H274 VanDerWaalsContact CD-ND1 3.32Å; R270-H274 WeakPolarHBondContact CD-ND1 3.42Å; R270-H274 VanDerWaalsContact CZ-CE1 3.45Å; R270-H274 VanDerWaalsContact CZ-CG 3.45Å; R270-H274 PolarHBondContact NE-ND1 3.03Å; R270-H274 PolarHBondContact NH1-CE1 2.73Å; R270-H274 PolarHBondContact NH1-ND1 2.54Å; R270-H274 VanDerWaalsContact NH1-ND1 3.17Å; R270-H274 PolarHBondContact NH1-NE2 3.4Å
271	D	89.3	Confident	88.7	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	28%	0.279	C	S	.	.			trans	-55.7	129	168.2	177.7	67.3	0	0	0	109	P7 G253 S273 H274 I277 F291 N293	P7-D271 WeakPolarHBondContact CG-OD1 3.44Å; G253-D271 PolarHBondContact O-N 3.3Å; D271-S273 PolarHBondContact O-N 3.32Å; D271-S273 VanDerWaalsContact O-N 3.14Å; D271-S273 WeakPolarHBondContact OD2-CA 3.46Å; D271-S273 VanDerWaalsContact OD2-CB 3.29Å; D271-S273 WeakPolarHBondContact OD2-CB 3.24Å; D271-S273 PolarHBondContact OD2-N 3.36Å; D271-S273 VanDerWaalsContact OD2-N 3.07Å; D271-S273 PolarHBondContact OD2-OG 2.76Å; D271-H274 PolarHBondContact O-N 2.98Å; D271-H274 PolarHBondContact O-ND1 3.15Å; D271-H274 VanDerWaalsContact O-ND1 3.13Å; D271-I277 HydrophobicContact CB-CD1 4.18Å; D271-F291 HydrophobicContact CB-CE2 4.47Å; D271-N293 PolarHBondContact OD2-ND2 3.04Å
272	P	87.4	Confident	89.1	Confident	83 Å²	83	52.4 Å²	52.4	54%	0.539	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.1	-178.3	-26.8	34.5	0	0	0	114.4	I3 H274	I3-P272 HydrophobicContact CD1-CG 4.41Å; P272-H274 VanDerWaalsContact C-N 3.27Å
273	S	86.5	Confident	89.4	Confident	53 Å²	53	49.2 Å²	49.2	37%	0.371	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-6.2	176.8	82.2	0	0	0	0	113.3	D271 S275 N293 N295	D271-S273 PolarHBondContact O-N 3.32Å; D271-S273 VanDerWaalsContact O-N 3.14Å; D271-S273 WeakPolarHBondContact OD2-CA 3.46Å; D271-S273 VanDerWaalsContact OD2-CB 3.29Å; D271-S273 WeakPolarHBondContact OD2-CB 3.24Å; D271-S273 PolarHBondContact OD2-N 3.36Å; D271-S273 VanDerWaalsContact OD2-N 3.07Å; D271-S273 PolarHBondContact OD2-OG 2.76Å; S273-S275 PolarHBondContact O-N 2.64Å; S273-S275 VanDerWaalsContact O-N 3.09Å; S273-S275 VanDerWaalsContact OG-CB 3.22Å; S273-S275 WeakPolarHBondContact OG-CB 3.46Å; S273-N293 PolarHBondContact OG-ND2 3.42Å; S273-N295 WeakPolarHBondContact CB-ND2 3.44Å; S273-N295 PolarHBondContact OG-ND2 3.44Å
274	H	88.7	Confident	89.3	Confident	94 Å²	94	44.8 Å²	44.8	44%	0.435	22%	0.217	S	C	.	.			trans	53.2	28.2	-178.2	-56.7	-43.5	0	0	0	113.2	R270 D271 P272	R270-H274 VanDerWaalsContact CD-ND1 3.32Å; R270-H274 WeakPolarHBondContact CD-ND1 3.42Å; R270-H274 VanDerWaalsContact CZ-CE1 3.45Å; R270-H274 VanDerWaalsContact CZ-CG 3.45Å; R270-H274 PolarHBondContact NE-ND1 3.03Å; R270-H274 PolarHBondContact NH1-CE1 2.73Å; R270-H274 PolarHBondContact NH1-ND1 2.54Å; R270-H274 VanDerWaalsContact NH1-ND1 3.17Å; R270-H274 PolarHBondContact NH1-NE2 3.4Å; D271-H274 PolarHBondContact O-N 2.98Å; D271-H274 PolarHBondContact O-ND1 3.15Å; D271-H274 VanDerWaalsContact O-ND1 3.13Å; P272-H274 VanDerWaalsContact C-N 3.27Å
275	S	91.2	Very high	89.2	Confident	13 Å²	13	44.3 Å²	44.3	9%	0.091	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-95.3	155	-174.5	-170.3	0	0	0	0	111.2	G253 S273 I277 N295	G253-S275 WeakPolarHBondContact CA-O 3.48Å; G253-S275 PolarHBondContact N-O 3.27Å; S273-S275 PolarHBondContact O-N 2.64Å; S273-S275 VanDerWaalsContact O-N 3.09Å; S273-S275 VanDerWaalsContact OG-CB 3.22Å; S273-S275 WeakPolarHBondContact OG-CB 3.46Å; S275-I277 PolarHBondContact O-N 3.06Å; S275-N295 WeakPolarHBondContact CB-ND2 3.43Å
276	R	94.2	Very high	88.9	Confident	60 Å²	60	47.6 Å²	47.6	23%	0.226	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-53.8	129.4	-179.6	171	-173.4	-58.1	-157.8	-6.3	111.2	L251 C278 N293 E294	L251-R276 HydrophobicContact CD2-CG 3.77Å; L251-R276 WeakPolarHBondContact O-CA 3.21Å; L251-R276 PolarHBondContact O-N 3.32Å; R276-C278 PolarHBondContact O-N 3.2Å; R276-N293 CarbonylContact O-C 3.55Å; R276-N293 WeakPolarHBondContact O-CA 3.27Å; R276-E294 HydrophobicContact CB-CB 4.11Å; R276-E294 IonicContact NE-OE2 3.67Å; R276-E294 PolarHBondContact O-N 3.16Å
277	I	96.1	Very high	88.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	117.8	173.7	-53.7	-56	0	0	0	109.5	N235 I236 S250 I255 D271 S275 F291 A292 N293	N235-I277 WeakPolarHBondContact CB-O 3.25Å; N235-I277 PolarHBondContact ND2-O 3.18Å; I236-I277 HydrophobicContact CG2-CG2 4.05Å; S250-I277 PolarHBondContact O-N 2.99Å; I255-I277 HydrophobicContact CD1-CD1 4.26Å; I255-I277 HydrophobicContact CG1-CD1 4.18Å; I255-I277 HydrophobicContact CG1-CG1 4.08Å; D271-I277 HydrophobicContact CB-CD1 4.18Å; S275-I277 PolarHBondContact O-N 3.06Å; I277-F291 HydrophobicContact CD1-CD2 4.13Å; I277-F291 HydrophobicContact CG2-CB 4.49Å; I277-A292 CarbonylContact C-O 3.58Å; I277-N293 HydrophobicContact CD1-CB 4.35Å
278	C	93.8	Very high	88.7	Confident	6 Å²	6	49 Å²	49	4%	0.041	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-31	-174.8	-62.8	0	0	0	0	113.8	L15 T16 R276 A292	L15-C278 HydrophobicContact CD1-CB 3.81Å; T16-C278 WeakPolarHBondContact O-CB 3.31Å; R276-C278 PolarHBondContact O-N 3.2Å; C278-A292 PolarHBondContact N-O 3.5Å
279	S	94.6	Very high	88.8	Confident	11 Å²	11	43.1 Å²	43.1	8%	0.077	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	144.3	179.9	-159	0	0	0	0	110.2	A18 F291 A292	A18-S279 PolarHBondContact N-OG 3.35Å; A18-S279 VanDerWaalsContact N-OG 3.15Å; A18-S279 PolarHBondContact O-OG 3.44Å; S279-F291 VanDerWaalsContact O-CA 3.28Å; S279-F291 WeakPolarHBondContact O-CA 3.42Å; S279-A292 PolarHBondContact N-O 2.94Å; S279-A292 PolarHBondContact O-N 3.17Å
280	L	94.4	Very high	89	Confident	7 Å²	7	42.4 Å²	42.4	4%	0.037	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	116.4	-179.8	-164.3	65.5	0	0	0	108.9	I236 A238 S247 I255 L289 L290 F291	I236-L280 HydrophobicContact CD1-CB 3.87Å; I236-L280 HydrophobicContact CG1-CB 3.89Å; I236-L280 HydrophobicContact CG2-CB 3.86Å; I236-L280 HydrophobicContact CG2-CD2 4.38Å; A238-L280 HydrophobicContact CB-CG 4.48Å; S247-L280 WeakPolarHBondContact OG-CD2 3.12Å; I255-L280 HydrophobicContact CG2-CD1 4.22Å; L280-L289 HydrophobicContact CD1-CD1 3.91Å; L280-L289 HydrophobicContact CD1-CD2 3.81Å; L280-L289 HydrophobicContact CD1-CG 3.79Å; L280-L289 HydrophobicContact CG-CD1 3.98Å; L280-L289 HydrophobicContact CG-CD2 4.47Å; L280-L289 HydrophobicContact CG-CG 4.41Å; L280-L290 WeakPolarHBondContact CA-O 3.3Å; L280-F291 HydrophobicContact CD1-CB 3.85Å
281	F	91.9	Very high	89.2	Confident	87 Å²	87	38.1 Å²	38.1	38%	0.382	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	126.1	-172.8	-157.6	-83.6	0	0	0	111.2	V19 Y20 L290	V19-F281 HydrophobicContact CG1-CD2 4.27Å; V19-F281 HydrophobicContact CG1-CE2 4.49Å; Y20-F281 AromaticContact CD2-CD1 3.99Å; Y20-F281 HydrophobicContact CD2-CD1 3.99Å; F281-L290 PolarHBondContact N-O 3.38Å; F281-L290 WeakPolarHBondContact O-CB 2.99Å; F281-L290 PolarHBondContact O-N 2.94Å
282	W	92.2	Very high	89.4	Confident	17 Å²	17	38.1 Å²	38.1	6%	0.064	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	135.6	174.4	-71	92.9	0	0	0	110.3	M1 A238 S239 L245 S247 V257 L289 A303	M1-W282 HydrophobicContact CE-CH2 4.39Å; A238-W282 PolarHBondContact O-NE1 3.38Å; A238-W282 VanDerWaalsContact O-NE1 3.16Å; S239-W282 VanDerWaalsContact C-CD1 3.44Å; S239-W282 VanDerWaalsContact O-CD1 3.28Å; L245-W282 HydrophobicContact CB-CH2 4.18Å; L245-W282 HydrophobicContact CB-CZ2 4.1Å; L245-W282 HydrophobicContact CD1-CH2 3.95Å; L245-W282 HydrophobicContact CD1-CZ3 4.42Å; S247-W282 PolarHBondContact OG-NE1 3.29Å; V257-W282 HydrophobicContact CG1-CH2 4.09Å; V257-W282 HydrophobicContact CG1-CZ2 4.15Å; V257-W282 HydrophobicContact CG2-CH2 4.47Å; V257-W282 HydrophobicContact CG2-CZ2 4.43Å; W282-L289 HydrophobicContact CD2-CD1 3.69Å; W282-L289 HydrophobicContact CE3-CB 4.34Å; W282-L289 HydrophobicContact CE3-CD1 4.21Å; W282-L289 HydrophobicContact CG-CD1 3.86Å; W282-L289 HydrophobicContact CZ2-CD1 4.3Å; W282-L289 HydrophobicContact CZ3-CB 4.4Å; W282-A303 HydrophobicContact CH2-CB 4.31Å; W282-A303 HydrophobicContact CZ3-CB 4.04Å
283	H	89.1	Confident	89.7	Confident	18 Å²	18	34.1 Å²	34.1	8%	0.083	17%	0.173	C	C	.	.			trans	-60	139	172.8	-178.2	-84.6	0	0	0	110.2	Y20 G24 L285 D286 N288	Y20-H283 AromaticContact CD1-CD2 3.96Å; Y20-H283 HydrophobicContact CD2-CB 4.22Å; Y20-H283 AromaticContact CE1-CD2 3.66Å; Y20-H283 HydrophobicContact CE2-CB 3.8Å; Y20-H283 AromaticContact CE2-CD2 3.9Å; Y20-H283 AromaticContact CZ-CD2 3.64Å; G24-H283 WeakPolarHBondContact CA-NE2 3.48Å; G24-H283 PolarHBondContact O-NE2 3.16Å; H283-L285 VanDerWaalsContact C-N 3.27Å; H283-L285 PolarHBondContact ND1-N 3Å; H283-L285 PolarHBondContact O-N 3.39Å; H283-D286 WeakPolarHBondContact CB-O 3.44Å; H283-D286 IonicContact CE1-OD2 2.67Å; H283-D286 WeakPolarHBondContact ND1-CB 3.33Å; H283-D286 PolarHBondContact ND1-N 3.2Å; H283-D286 IonicContact ND1-OD2 3.67Å; H283-D286 VanDerWaalsContact O-O 3.11Å; H283-N288 HydrophobicContact CB-CB 3.92Å; H283-N288 WeakPolarHBondContact CB-O 3.1Å; H283-N288 PolarHBondContact N-O 3.21Å
284	P	81.3	Confident	90	Very high	28 Å²	28	34.4 Å²	34.4	18%	0.182	17%	0.168	C	C	.	.	S	Bend	trans	-67.4	-22.4	-170.1	22.9	-33.9	0	0	0	114.7	R241	R241-P284 WeakPolarHBondContact CD-O 3.48Å; R241-P284 PolarHBondContact NH1-O 3.24Å; R241-P284 VanDerWaalsContact NH1-O 3.07Å
285	L	80.5	Confident	90.1	Very high	119 Å²	119	32 Å²	32	62%	0.623	16%	0.158	S	C	*	.	S	Bend	trans	-115.7	-58	-178.2	-57.3	176.5	0	0	0	111.6	H283	H283-L285 VanDerWaalsContact C-N 3.27Å; H283-L285 PolarHBondContact ND1-N 3Å; H283-L285 PolarHBondContact O-N 3.39Å
286	D	78.8	Confident	90	Very high	90 Å²	90	31.4 Å²	31.4	48%	0.481	15%	0.154	S	C	.	.	S	Bend	trans	-77.6	157.3	177.4	-54.2	-20.3	0	0	0	114.3	H283 N288	H283-D286 WeakPolarHBondContact CB-O 3.44Å; H283-D286 IonicContact CE1-OD2 2.67Å; H283-D286 WeakPolarHBondContact ND1-CB 3.33Å; H283-D286 PolarHBondContact ND1-N 3.2Å; H283-D286 IonicContact ND1-OD2 3.67Å; H283-D286 VanDerWaalsContact O-O 3.11Å; D286-N288 HydrophobicContact CB-CB 4.44Å; D286-N288 PolarHBondContact O-N 3.11Å
287	K	78.3	Confident	89.9	Confident	78 Å²	78	29.2 Å²	29.2	34%	0.339	15%	0.148	S	C	.	.	S	Bend	trans	-80.1	40.1	171.2	-61.4	-174.9	176.5	176.3	0	112.8	A303 D305	K287-A303 HydrophobicContact CB-CB 4.09Å; K287-A303 WeakPolarHBondContact O-CB 3.37Å; K287-A303 PolarHBondContact O-N 3.38Å; K287-D305 IonicContact NZ-OD1 2.75Å; K287-D305 PolarHBondContact NZ-OD1 3.35Å
288	N	87	Confident	89.7	Confident	34 Å²	34	29.2 Å²	29.2	18%	0.182	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	142.2	172.9	-70.8	-27.6	0	0	0	109.8	H283 D286 L300 V301 H302	H283-N288 HydrophobicContact CB-CB 3.92Å; H283-N288 WeakPolarHBondContact CB-O 3.1Å; H283-N288 PolarHBondContact N-O 3.21Å; D286-N288 HydrophobicContact CB-CB 4.44Å; D286-N288 PolarHBondContact O-N 3.11Å; N288-L300 HydrophobicContact CB-CD2 4.41Å; N288-V301 CarbonylContact C-O 3.59Å; N288-V301 WeakPolarHBondContact CA-O 3.43Å; N288-H302 PolarHBondContact OD1-ND1 2.88Å
289	L	90.9	Very high	89.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117.4	179.6	-174.3	65.9	0	0	0	108.6	I255 V257 L280 W282 V301	I255-L289 HydrophobicContact CG2-CD2 3.75Å; V257-L289 HydrophobicContact CG2-CD2 4.3Å; L280-L289 HydrophobicContact CD1-CD1 3.91Å; L280-L289 HydrophobicContact CD1-CD2 3.81Å; L280-L289 HydrophobicContact CD1-CG 3.79Å; L280-L289 HydrophobicContact CG-CD1 3.98Å; L280-L289 HydrophobicContact CG-CD2 4.47Å; L280-L289 HydrophobicContact CG-CG 4.41Å; W282-L289 HydrophobicContact CD2-CD1 3.69Å; W282-L289 HydrophobicContact CE3-CB 4.34Å; W282-L289 HydrophobicContact CE3-CD1 4.21Å; W282-L289 HydrophobicContact CG-CD1 3.86Å; W282-L289 HydrophobicContact CZ2-CD1 4.3Å; W282-L289 HydrophobicContact CZ3-CB 4.4Å; L289-V301 HydrophobicContact CB-CB 4.28Å; L289-V301 PolarHBondContact N-O 2.99Å; L289-V301 PolarHBondContact O-N 2.86Å
290	L	92.7	Very high	89.2	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	133	172.5	-177.8	70.5	0	0	0	108.6	A18 Y20 I27 L280 F281 V298 L300	A18-L290 HydrophobicContact CB-CD2 3.93Å; A18-L290 HydrophobicContact CB-CG 4.35Å; Y20-L290 HydrophobicContact CD2-CB 4.34Å; Y20-L290 HydrophobicContact CD2-CD2 4.17Å; Y20-L290 HydrophobicContact CE2-CB 3.59Å; Y20-L290 HydrophobicContact CE2-CD2 3.99Å; Y20-L290 HydrophobicContact CE2-CG 4.33Å; I27-L290 HydrophobicContact CD1-CD1 4.17Å; I27-L290 HydrophobicContact CG2-CD1 4.26Å; I27-L290 HydrophobicContact CG2-CD2 3.81Å; L280-L290 WeakPolarHBondContact CA-O 3.3Å; F281-L290 PolarHBondContact N-O 3.38Å; F281-L290 WeakPolarHBondContact O-CB 2.99Å; F281-L290 PolarHBondContact O-N 2.94Å; L290-V298 HydrophobicContact CD1-CG1 3.48Å; L290-V298 VanDerWaalsContact CD1-CG1 3.48Å; L290-V298 HydrophobicContact CG-CG1 4.26Å; L290-L300 HydrophobicContact CB-CD2 4.31Å; L290-L300 HydrophobicContact CD1-CD2 4.17Å; L290-L300 HydrophobicContact CD1-CG 4.24Å
291	F	94.3	Very high	88.8	Confident	1 Å²	1	29.3 Å²	29.3	0%	0.004	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	152	174.2	72.7	-87.2	0	0	0	111	P7 I255 D271 I277 S279 L280 V298 G299 V301	P7-F291 HydrophobicContact CB-CE2 4.46Å; P7-F291 HydrophobicContact CB-CZ 4.41Å; I255-F291 HydrophobicContact CD1-CB 3.73Å; I255-F291 HydrophobicContact CD1-CD1 3.64Å; I255-F291 HydrophobicContact CD1-CD2 3.74Å; I255-F291 HydrophobicContact CD1-CE1 4.14Å; I255-F291 HydrophobicContact CD1-CE2 4.23Å; I255-F291 HydrophobicContact CD1-CG 3.41Å; I255-F291 VanDerWaalsContact CD1-CG 3.41Å; I255-F291 HydrophobicContact CD1-CZ 4.4Å; D271-F291 HydrophobicContact CB-CE2 4.47Å; I277-F291 HydrophobicContact CD1-CD2 4.13Å; I277-F291 HydrophobicContact CG2-CB 4.49Å; S279-F291 VanDerWaalsContact O-CA 3.28Å; S279-F291 WeakPolarHBondContact O-CA 3.42Å; L280-F291 HydrophobicContact CD1-CB 3.85Å; F291-V298 CarbonylContact O-C 3.5Å; F291-V298 WeakPolarHBondContact O-CA 3.49Å; F291-G299 VanDerWaalsContact CD1-C 3.5Å; F291-G299 VanDerWaalsContact CD1-O 3.23Å; F291-G299 WeakPolarHBondContact CD1-O 3.11Å; F291-G299 VanDerWaalsContact CE1-CA 3.47Å; F291-G299 PolarHBondContact N-O 3.22Å; F291-G299 PolarHBondContact O-N 2.58Å; F291-V301 HydrophobicContact CD1-CG2 3.94Å; F291-V301 HydrophobicContact CE1-CG2 3.77Å
292	A	94.3	Very high	88.2	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.6	170.6	0	0	0	0	0	110.3	T16 A18 I277 C278 S279 S297 V298	T16-A292 HydrophobicContact CG2-CB 4.01Å; A18-A292 HydrophobicContact CB-CB 4.05Å; I277-A292 CarbonylContact C-O 3.58Å; C278-A292 PolarHBondContact N-O 3.5Å; S279-A292 PolarHBondContact N-O 2.94Å; S279-A292 PolarHBondContact O-N 3.17Å; A292-S297 CarbonylContact C-O 3.49Å; A292-S297 VanDerWaalsContact CA-O 3.28Å; A292-S297 WeakPolarHBondContact CA-O 3.48Å; A292-V298 HydrophobicContact CB-CG2 4.04Å
293	N	94	Very high	87	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	169.6	179.2	70.3	21.4	0	0	0	112.4	D271 S273 R276 I277 N295 G296 S297	D271-N293 PolarHBondContact OD2-ND2 3.04Å; S273-N293 PolarHBondContact OG-ND2 3.42Å; R276-N293 CarbonylContact O-C 3.55Å; R276-N293 WeakPolarHBondContact O-CA 3.27Å; I277-N293 HydrophobicContact CD1-CB 4.35Å; N293-N295 PolarHBondContact O-N 3.26Å; N293-N295 WeakPolarHBondContact OD1-CA 3Å; N293-N295 WeakPolarHBondContact OD1-CB 3.46Å; N293-N295 PolarHBondContact OD1-N 2.97Å; N293-G296 PolarHBondContact O-N 2.92Å; N293-S297 PolarHBondContact N-O 2.8Å; N293-S297 WeakPolarHBondContact OD1-CB 3.34Å; N293-S297 PolarHBondContact OD1-N 3.44Å; N293-S297 PolarHBondContact OD1-O 3.23Å
294	E	91.9	Very high	85.6	Confident	59 Å²	59	30 Å²	30	28%	0.276	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-16	179.6	-167.8	-169	154.5	0	0	112.8	K13 G14 R276 G296	K13-E294 CarbonylContact C-O 3.46Å; K13-E294 WeakPolarHBondContact CA-O 3.41Å; K13-E294 VanDerWaalsContact CG-O 3.31Å; K13-E294 WeakPolarHBondContact CG-O 3.45Å; G14-E294 PolarHBondContact N-O 3.34Å; G14-E294 CarbonylContact O-C 3.51Å; G14-E294 WeakPolarHBondContact O-CA 3.42Å; G14-E294 VanDerWaalsContact O-O 3.04Å; R276-E294 HydrophobicContact CB-CB 4.11Å; R276-E294 IonicContact NE-OE2 3.67Å; R276-E294 PolarHBondContact O-N 3.16Å; E294-G296 PolarHBondContact O-N 3.01Å
295	N	91	Very high	84.3	Confident	44 Å²	44	34.5 Å²	34.5	24%	0.235	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-0	176.6	-69.4	-23.9	0	0	0	113.3	S273 S275 N293 S297	S273-N295 WeakPolarHBondContact CB-ND2 3.44Å; S273-N295 PolarHBondContact OG-ND2 3.44Å; S275-N295 WeakPolarHBondContact CB-ND2 3.43Å; N293-N295 PolarHBondContact O-N 3.26Å; N293-N295 WeakPolarHBondContact OD1-CA 3Å; N293-N295 WeakPolarHBondContact OD1-CB 3.46Å; N293-N295 PolarHBondContact OD1-N 2.97Å; N295-S297 VanDerWaalsContact C-N 3.31Å
296	G	88.9	Confident	82.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	84	9.2	-174.4	0	0	0	0	0	113.3	V10 H11 T16 N293 E294	V10-G296 PolarHBondContact N-O 3.14Å; H11-G296 PolarHBondContact N-O 3.48Å; T16-G296 WeakPolarHBondContact OG1-CA 3.39Å; N293-G296 PolarHBondContact O-N 2.92Å; E294-G296 PolarHBondContact O-N 3.01Å
297	S	91.9	Very high	81.1	Confident	13 Å²	13	38.2 Å²	38.2	9%	0.091	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	144.8	-178.4	-53.3	0	0	0	0	112.5	V8 A292 N293 N295	V8-S297 CarbonylContact O-C 3.52Å; V8-S297 WeakPolarHBondContact O-CA 3.31Å; V8-S297 WeakPolarHBondContact O-CB 3.09Å; A292-S297 CarbonylContact C-O 3.49Å; A292-S297 VanDerWaalsContact CA-O 3.28Å; A292-S297 WeakPolarHBondContact CA-O 3.48Å; N293-S297 PolarHBondContact N-O 2.8Å; N293-S297 WeakPolarHBondContact OD1-CB 3.34Å; N293-S297 PolarHBondContact OD1-N 3.44Å; N293-S297 PolarHBondContact OD1-O 3.23Å; N295-S297 VanDerWaalsContact C-N 3.31Å
298	V	92.1	Very high	79.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.2	179	-177.5	0	0	0	0	109.2	P7 V8 V10 T16 A18 T29 L42 L290 F291 A292	P7-V298 WeakPolarHBondContact CA-O 3.35Å; V8-V298 PolarHBondContact N-O 3.14Å; V8-V298 PolarHBondContact O-N 3.48Å; V10-V298 HydrophobicContact CB-CG2 4.49Å; V10-V298 HydrophobicContact CG2-CB 4.44Å; V10-V298 HydrophobicContact CG2-CG2 4.36Å; T16-V298 HydrophobicContact CG2-CG2 4.38Å; A18-V298 HydrophobicContact CB-CG1 4.23Å; A18-V298 HydrophobicContact CB-CG2 4.35Å; T29-V298 HydrophobicContact CG2-CG2 4.01Å; L42-V298 HydrophobicContact CD1-CG1 4.5Å; L42-V298 HydrophobicContact CD2-CB 4.39Å; L42-V298 HydrophobicContact CD2-CG1 3.98Å; L290-V298 HydrophobicContact CD1-CG1 3.48Å; L290-V298 VanDerWaalsContact CD1-CG1 3.48Å; L290-V298 HydrophobicContact CG-CG1 4.26Å; F291-V298 CarbonylContact O-C 3.5Å; F291-V298 WeakPolarHBondContact O-CA 3.49Å; A292-V298 HydrophobicContact CB-CG2 4.04Å
299	G	89.5	Confident	77.2	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	164.8	-176.6	0	0	0	0	0	113.3	F291	F291-G299 VanDerWaalsContact CD1-C 3.5Å; F291-G299 VanDerWaalsContact CD1-O 3.23Å; F291-G299 WeakPolarHBondContact CD1-O 3.11Å; F291-G299 VanDerWaalsContact CE1-CA 3.47Å; F291-G299 PolarHBondContact N-O 3.22Å; F291-G299 PolarHBondContact O-N 2.58Å
300	L	89.4	Confident	74.8	Confident	27 Å²	27	51.7 Å²	51.7	14%	0.141	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.2	-179.7	-85.5	164.2	0	0	0	111.4	T4 K5 Y20 L42 N288 L290	T4-L300 PolarHBondContact N-O 3.16Å; T4-L300 PolarHBondContact OG1-O 2.83Å; K5-L300 HydrophobicContact CB-CB 4.28Å; K5-L300 PolarHBondContact N-O 2.78Å; K5-L300 PolarHBondContact O-N 3.02Å; Y20-L300 WeakPolarHBondContact OH-CD2 3.43Å; L42-L300 HydrophobicContact CD1-CB 4.33Å; L42-L300 HydrophobicContact CD1-CD1 3.49Å; L42-L300 VanDerWaalsContact CD1-CD1 3.49Å; L42-L300 HydrophobicContact CD1-CG 3.69Å; L42-L300 HydrophobicContact CG-CD1 4.07Å; N288-L300 HydrophobicContact CB-CD2 4.41Å; L290-L300 HydrophobicContact CB-CD2 4.31Å; L290-L300 HydrophobicContact CD1-CD2 4.17Å; L290-L300 HydrophobicContact CD1-CG 4.24Å
301	V	84.8	Confident	72.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.9	176.6	171.4	0	0	0	0	108.9	M1 I3 I269 N288 L289 F291	M1-V301 HydrophobicContact CB-CG1 3.95Å; M1-V301 HydrophobicContact CE-CG1 4.38Å; M1-V301 HydrophobicContact CG-CG1 3.74Å; M1-V301 HydrophobicContact SD-CG1 3.4Å; M1-V301 WeakPolarHBondContact SD-CG1 3.31Å; I3-V301 HydrophobicContact CG1-CG2 4.48Å; I269-V301 HydrophobicContact CD1-CB 4.24Å; I269-V301 HydrophobicContact CD1-CG1 3.2Å; I269-V301 HydrophobicContact CD1-CG2 3.99Å; N288-V301 CarbonylContact C-O 3.59Å; N288-V301 WeakPolarHBondContact CA-O 3.43Å; L289-V301 HydrophobicContact CB-CB 4.28Å; L289-V301 PolarHBondContact N-O 2.99Å; L289-V301 PolarHBondContact O-N 2.86Å; F291-V301 HydrophobicContact CD1-CG2 3.94Å; F291-V301 HydrophobicContact CE1-CG2 3.77Å
302	H	79.6	Confident	70.2	Confident	78 Å²	78	59.8 Å²	59.8	36%	0.361	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	119.9	176	179.2	68.3	0	0	0	111.9	M1 T4 N288 P304	M1-H302 VanDerWaalsContact CA-O 3.24Å; M1-H302 WeakPolarHBondContact CA-O 3.44Å; M1-H302 WeakPolarHBondContact CB-O 3.49Å; M1-H302 WeakPolarHBondContact CG-O 3.39Å; T4-H302 HydrophobicContact CG2-CB 3.41Å; T4-H302 VanDerWaalsContact CG2-CB 3.41Å; T4-H302 PolarHBondContact OG1-N 3.06Å; N288-H302 PolarHBondContact OD1-ND1 2.88Å; H302-P304 WeakPolarHBondContact O-CD 3.41Å
303	A	67.8	Low	68	Low	3 Å²	3	66 Å²	66	3%	0.025	34%	0.341	C	S	.	.			trans	-84.5	100.9	174.2	0	0	0	0	0	111.4	M1 W282 K287	M1-A303 HydrophobicContact CE-CB 3.15Å; M1-A303 HydrophobicContact CG-CB 4.23Å; W282-A303 HydrophobicContact CH2-CB 4.31Å; W282-A303 HydrophobicContact CZ3-CB 4.04Å; K287-A303 HydrophobicContact CB-CB 4.09Å; K287-A303 WeakPolarHBondContact O-CB 3.37Å; K287-A303 PolarHBondContact O-N 3.38Å
304	P	58.7	Low	65.8	Low	56 Å²	56	67.2 Å²	67.2	36%	0.364	35%	0.35	S	S	.	.			trans	-66.4	150.7	177.1	28.8	-34.5	0	0	0	111.2	H302 H306	H302-P304 WeakPolarHBondContact O-CD 3.41Å; P304-H306 PolarHBondContact O-N 3.26Å
305	D	53.8	Low	63.4	Low	122 Å²	122	68.2 Å²	68.2	65%	0.652	36%	0.361	S	S	*	.			trans	-66.3	97.6	167.8	-80.1	-30.5	0	0	0	109.6	K287 Q307	K287-D305 IonicContact NZ-OD1 2.75Å; K287-D305 PolarHBondContact NZ-OD1 3.35Å; D305-Q307 PolarHBondContact O-N 3.43Å; D305-Q307 VanDerWaalsContact O-N 3.15Å
306	H	49.3	Very low	61.4	Low	122 Å²	122	71.9 Å²	71.9	57%	0.565	38%	0.381	S	S	*	.			trans	-78.9	98.2	165.8	-160.3	26.9	0	0	0	108.6	P304	P304-H306 PolarHBondContact O-N 3.26Å
307	Q	43.1	Very low	59.7	Low	165 Å²	165	77 Å²	77	77%	0.771	40%	0.4	S	S	*	.			trans	-57.7	129.8	163.7	-92.5	171.6	-18.9	0	0	108.5	D305 S309	D305-Q307 PolarHBondContact O-N 3.43Å; D305-Q307 VanDerWaalsContact O-N 3.15Å; Q307-S309 PolarHBondContact O-N 3.22Å; Q307-S309 VanDerWaalsContact O-N 3.09Å
308	P	40.8	Very low	57.7	Low	92 Å²	92	79.6 Å²	79.6	60%	0.597	41%	0.412	S	S	*	.			trans	-60.6	118.3	175.2	24.5	-31.2	0	0	0	108.2	R310	P308-R310 VanDerWaalsContact C-N 3.34Å; P308-R310 PolarHBondContact O-N 3.32Å
309	S	43.2	Very low	55.8	Low	78 Å²	78	81.4 Å²	81.4	55%	0.545	43%	0.427	S	S	.	.			trans	-62.7	101.7	167.2	57.1	0	0	0	0	107	Q307 D311	Q307-S309 PolarHBondContact O-N 3.22Å; Q307-S309 VanDerWaalsContact O-N 3.09Å; S309-D311 PolarHBondContact O-N 3.41Å
310	R	39.7	Very low	53.8	Low	224 Å²	224	88.4 Å²	88.4	85%	0.845	46%	0.46	S	S	*	.			trans	-66.9	-2.3	-179.8	-83	-173.6	172.5	-174.6	-1.8	113.5	P308 P312	P308-R310 VanDerWaalsContact C-N 3.34Å; P308-R310 PolarHBondContact O-N 3.32Å; R310-P312 WeakPolarHBondContact O-CD 3.44Å
311	D	42.7	Very low	51.8	Low	99 Å²	99	93.7 Å²	93.7	53%	0.529	49%	0.487	S	S	.	.			trans	-73.2	109.3	-173.8	-148.1	-16.6	0	0	0	111.2	S309 L313 S314	S309-D311 PolarHBondContact O-N 3.41Å; D311-L313 PolarHBondContact O-N 3.38Å; D311-S314 PolarHBondContact O-N 2.69Å; D311-S314 PolarHBondContact O-OG 2.58Å
312	P	47.3	Very low	50	Low	74 Å²	74	100.3 Å²	100.3	48%	0.481	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.1	-176.9	21.4	-22.3	0	0	0	113.4	R310	R310-P312 WeakPolarHBondContact O-CD 3.44Å
313	L	48.7	Very low	48.2	Very low	130 Å²	130	99.3 Å²	99.3	68%	0.681	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	6	-179	-88.8	84.1	0	0	0	114.6	D311	D311-L313 PolarHBondContact O-N 3.38Å
314	S	47.5	Very low	47.1	Very low	26 Å²	26	102.1 Å²	102.1	18%	0.182	55%	0.55	C	S	.	*			trans	-62.3	139.3	176.1	64	0	0	0	0	110.7	D311 N316 R317 I318	D311-S314 PolarHBondContact O-N 2.69Å; D311-S314 PolarHBondContact O-OG 2.58Å; S314-N316 PolarHBondContact O-N 3.28Å; S314-N316 VanDerWaalsContact O-N 3.07Å; S314-R317 PolarHBondContact O-N 3.27Å; S314-R317 WeakPolarHBondContact OG-CB 3.24Å; S314-R317 PolarHBondContact OG-N 2.88Å; S314-I318 PolarHBondContact O-N 3.18Å; S314-I318 VanDerWaalsContact O-N 3.09Å
315	P	42.3	Very low	46.3	Very low	79 Å²	79	106.4 Å²	106.4	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-51.2	-37	179.5	-28.2	33.8	0	0	0	112.7	R317 I318 A319	P315-R317 PolarHBondContact O-N 3.44Å; P315-I318 PolarHBondContact O-N 2.72Å; P315-A319 VanDerWaalsContact O-CB 3.29Å; P315-A319 WeakPolarHBondContact O-CB 3.32Å; P315-A319 PolarHBondContact O-N 2.82Å
316	N	48.7	Very low	45.8	Very low	122 Å²	122	109.9 Å²	109.9	65%	0.652	58%	0.582	S	S	*	*	H	α-helix	trans	-63.7	-38.4	176.8	-71.4	-14.1	0	0	0	113	S314 Q320	S314-N316 PolarHBondContact O-N 3.28Å; S314-N316 VanDerWaalsContact O-N 3.07Å; N316-Q320 WeakPolarHBondContact O-CB 3.47Å; N316-Q320 WeakPolarHBondContact O-CG 3.44Å; N316-Q320 PolarHBondContact O-N 3.38Å
317	R	53.1	Low	45.6	Very low	107 Å²	107	110.5 Å²	110.5	40%	0.404	59%	0.59	S	S	.	*	H	α-helix	trans	-78.3	-31.9	-179.8	-161.6	161.7	-179.1	-161.2	3	112.1	S314 P315 Q320 L321	S314-R317 PolarHBondContact O-N 3.27Å; S314-R317 WeakPolarHBondContact OG-CB 3.24Å; S314-R317 PolarHBondContact OG-N 2.88Å; P315-R317 PolarHBondContact O-N 3.44Å; R317-Q320 PolarHBondContact O-N 2.94Å; R317-L321 WeakPolarHBondContact O-CB 3.43Å; R317-L321 PolarHBondContact O-N 3.01Å
318	I	50.3	Low	45.8	Very low	68 Å²	68	105.6 Å²	105.6	35%	0.349	58%	0.583	S	S	.	*	H	α-helix	trans	-67	-45.2	171.5	-61.4	174.3	0	0	0	110	S314 P315 Q320 L321 M322 L334	S314-I318 PolarHBondContact O-N 3.18Å; S314-I318 VanDerWaalsContact O-N 3.09Å; P315-I318 PolarHBondContact O-N 2.72Å; I318-Q320 VanDerWaalsContact C-N 3.29Å; I318-Q320 PolarHBondContact O-N 3.49Å; I318-L321 PolarHBondContact O-N 3.44Å; I318-M322 PolarHBondContact O-N 2.81Å; I318-M322 VanDerWaalsContact O-N 3.14Å; I318-L334 HydrophobicContact CG2-CD2 3.8Å
319	A	50.5	Low	46.2	Very low	38 Å²	38	108 Å²	108	31%	0.314	59%	0.591	S	S	.	*	H	α-helix	trans	-59.3	-40.3	173.3	0	0	0	0	0	111.8	P315 G323	P315-A319 VanDerWaalsContact O-CB 3.29Å; P315-A319 WeakPolarHBondContact O-CB 3.32Å; P315-A319 PolarHBondContact O-N 2.82Å; A319-G323 PolarHBondContact O-N 2.93Å
320	Q	47.8	Very low	46.5	Very low	147 Å²	147	107.4 Å²	107.4	69%	0.687	58%	0.584	S	S	*	*	H	α-helix	trans	-67.6	-38.3	175.2	-79	169.5	-1.1	0	0	114.1	N316 R317 I318 M322	N316-Q320 WeakPolarHBondContact O-CB 3.47Å; N316-Q320 WeakPolarHBondContact O-CG 3.44Å; N316-Q320 PolarHBondContact O-N 3.38Å; R317-Q320 PolarHBondContact O-N 2.94Å; I318-Q320 VanDerWaalsContact C-N 3.29Å; I318-Q320 PolarHBondContact O-N 3.49Å; Q320-M322 VanDerWaalsContact C-N 3.32Å
321	L	47.4	Very low	46.9	Very low	137 Å²	137	99.6 Å²	99.6	72%	0.717	57%	0.567	S	S	*	*	H	α-helix	trans	-68.9	-31	178.3	-101.9	151.2	0	0	0	112.5	R317 I318	R317-L321 WeakPolarHBondContact O-CB 3.43Å; R317-L321 PolarHBondContact O-N 3.01Å; I318-L321 PolarHBondContact O-N 3.44Å
322	M	48.3	Very low	47.3	Very low	139 Å²	139	100.5 Å²	100.5	69%	0.685	57%	0.572	S	S	*	*	H	α-helix	trans	-93.9	-5.1	-177.5	-65	-63.8	-66.2	0	0	113.9	I318 Q320 C324	I318-M322 PolarHBondContact O-N 2.81Å; I318-M322 VanDerWaalsContact O-N 3.14Å; Q320-M322 VanDerWaalsContact C-N 3.32Å; M322-C324 VanDerWaalsContact C-N 3.26Å; M322-C324 PolarHBondContact O-N 2.8Å
323	G	41.6	Very low	47.5	Very low	58 Å²	58	103.1 Å²	103.1	60%	0.598	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.4	28.6	171.3	0	0	0	0	0	114.6	A319 D325	A319-G323 PolarHBondContact O-N 2.93Å; G323-D325 PolarHBondContact O-N 2.79Å
324	C	43.3	Very low	47.7	Very low	62 Å²	62	99.6 Å²	99.6	42%	0.419	56%	0.563	S	S	.	*			trans	-86.6	93.1	-177.4	-60.2	0	0	0	0	110.1	M322 E326	M322-C324 VanDerWaalsContact C-N 3.26Å; M322-C324 PolarHBondContact O-N 2.8Å; C324-E326 PolarHBondContact O-N 2.96Å
325	D	43.8	Very low	48	Very low	146 Å²	146	101.7 Å²	101.7	78%	0.781	58%	0.578	S	S	*	*			trans	-72.5	110.7	165.3	-71	-36.8	0	0	0	109.1	G323 D327	G323-D325 PolarHBondContact O-N 2.79Å; D325-D327 VanDerWaalsContact C-N 3.3Å; D325-D327 PolarHBondContact O-N 2.88Å
326	E	43.2	Very low	48.6	Very low	195 Å²	195	100.3 Å²	100.3	91%	0.911	57%	0.573	S	S	*	*	S	Bend	trans	37	19.4	155.1	-65.1	-162.6	160.3	0	0	122.7	C324 G328	C324-E326 PolarHBondContact O-N 2.96Å; E326-G328 PolarHBondContact O-N 2.83Å
327	D	44.5	Very low	48.9	Very low	135 Å²	135	97.1 Å²	97.1	72%	0.722	56%	0.564	S	S	*	*			trans	-84	110.5	169.1	-73.1	-31.3	0	0	0	111	D325 D329 T330	D325-D327 VanDerWaalsContact C-N 3.3Å; D325-D327 PolarHBondContact O-N 2.88Å; D327-D329 PolarHBondContact O-N 3.46Å; D327-T330 PolarHBondContact O-N 2.89Å; D327-T330 PolarHBondContact O-OG1 2.89Å
328	G	47.2	Very low	48.9	Very low	61 Å²	61	93.7 Å²	93.7	63%	0.629	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	5.4	-156.2	0	0	0	0	0	119.7	E326	E326-G328 PolarHBondContact O-N 2.83Å
329	D	49.8	Very low	49.2	Very low	144 Å²	144	92.8 Å²	92.8	77%	0.77	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-16	178.7	-68.7	-23.3	0	0	0	113.1	D327	D327-D329 PolarHBondContact O-N 3.46Å
330	T	49.1	Very low	49.4	Very low	64 Å²	64	98 Å²	98	39%	0.393	58%	0.579	S	S	.	*	H	α-helix	trans	-89.8	-22.7	-178.2	56.7	0	0	0	0	113.9	D327 D332 L333 L334	D327-T330 PolarHBondContact O-N 2.89Å; D327-T330 PolarHBondContact O-OG1 2.89Å; T330-D332 VanDerWaalsContact C-N 3.33Å; T330-D332 PolarHBondContact O-N 2.82Å; T330-L333 PolarHBondContact O-N 3Å; T330-L334 PolarHBondContact O-N 2.91Å
331	A	48.4	Very low	49.6	Very low	60 Å²	60	93.8 Å²	93.8	50%	0.496	57%	0.569	S	S	.	*	H	α-helix	trans	-63.3	-38.9	178.6	0	0	0	0	0	112.1	L334 S335	A331-L334 PolarHBondContact O-N 2.95Å; A331-S335 PolarHBondContact O-N 2.89Å
332	D	50.8	Low	49.8	Very low	119 Å²	119	93.9 Å²	93.9	64%	0.636	57%	0.566	S	S	*	*	H	α-helix	trans	-67	-41	178.6	-81.6	-4.9	0	0	0	111.6	T330 L334 S335 A336	T330-D332 VanDerWaalsContact C-N 3.33Å; T330-D332 PolarHBondContact O-N 2.82Å; D332-L334 VanDerWaalsContact C-N 3.35Å; D332-L334 PolarHBondContact O-N 3.32Å; D332-S335 PolarHBondContact O-N 2.74Å; D332-S335 PolarHBondContact O-OG 3.1Å; D332-A336 WeakPolarHBondContact O-CB 3.17Å; D332-A336 PolarHBondContact O-N 3.2Å
333	L	51.3	Low	50	Low	129 Å²	129	90.8 Å²	90.8	68%	0.675	56%	0.558	S	S	*	*	H	α-helix	trans	-65.5	-37.2	175.4	-66.9	177.3	0	0	0	112.3	T330 A336 A337	T330-L333 PolarHBondContact O-N 3Å; L333-A336 PolarHBondContact O-N 3.17Å; L333-A337 WeakPolarHBondContact O-CB 3.26Å; L333-A337 PolarHBondContact O-N 3.19Å
334	L	52	Low	50.5	Low	55 Å²	55	92.1 Å²	92.1	29%	0.288	56%	0.558	S	S	.	*	H	α-helix	trans	-68.2	-40.9	175.2	-95.8	149.6	0	0	0	112.1	I318 T330 A331 D332 A336 A337 A338	I318-L334 HydrophobicContact CG2-CD2 3.8Å; T330-L334 PolarHBondContact O-N 2.91Å; A331-L334 PolarHBondContact O-N 2.95Å; D332-L334 VanDerWaalsContact C-N 3.35Å; D332-L334 PolarHBondContact O-N 3.32Å; L334-A336 VanDerWaalsContact C-N 3.31Å; L334-A336 PolarHBondContact O-N 3.07Å; L334-A337 PolarHBondContact O-N 2.88Å; L334-A338 WeakPolarHBondContact O-CB 3.08Å; L334-A338 PolarHBondContact O-N 3.38Å
335	S	54.4	Low	50.7	Low	71 Å²	71	99.8 Å²	99.8	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-63.3	-39.4	174	83.2	0	0	0	0	111.4	A331 D332 A338 A339	A331-S335 PolarHBondContact O-N 2.89Å; D332-S335 PolarHBondContact O-N 2.74Å; D332-S335 PolarHBondContact O-OG 3.1Å; S335-A338 PolarHBondContact O-N 3.1Å; S335-A339 VanDerWaalsContact O-CB 3.25Å; S335-A339 WeakPolarHBondContact O-CB 3.41Å; S335-A339 PolarHBondContact O-N 3.26Å
336	A	55.3	Low	50.6	Low	50 Å²	50	99.4 Å²	99.4	41%	0.413	58%	0.575	S	S	.	*	H	α-helix	trans	-67.5	-43.5	176.8	0	0	0	0	0	111.5	D332 L333 L334 A339 Q340	D332-A336 WeakPolarHBondContact O-CB 3.17Å; D332-A336 PolarHBondContact O-N 3.2Å; L333-A336 PolarHBondContact O-N 3.17Å; L334-A336 VanDerWaalsContact C-N 3.31Å; L334-A336 PolarHBondContact O-N 3.07Å; A336-A339 PolarHBondContact O-N 3.01Å; A336-Q340 VanDerWaalsContact O-CB 3.26Å; A336-Q340 WeakPolarHBondContact O-CB 3.33Å; A336-Q340 PolarHBondContact O-N 3.02Å
337	A	54.5	Low	50.2	Low	55 Å²	55	97.5 Å²	97.5	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-64.6	-41	176.3	0	0	0	0	0	112.1	L333 L334 Q340 A341	L333-A337 WeakPolarHBondContact O-CB 3.26Å; L333-A337 PolarHBondContact O-N 3.19Å; L334-A337 PolarHBondContact O-N 2.88Å; A337-Q340 PolarHBondContact O-N 3.42Å; A337-A341 WeakPolarHBondContact O-CB 3.14Å; A337-A341 PolarHBondContact O-N 3.2Å
338	A	53.1	Low	49.7	Very low	35 Å²	35	97.1 Å²	97.1	29%	0.289	57%	0.573	S	S	.	*	H	α-helix	trans	-65.1	-43.8	174.4	0	0	0	0	0	111.7	L334 S335 Q340 A341 E342	L334-A338 WeakPolarHBondContact O-CB 3.08Å; L334-A338 PolarHBondContact O-N 3.38Å; S335-A338 PolarHBondContact O-N 3.1Å; A338-Q340 VanDerWaalsContact C-N 3.28Å; A338-Q340 PolarHBondContact O-N 3.46Å; A338-A341 PolarHBondContact O-N 3.45Å; A338-E342 PolarHBondContact O-N 3.39Å
339	A	57.8	Low	49.1	Very low	49 Å²	49	102 Å²	102	41%	0.405	59%	0.585	S	S	.	*	H	α-helix	trans	-63.8	-33.3	175.2	0	0	0	0	0	112.5	S335 A336 S343	S335-A339 VanDerWaalsContact O-CB 3.25Å; S335-A339 WeakPolarHBondContact O-CB 3.41Å; S335-A339 PolarHBondContact O-N 3.26Å; A336-A339 PolarHBondContact O-N 3.01Å; A339-S343 WeakPolarHBondContact O-CB 3.32Å; A339-S343 PolarHBondContact O-N 3.05Å; A339-S343 PolarHBondContact O-OG 3.1Å; A339-S343 VanDerWaalsContact O-OG 3.05Å
340	Q	54.3	Low	48.3	Very low	147 Å²	147	102.2 Å²	102.2	69%	0.687	59%	0.586	S	S	*	*	H	α-helix	trans	-73.5	-36	176.1	-160.7	167.1	4.5	0	0	111.7	A336 A337 A338 S344	A336-Q340 VanDerWaalsContact O-CB 3.26Å; A336-Q340 WeakPolarHBondContact O-CB 3.33Å; A336-Q340 PolarHBondContact O-N 3.02Å; A337-Q340 PolarHBondContact O-N 3.42Å; A338-Q340 VanDerWaalsContact C-N 3.28Å; A338-Q340 PolarHBondContact O-N 3.46Å; Q340-S344 PolarHBondContact O-N 3.25Å; Q340-S344 VanDerWaalsContact O-N 3.09Å; Q340-S344 PolarHBondContact O-OG 3.35Å
341	A	51.2	Low	47.5	Very low	58 Å²	58	106.1 Å²	106.1	48%	0.479	60%	0.604	S	S	.	*	H	α-helix	trans	-68.3	-36.2	171.5	0	0	0	0	0	112.3	A337 A338 S344 R345	A337-A341 WeakPolarHBondContact O-CB 3.14Å; A337-A341 PolarHBondContact O-N 3.2Å; A338-A341 PolarHBondContact O-N 3.45Å; A341-S344 WeakPolarHBondContact CA-OG 3.39Å; A341-S344 PolarHBondContact O-OG 2.93Å; A341-S344 VanDerWaalsContact O-OG 3.05Å; A341-R345 PolarHBondContact O-N 3.38Å
342	E	51.2	Low	46.5	Very low	139 Å²	139	109.9 Å²	109.9	65%	0.65	62%	0.621	S	S	*	*	H	α-helix	trans	-72	-39.4	173.7	-80	-177.4	158.7	0	0	112.2	A338 S344 R345	A338-E342 PolarHBondContact O-N 3.39Å; E342-S344 VanDerWaalsContact C-N 3.27Å; E342-S344 PolarHBondContact O-N 3.27Å; E342-R345 VanDerWaalsContact O-CB 3.32Å; E342-R345 WeakPolarHBondContact O-CB 3.27Å; E342-R345 PolarHBondContact O-N 3.36Å
343	S	53.3	Low	45.6	Very low	74 Å²	74	109.9 Å²	109.9	52%	0.517	62%	0.62	S	S	.	*	H	α-helix	trans	-64.1	-31.9	175.5	-72	0	0	0	0	112.5	A339 R345 L346	A339-S343 WeakPolarHBondContact O-CB 3.32Å; A339-S343 PolarHBondContact O-N 3.05Å; A339-S343 PolarHBondContact O-OG 3.1Å; A339-S343 VanDerWaalsContact O-OG 3.05Å; S343-R345 PolarHBondContact O-N 3.28Å; S343-L346 PolarHBondContact O-N 3.14Å
344	S	51.9	Low	44.4	Very low	86 Å²	86	111.2 Å²	111.2	60%	0.601	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-12	173.3	34.1	0	0	0	0	113.5	Q340 A341 E342	Q340-S344 PolarHBondContact O-N 3.25Å; Q340-S344 VanDerWaalsContact O-N 3.09Å; Q340-S344 PolarHBondContact O-OG 3.35Å; A341-S344 WeakPolarHBondContact CA-OG 3.39Å; A341-S344 PolarHBondContact O-OG 2.93Å; A341-S344 VanDerWaalsContact O-OG 3.05Å; E342-S344 VanDerWaalsContact C-N 3.27Å; E342-S344 PolarHBondContact O-N 3.27Å
345	R	47.9	Very low	43.4	Very low	224 Å²	224	116.4 Å²	116.4	85%	0.845	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-14	170.5	-149.3	177.3	-176.3	163.8	3	113.1	A341 E342 S343	A341-R345 PolarHBondContact O-N 3.38Å; E342-R345 VanDerWaalsContact O-CB 3.32Å; E342-R345 WeakPolarHBondContact O-CB 3.27Å; E342-R345 PolarHBondContact O-N 3.36Å; S343-R345 PolarHBondContact O-N 3.28Å
346	L	41.4	Very low	42.1	Very low	138 Å²	138	118 Å²	118	72%	0.723	66%	0.66	S	S	*	*	S	Bend	trans	-97	2.2	-175	-79.6	169.7	0	0	0	115.1	S343 T348	S343-L346 PolarHBondContact O-N 3.14Å; L346-T348 PolarHBondContact O-N 3.4Å
347	L	35.4	Very low	40.9	Very low	155 Å²	155	122.5 Å²	122.5	81%	0.812	68%	0.677	S	S	*	*			trans	-95.7	91.8	170.5	-66.8	173.1	0	0	0	109
348	T	34.3	Very low	39.6	Very low	126 Å²	126	128 Å²	128	77%	0.773	69%	0.694	S	S	*	*			trans	-55.8	135.7	165.2	45.9	0	0	0	0	110.1	L346 D350	L346-T348 PolarHBondContact O-N 3.4Å; T348-D350 PolarHBondContact O-N 2.77Å
349	D	33.7	Very low	38.5	Very low	163 Å²	163	132.9 Å²	132.9	87%	0.872	72%	0.715	S	S	*	*	S	Bend	trans	-38.8	99.2	169	-76.3	-42.1	0	0	0	112
350	D	33.2	Very low	37.4	Very low	149 Å²	149	138.4 Å²	138.4	80%	0.797	74%	0.738	S	S	*	*			trans	-174.3	91.8	153.6	-91.2	-25.6	0	0	0	107.2	T348	T348-D350 PolarHBondContact O-N 2.77Å
351	D	32.1	Very low	36.2	Very low	146 Å²	146	136.8 Å²	136.8	78%	0.781	74%	0.742	S	S	*	*			trans	162.9	85.1	142.3	-81.1	-23	0	0	0	110	I353	D351-I353 PolarHBondContact O-N 3.03Å
352	V	28.3	Very low	35.7	Very low	140 Å²	140	139.4 Å²	139.4	85%	0.848	76%	0.757	S	S	*	*			trans	-70	94.2	162.8	177.4	0	0	0	0	107.6
353	I	31.6	Very low	34.9	Very low	119 Å²	119	137.8 Å²	137.8	61%	0.61	76%	0.761	S	S	*	*			trans	-123.6	105.5	164.5	-56.8	-177.6	0	0	0	109	D351 H355	D351-I353 PolarHBondContact O-N 3.03Å; I353-H355 PolarHBondContact O-N 2.74Å
354	L	26.4	Very low	34.1	Very low	156 Å²	156	141 Å²	141	82%	0.817	77%	0.773	S	S	*	*			trans	-67.1	110.8	171.2	-66	168.9	0	0	0	109.7
355	H	31.1	Very low	33.7	Very low	165 Å²	165	142.5 Å²	142.5	76%	0.764	78%	0.783	S	S	*	*			trans	-122.3	96.9	157.8	-78.3	-55.5	0	0	0	109.5	I353	I353-H355 PolarHBondContact O-N 2.74Å
356	S	26.2	Very low	33.4	Very low	104 Å²	104	138.1 Å²	138.1	73%	0.727	78%	0.775	S	S	*	*			trans	-60.2	129.1	151.6	50.6	0	0	0	0	109.4
357	N	30.8	Very low	33.7	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	77%	0.767	S	S	*	*			trans	-177.3	99.2	151.5	-79.9	-22.4	0	0	0	104.3
358	E	27.5	Very low	34.4	Very low	172 Å²	172	135.4 Å²	135.4	80%	0.804	76%	0.761	S	S	*	*				63.3	123.5	93	-70.5	-168.1	174.8	0	0	113.3
359	D	29.5	Very low	35.4	Very low	136 Å²	136	132.8 Å²	132.8	73%	0.727	75%	0.749	S	S	*	*			trans	76.8	100	160.5	-52.5	-23.1	0	0	0	118.5
360	D	33.9	Very low	36.2	Very low	166 Å²	166	133.9 Å²	133.9	89%	0.888	74%	0.74	S	S	*	*				-174.6	142.3	95.9	-102.7	-31.8	0	0	0	114
361	S	30.1	Very low	36.9	Very low	112 Å²	112	131.7 Å²	131.7	78%	0.783	73%	0.728	S	S	*	*			trans	-54.6	128	175.9	167.5	0	0	0	0	114.9
362	S	39.6	Very low	37.4	Very low	113 Å²	113	132.3 Å²	132.3	79%	0.79	72%	0.723	S	S	*	*				-179.4	136.5	127.5	55.1	0	0	0	0	113.1
363	S	34.8	Very low	38.4	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	70%	0.702	S	S	*	*	S	Bend	trans	23	133.7	158.7	-132.6	0	0	0	0	122.1
364	D	35.9	Very low	39.1	Very low	141 Å²	141	128 Å²	128	75%	0.754	70%	0.701	S	S	*	*			trans	86.7	35.6	155.4	-61	11	0	0	0	118.6	I366	D364-I366 PolarHBondContact O-N 3.15Å
365	S	43	Very low	40.1	Very low	118 Å²	118	129.9 Å²	129.9	83%	0.825	70%	0.699	S	S	*	*			trans	-68.3	92.2	164.2	178.2	0	0	0	0	111.4	D367	S365-D367 PolarHBondContact O-N 3.13Å
366	I	42.8	Very low	40.9	Very low	132 Å²	132	128.8 Å²	128.8	68%	0.677	70%	0.696	S	S	*	*			trans	-66.2	114.2	160.9	-72.7	162.8	0	0	0	107.7	D364 L368 I371	D364-I366 PolarHBondContact O-N 3.15Å; I366-L368 PolarHBondContact O-N 2.81Å; I366-I371 HydrophobicContact CG2-CD1 4.04Å
367	D	47.7	Very low	41.7	Very low	103 Å²	103	128.4 Å²	128.4	55%	0.551	69%	0.693	S	S	*	*			trans	-68.2	97.3	-175.6	-154.5	-21.4	0	0	0	110.5	S365 S369 R370	S365-D367 PolarHBondContact O-N 3.13Å; D367-S369 PolarHBondContact O-N 3.32Å; D367-S369 WeakPolarHBondContact OD1-CB 3.5Å; D367-S369 PolarHBondContact OD1-OG 2.88Å; D367-R370 PolarHBondContact O-N 3.49Å
368	L	49.9	Very low	41.9	Very low	132 Å²	132	128.4 Å²	128.4	69%	0.691	69%	0.692	S	S	*	*	H	α-helix	trans	-56.9	-20.6	179.4	-75.9	167.9	0	0	0	112.5	I366 R370 I371 K372	I366-L368 PolarHBondContact O-N 2.81Å; L368-R370 VanDerWaalsContact C-N 3.27Å; L368-R370 PolarHBondContact O-N 2.56Å; L368-I371 PolarHBondContact O-N 2.76Å; L368-K372 WeakPolarHBondContact O-CB 3.45Å; L368-K372 PolarHBondContact O-N 3.01Å; L368-K372 VanDerWaalsContact O-N 3.1Å
369	S	56.4	Low	42.3	Very low	72 Å²	72	127.1 Å²	127.1	50%	0.503	69%	0.691	S	S	.	*	H	α-helix	trans	-62.2	-33.5	175	68.1	0	0	0	0	112.5	D367 S373	D367-S369 PolarHBondContact O-N 3.32Å; D367-S369 WeakPolarHBondContact OD1-CB 3.5Å; D367-S369 PolarHBondContact OD1-OG 2.88Å; S369-S373 PolarHBondContact O-N 2.84Å; S369-S373 PolarHBondContact O-OG 2.84Å
370	R	49.4	Very low	42.6	Very low	185 Å²	185	128.2 Å²	128.2	70%	0.698	70%	0.697	S	S	*	*	H	α-helix	trans	-76.3	-36.1	-178.5	-147.3	175.3	93.1	-179.9	5.2	113	D367 L368 S373 D374	D367-R370 PolarHBondContact O-N 3.49Å; L368-R370 VanDerWaalsContact C-N 3.27Å; L368-R370 PolarHBondContact O-N 2.56Å; R370-S373 PolarHBondContact O-OG 3.36Å; R370-D374 PolarHBondContact O-N 2.81Å
371	I	49	Very low	42.7	Very low	103 Å²	103	129.4 Å²	129.4	53%	0.528	70%	0.697	S	S	.	*	H	α-helix	trans	-69.9	-38.9	174.9	-61.1	172.6	0	0	0	109.9	I366 L368 D374 Y375	I366-I371 HydrophobicContact CG2-CD1 4.04Å; L368-I371 PolarHBondContact O-N 2.76Å; I371-D374 PolarHBondContact O-N 3.1Å; I371-Y375 WeakPolarHBondContact O-CB 3.49Å; I371-Y375 PolarHBondContact O-N 2.88Å; I371-Y375 VanDerWaalsContact O-N 3.1Å
372	K	41.9	Very low	42.7	Very low	159 Å²	159	128.9 Å²	128.9	69%	0.691	70%	0.699	S	S	*	*	H	α-helix	trans	-69.1	-33.8	178.7	-134	174.1	-175	176.4	0	112.3	L368 M376	L368-K372 WeakPolarHBondContact O-CB 3.45Å; L368-K372 PolarHBondContact O-N 3.01Å; L368-K372 VanDerWaalsContact O-N 3.1Å; K372-M376 WeakPolarHBondContact O-CB 3.37Å; K372-M376 WeakPolarHBondContact O-CG 3.43Å; K372-M376 PolarHBondContact O-N 2.86Å
373	S	49.4	Very low	42.3	Very low	57 Å²	57	132 Å²	132	40%	0.399	70%	0.701	S	S	.	*	H	α-helix	trans	-72.2	-37.1	175.5	59.7	0	0	0	0	113.1	S369 R370 S377	S369-S373 PolarHBondContact O-N 2.84Å; S369-S373 PolarHBondContact O-OG 2.84Å; R370-S373 PolarHBondContact O-OG 3.36Å; S373-S377 WeakPolarHBondContact O-CB 3.44Å; S373-S377 PolarHBondContact O-N 3.01Å; S373-S377 PolarHBondContact O-OG 3.45Å
374	D	45.5	Very low	42	Very low	111 Å²	111	136.2 Å²	136.2	59%	0.594	71%	0.71	S	S	*	*	H	α-helix	trans	-71.5	-35.6	178.5	-78.8	-6.9	0	0	0	111.9	R370 I371	R370-D374 PolarHBondContact O-N 2.81Å; I371-D374 PolarHBondContact O-N 3.1Å
375	Y	47.3	Very low	41.8	Very low	196 Å²	196	139.2 Å²	139.2	77%	0.769	72%	0.716	S	S	*	*	H	α-helix	trans	-76.3	-29.2	178.5	-161.3	-95.2	0	0	0	113.3	I371	I371-Y375 WeakPolarHBondContact O-CB 3.49Å; I371-Y375 PolarHBondContact O-N 2.88Å; I371-Y375 VanDerWaalsContact O-N 3.1Å
376	M	49.2	Very low	41.1	Very low	143 Å²	143	142.7 Å²	142.7	70%	0.704	72%	0.719	S	S	*	*	H	α-helix	trans	-87.7	-9.8	-180	-65.1	-71.6	-73.9	0	0	113.7	K372	K372-M376 WeakPolarHBondContact O-CB 3.37Å; K372-M376 WeakPolarHBondContact O-CG 3.43Å; K372-M376 PolarHBondContact O-N 2.86Å
377	S	42.5	Very low	40.3	Very low	96 Å²	96	140.8 Å²	140.8	67%	0.671	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	2.9	179.1	-61.8	0	0	0	0	114.3	S373	S373-S377 WeakPolarHBondContact O-CB 3.44Å; S373-S377 PolarHBondContact O-N 3.01Å; S373-S377 PolarHBondContact O-OG 3.45Å
378	L	34.9	Very low	39.4	Very low	143 Å²	143	142 Å²	142	75%	0.749	74%	0.736	S	S	*	*	S	Bend	trans	-106.2	42.7	179.1	-70.1	173.3	0	0	0	112.5
379	N	34.7	Very low	38.4	Very low	146 Å²	146	141.5 Å²	141.5	78%	0.781	74%	0.739	S	S	*	*	S	Bend	trans	-142.8	6.6	176.8	-110.6	4.1	0	0	0	117.8
380	D	36.7	Very low	36.9	Very low	158 Å²	158	147.6 Å²	147.6	85%	0.845	76%	0.76	S	S	*	*			trans	-119.9	62.4	180	-70.5	-24.3	0	0	0	112.4
381	E	35.4	Very low	35.9	Very low	191 Å²	191	144.7 Å²	144.7	89%	0.893	76%	0.762	S	S	*	*			trans	-136.3	69.3	147.4	-75.6	-149.7	178.7	0	0	109.4	E383	E381-E383 PolarHBondContact O-N 3.15Å
382	A	30.1	Very low	34.8	Very low	101 Å²	101	148.1 Å²	148.1	84%	0.835	78%	0.776	S	S	*	*			trans	-85.7	84.3	160.8	0	0	0	0	0	108.6
383	E	31.4	Very low	34.1	Very low	178 Å²	178	148.7 Å²	148.7	83%	0.832	79%	0.785	S	S	*	*			trans	-101	113.4	161.4	-77.4	-161.4	164.7	0	0	110.6	E381 K385	E381-E383 PolarHBondContact O-N 3.15Å; E383-K385 PolarHBondContact O-N 3.39Å
384	E	28.3	Very low	33.2	Very low	195 Å²	195	154.4 Å²	154.4	91%	0.911	80%	0.803	S	S	*	*			trans	-33.5	113.2	164.8	-78.5	175	137	0	0	113.4
385	K	31.8	Very low	32.3	Very low	204 Å²	204	153.9 Å²	153.9	89%	0.887	81%	0.814	S	S	*	*			trans	-119.7	124	152.9	-75.2	-175.4	-179.4	172	0	109.7	E383	E383-K385 PolarHBondContact O-N 3.39Å
386	Q	28.5	Very low	31.3	Very low	191 Å²	191	151 Å²	151	89%	0.893	82%	0.816	S	S	*	*			trans	-54.5	148.2	-167.8	-71.2	163.5	-18.5	0	0	113.8
387	A	27.2	Very low	30.3	Very low	92 Å²	92	149.9 Å²	149.9	76%	0.76	82%	0.817	S	S	*	*			trans	-50.3	133.3	179.8	0	0	0	0	0	112.6	T389	A387-T389 PolarHBondContact O-N 3.02Å
388	P	28.2	Very low	29.6	Very low	128 Å²	128	150.5 Å²	150.5	83%	0.831	82%	0.819	S	S	*	*			trans	-78.5	113.6	-177.6	30	-28.1	0	0	0	109.6
389	T	28.4	Very low	29.4	Very low	123 Å²	123	151 Å²	151	76%	0.755	82%	0.821	S	S	*	*			trans	-62.1	131.2	162.6	40.7	0	0	0	0	109.9	A387 V391	A387-T389 PolarHBondContact O-N 3.02Å; T389-V391 PolarHBondContact O-N 3.17Å
390	E	24.3	Very low	29.3	Very low	200 Å²	200	151.1 Å²	151.1	94%	0.935	82%	0.82	S	S	*	*			trans	-48.1	113.2	172.6	-65.6	172.5	153.2	0	0	111
391	V	29.8	Very low	29	Very low	123 Å²	123	151.5 Å²	151.5	75%	0.745	82%	0.817	S	S	*	*			trans	-123.1	120.3	168.6	-179.6	0	0	0	0	108.1	T389 I393	T389-V391 PolarHBondContact O-N 3.17Å; V391-I393 PolarHBondContact O-N 2.98Å
392	E	25.6	Very low	28.6	Very low	175 Å²	175	148.8 Å²	148.8	82%	0.818	81%	0.809	S	S	*	*			trans	-50.9	125.2	178.2	-68.2	176.4	140.8	0	0	112.3	K394	E392-K394 PolarHBondContact O-N 2.88Å
393	I	28	Very low	28.9	Very low	171 Å²	171	151.2 Å²	151.2	88%	0.877	81%	0.807	S	S	*	*			trans	-75	93.4	178.1	-58.1	165.9	0	0	0	108	V391	V391-I393 PolarHBondContact O-N 2.98Å
394	K	29.2	Very low	28.9	Very low	178 Å²	178	150.3 Å²	150.3	77%	0.774	81%	0.807	S	S	*	*			trans	-78.3	124.8	165.1	-82	-178.6	177.1	173.3	0	109.4	E392 T396	E392-K394 PolarHBondContact O-N 2.88Å; K394-T396 PolarHBondContact O-N 2.94Å
395	A	25.9	Very low	28.8	Very low	100 Å²	100	146.1 Å²	146.1	83%	0.826	80%	0.798	S	S	*	*			trans	-53.4	110.4	-179.1	0	0	0	0	0	112.7
396	T	27	Very low	28.7	Very low	134 Å²	134	141.9 Å²	141.9	82%	0.822	79%	0.791	S	S	*	*			trans	-95.4	115.4	170.8	-39.4	0	0	0	0	108.6	K394	K394-T396 PolarHBondContact O-N 2.94Å
397	V	28.3	Very low	28.9	Very low	120 Å²	120	141.6 Å²	141.6	73%	0.727	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-59.3	133.3	176.4	177.6	0	0	0	0	109.5	I399	V397-I399 PolarHBondContact O-N 2.95Å
398	P	28.7	Very low	29.2	Very low	110 Å²	110	146.7 Å²	146.7	71%	0.714	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-71.8	125.1	-175.9	23.8	-22.4	0	0	0	110	I400	P398-I400 PolarHBondContact O-N 3Å
399	I	30.2	Very low	29.5	Very low	153 Å²	153	147.1 Å²	147.1	79%	0.785	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-70.7	120.8	173.9	-62.7	166	0	0	0	107.2	V397 E401	V397-I399 PolarHBondContact O-N 2.95Å; I399-E401 PolarHBondContact O-N 2.78Å
400	I	33	Very low	29.8	Very low	149 Å²	149	148.8 Å²	148.8	76%	0.764	79%	0.791	S	S	*	*			trans	-77.6	105.5	178	-61.4	166.7	0	0	0	106.7	P398	P398-I400 PolarHBondContact O-N 3Å
401	E	30.6	Very low	30.2	Very low	165 Å²	165	144.6 Å²	144.6	77%	0.771	78%	0.779	S	S	*	*			trans	-83.5	117.1	172.3	-75.6	-174	164.7	0	0	110.3	I399 N403	I399-E401 PolarHBondContact O-N 2.78Å; E401-N403 PolarHBondContact O-N 2.77Å
402	D	27.5	Very low	30.6	Very low	135 Å²	135	143.8 Å²	143.8	72%	0.722	78%	0.775	S	S	*	*			trans	-67.2	83.8	-179	-70.9	-43.7	0	0	0	112.5
403	N	34.7	Very low	31.4	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	77%	0.774	S	S	*	*			trans	-97.9	87.1	163.1	-84.1	-44.2	0	0	0	110.2	E401 C405	E401-N403 PolarHBondContact O-N 2.77Å; N403-C405 VanDerWaalsContact C-N 3.33Å; N403-C405 PolarHBondContact O-N 2.78Å
404	I	32.1	Very low	32.4	Very low	160 Å²	160	138.7 Å²	138.7	82%	0.821	76%	0.756	S	S	*	*			trans	-69.4	86.4	173.5	-56.7	165.9	0	0	0	108.5
405	C	25.3	Very low	34	Very low	106 Å²	106	134 Å²	134	72%	0.716	75%	0.746	S	S	*	*			trans	-105.9	126	150.2	-155.3	0	0	0	0	105.5	N403 K407	N403-C405 VanDerWaalsContact C-N 3.33Å; N403-C405 PolarHBondContact O-N 2.78Å; C405-K407 VanDerWaalsContact C-N 3.33Å; C405-K407 PolarHBondContact O-N 2.93Å
406	P	31.4	Very low	36.3	Very low	115 Å²	115	132.4 Å²	132.4	75%	0.747	72%	0.723	S	S	*	*			trans	-62.5	101.4	-177.2	25.1	-30.7	0	0	0	107.1	K408	P406-K408 PolarHBondContact O-N 2.85Å
407	K	31.7	Very low	38.8	Very low	186 Å²	186	126.6 Å²	126.6	81%	0.809	69%	0.687	S	S	*	*			trans	-51.2	112.8	163.3	-72.6	177.3	178.4	174.6	0	103.3	C405 D409	C405-K407 VanDerWaalsContact C-N 3.33Å; C405-K407 PolarHBondContact O-N 2.93Å; K407-D409 PolarHBondContact O-N 2.65Å
408	K	33.1	Very low	41.4	Very low	199 Å²	199	128.4 Å²	128.4	87%	0.865	69%	0.685	S	S	*	*			trans	-48.6	105.8	159.2	-82.9	177.8	175.6	176.3	0	102.9	P406 N410	P406-K408 PolarHBondContact O-N 2.85Å; K408-N410 PolarHBondContact O-N 2.76Å
409	D	35.1	Very low	44.3	Very low	137 Å²	137	124.3 Å²	124.3	73%	0.733	66%	0.66	S	S	*	*			trans	-45.1	127.5	172.4	-74	-45.1	0	0	0	104.1	K407 V411	K407-D409 PolarHBondContact O-N 2.65Å; D409-V411 PolarHBondContact O-N 3.49Å
410	N	34.1	Very low	47.2	Very low	157 Å²	157	119.3 Å²	119.3	84%	0.84	63%	0.633	S	S	*	*			trans	-58.8	79.7	160.2	-78.4	-26.6	0	0	0	104.1	K408 T412	K408-N410 PolarHBondContact O-N 2.76Å; N410-T412 PolarHBondContact O-N 2.86Å
411	V	33.3	Very low	50.1	Low	112 Å²	112	113 Å²	113	68%	0.679	60%	0.6	S	S	*	*			trans	-53.7	95.8	152.5	177.7	0	0	0	0	99.7	D409 T413	D409-V411 PolarHBondContact O-N 3.49Å; V411-T413 PolarHBondContact O-N 2.91Å
412	T	38.6	Very low	53.1	Low	107 Å²	107	105.9 Å²	105.9	66%	0.656	57%	0.569	S	S	*	*			trans	-45.7	101.4	164.9	23.8	0	0	0	0	102.1	N410 Q414	N410-T412 PolarHBondContact O-N 2.86Å; T412-Q414 PolarHBondContact O-N 2.91Å
413	T	41.7	Very low	56.2	Low	129 Å²	129	99.6 Å²	99.6	79%	0.791	54%	0.535	S	S	*	.			trans	-69	83	178	38.1	0	0	0	0	103.1	V411 S415	V411-T413 PolarHBondContact O-N 2.91Å; T413-S415 PolarHBondContact O-N 2.89Å
414	Q	49.8	Very low	59.1	Low	110 Å²	110	93.1 Å²	93.1	51%	0.514	50%	0.503	S	S	.	.			trans	-57.2	113.3	178	-65.8	-178.8	-11.2	0	0	104	T412 L416 V641 V642	T412-Q414 PolarHBondContact O-N 2.91Å; Q414-L416 PolarHBondContact O-N 3.44Å; Q414-V641 HydrophobicContact CB-CG1 4.28Å; Q414-V642 HydrophobicContact CB-CB 4.15Å; Q414-V642 HydrophobicContact CB-CG2 3.5Å; Q414-V642 VanDerWaalsContact CB-CG2 3.5Å; Q414-V642 WeakPolarHBondContact O-CG2 3.4Å
415	S	62.3	Low	61.9	Low	79 Å²	79	85.8 Å²	85.8	55%	0.552	47%	0.466	S	S	*	.			trans	-71.6	112	-171.1	71.4	0	0	0	0	111.6	T413 V642	T413-S415 PolarHBondContact O-N 2.89Å; S415-V642 VanDerWaalsContact N-CG2 3.26Å; S415-V642 WeakPolarHBondContact O-CG2 3.38Å
416	L	73.2	Confident	64.8	Low	67 Å²	67	82.6 Å²	82.6	35%	0.351	44%	0.444	S	S	.	.			trans	-40.3	140.4	179.2	-60.7	171.3	0	0	0	112.8	Q414 K418 G619 N640	Q414-L416 PolarHBondContact O-N 3.44Å; L416-K418 PolarHBondContact O-N 2.91Å; L416-G619 WeakPolarHBondContact CD1-O 3.21Å; L416-G619 VanDerWaalsContact CD2-O 3.28Å; L416-G619 WeakPolarHBondContact CD2-O 3.26Å; L416-N640 WeakPolarHBondContact CD2-O 3.46Å
417	Q	80.6	Confident	67.2	Low	12 Å²	12	81 Å²	81	6%	0.056	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-64.8	122.5	174.4	178.6	166.7	-25	0	0	109.3	V623 L697	Q417-V623 HydrophobicContact CG-CG1 4.11Å; Q417-L697 PolarHBondContact NE2-O 3.38Å
418	K	83.7	Confident	69.1	Low	158 Å²	158	72.7 Å²	72.7	69%	0.687	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-65.6	149.6	177.9	-66.5	-177.1	179.6	179.5	0	111.1	L416	L416-K418 PolarHBondContact O-N 2.91Å
419	A	88.4	Confident	71.2	Confident	24 Å²	24	65.3 Å²	65.3	20%	0.198	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-61.3	145.1	171.4	0	0	0	0	0	111.8	D556 T622 V623	A419-D556 HydrophobicContact CB-CB 4.02Å; A419-D556 WeakPolarHBondContact CB-O 3.26Å; A419-T622 WeakPolarHBondContact CB-O 3.41Å; A419-V623 CarbonylContact C-O 3.44Å; A419-V623 WeakPolarHBondContact CA-O 3.42Å
420	F	91.9	Very high	73.1	Confident	48 Å²	48	64 Å²	64	21%	0.211	35%	0.348	C	S	.	.			trans	-148.1	157.3	174.8	74.6	-84.2	0	0	0	110.6	V623 V624 L697 T698	F420-V623 HydrophobicContact CD1-CG1 3.97Å; F420-V623 HydrophobicContact CE1-CG1 3.74Å; F420-V623 PolarHBondContact N-O 3.31Å; F420-V624 HydrophobicContact CE1-CB 4.13Å; F420-V624 HydrophobicContact CE1-CG1 4.34Å; F420-V624 HydrophobicContact CE2-CG2 4.26Å; F420-V624 HydrophobicContact CZ-CB 4.15Å; F420-V624 HydrophobicContact CZ-CG1 4.3Å; F420-V624 HydrophobicContact CZ-CG2 4.22Å; F420-L697 HydrophobicContact CE1-CG 4.43Å; F420-L697 WeakPolarHBondContact CE1-O 3.48Å; F420-L697 HydrophobicContact CZ-CD2 4.5Å; F420-L697 HydrophobicContact CZ-CG 4.21Å; F420-T698 WeakPolarHBondContact CE2-O 3.38Å
421	Q	93.2	Very high	75.5	Confident	17 Å²	17	58.9 Å²	58.9	8%	0.079	32%	0.319	C	S	.	.			trans	-95.8	129.9	172.5	-165.2	70.7	24.2	0	0	109.4	G423 A424 V435 A490 V558	Q421-G423 PolarHBondContact O-N 2.79Å; Q421-A424 HydrophobicContact CB-CB 3.81Å; Q421-A424 WeakPolarHBondContact O-CB 3.32Å; Q421-A424 PolarHBondContact O-N 2.97Å; Q421-V435 HydrophobicContact CG-CB 4.41Å; Q421-V435 HydrophobicContact CG-CG2 4.4Å; Q421-A490 WeakPolarHBondContact CG-O 3.48Å; Q421-V558 PolarHBondContact NE2-O 3.17Å; Q421-V558 PolarHBondContact OE1-O 3.07Å; Q421-V558 VanDerWaalsContact OE1-O 3.13Å
422	S	94.2	Very high	78.3	Confident	15 Å²	15	54 Å²	54	11%	0.105	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	132.8	176.7	-73.7	0	0	0	0	111	A424 F700	S422-A424 PolarHBondContact O-N 2.78Å; S422-F700 WeakPolarHBondContact CB-O 3.41Å; S422-F700 PolarHBondContact OG-N 2.9Å; S422-F700 VanDerWaalsContact OG-N 3.07Å; S422-F700 PolarHBondContact OG-O 2.8Å
423	G	92.7	Very high	81	Confident	2 Å²	2	49 Å²	49	2%	0.021	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	8.3	-176.5	0	0	0	0	0	114.4	Q421 W436 F754	Q421-G423 PolarHBondContact O-N 2.79Å; G423-W436 WeakPolarHBondContact O-CB 3.13Å; G423-W436 PolarHBondContact O-N 2.96Å; G423-W436 VanDerWaalsContact O-N 3.09Å; G423-F754 VanDerWaalsContact C-CZ 3.44Å; G423-F754 WeakPolarHBondContact O-CZ 3.49Å
424	A	94.4	Very high	83.5	Confident	16 Å²	16	43 Å²	43	13%	0.132	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-95	152.7	172.7	0	0	0	0	0	112.5	Q421 S422 F433 M434	Q421-A424 HydrophobicContact CB-CB 3.81Å; Q421-A424 WeakPolarHBondContact O-CB 3.32Å; Q421-A424 PolarHBondContact O-N 2.97Å; S422-A424 PolarHBondContact O-N 2.78Å; A424-F433 WeakPolarHBondContact CA-O 3.2Å; A424-M434 WeakPolarHBondContact CB-O 3.3Å
425	T	91.9	Very high	85.7	Confident	6 Å²	6	37.8 Å²	37.8	4%	0.037	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-99.5	151.6	170.1	50.8	0	0	0	0	110.7	R432 F433 F754 W796 P797	T425-R432 PolarHBondContact O-NH1 2.87Å; T425-R432 VanDerWaalsContact OG1-CB 3.31Å; T425-R432 WeakPolarHBondContact OG1-CB 3.38Å; T425-F433 HydrophobicContact CG2-CB 4.35Å; T425-F433 HydrophobicContact CG2-CD2 3.9Å; T425-F433 PolarHBondContact N-O 2.83Å; T425-F433 PolarHBondContact OG1-N 2.86Å; T425-F433 PolarHBondContact OG1-O 2.86Å; T425-F754 HydrophobicContact CG2-CE2 4.42Å; T425-F754 HydrophobicContact CG2-CZ 4.25Å; T425-W796 HydrophobicContact CG2-CB 3.98Å; T425-W796 HydrophobicContact CG2-CE3 4.49Å; T425-P797 HydrophobicContact CG2-CG 4.36Å
426	P	85.3	Confident	87.3	Confident	39 Å²	39	34.2 Å²	34.2	25%	0.253	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-54.9	161.9	-175.7	-27.2	33.7	0	0	0	115.2	F429 R432 W796	P426-F429 HydrophobicContact CB-CE2 4.27Å; P426-F429 HydrophobicContact CG-CE2 4.32Å; P426-F429 WeakPolarHBondContact O-CD2 3.1Å; P426-R432 WeakPolarHBondContact O-CD 3.45Å; P426-W796 VanDerWaalsContact CD-CD2 3.43Å; P426-W796 VanDerWaalsContact CD-CE2 3.42Å; P426-W796 HydrophobicContact CG-CD2 3.94Å; P426-W796 HydrophobicContact CG-CG 4.34Å; P426-W796 HydrophobicContact CG-CH2 4.25Å; P426-W796 HydrophobicContact CG-CZ2 3.52Å
427	L	81.4	Confident	88.2	Confident	82 Å²	82	32.6 Å²	32.6	43%	0.429	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	154.2	169.6	-62.2	172.1	0	0	0	110.8
428	G	73.4	Confident	88.6	Confident	10 Å²	10	35.9 Å²	35.9	10%	0.103	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	106	-27.1	176.4	0	0	0	0	0	114.1	Q137	Q137-G428 WeakPolarHBondContact O-CA 3.29Å
429	F	76.5	Confident	89	Confident	45 Å²	45	30.5 Å²	30.5	20%	0.197	15%	0.152	C	C	.	.			trans	-65.5	137.5	174	-71.9	-77.8	0	0	0	110.3	F115 P426 R432	F115-F429 HydrophobicContact CD2-CE2 4.37Å; F115-F429 HydrophobicContact CD2-CZ 4.34Å; F115-F429 HydrophobicContact CE2-CD1 4.33Å; F115-F429 AromaticContact CE2-CD2 3.92Å; F115-F429 HydrophobicContact CE2-CD2 3.92Å; F115-F429 HydrophobicContact CE2-CE1 4.28Å; F115-F429 AromaticContact CE2-CE2 3.86Å; F115-F429 HydrophobicContact CE2-CE2 3.86Å; F115-F429 HydrophobicContact CE2-CG 4.14Å; F115-F429 HydrophobicContact CE2-CZ 4.04Å; F115-F429 AromaticContact CZ-CD1 3.98Å; F115-F429 HydrophobicContact CZ-CD1 3.98Å; F115-F429 HydrophobicContact CZ-CD2 4.27Å; F115-F429 HydrophobicContact CZ-CE1 4.17Å; F115-F429 HydrophobicContact CZ-CE2 4.45Å; F115-F429 HydrophobicContact CZ-CG 4.01Å; F115-F429 HydrophobicContact CZ-CZ 4.4Å; P426-F429 HydrophobicContact CB-CE2 4.27Å; P426-F429 HydrophobicContact CG-CE2 4.32Å; P426-F429 WeakPolarHBondContact O-CD2 3.1Å; F429-R432 HydrophobicContact CB-CB 3.77Å
430	R	74.9	Confident	89.2	Confident	108 Å²	108	29.3 Å²	29.3	41%	0.408	14%	0.143	S	C	.	.	S	Bend	trans	-61.1	-47.7	176.6	-176.7	-173.8	70.2	171	1	111.2	R446	R430-R446 PolarHBondContact O-N 2.99Å
431	E	85	Confident	89.4	Confident	50 Å²	50	27.2 Å²	27.2	23%	0.234	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	128.2	169.5	58.5	-84.7	-162.9	0	0	109.9	Q444 F445 V799 F800	E431-Q444 WeakPolarHBondContact CA-O 3.16Å; E431-F445 HydrophobicContact CB-CD1 3.71Å; E431-F445 HydrophobicContact CB-CE1 3.79Å; E431-V799 HydrophobicContact CB-CB 4.1Å; E431-V799 HydrophobicContact CB-CG1 4.41Å; E431-V799 HydrophobicContact CB-CG2 3.95Å; E431-V799 HydrophobicContact CG-CB 3.71Å; E431-V799 HydrophobicContact CG-CG1 4.4Å; E431-V799 HydrophobicContact CG-CG2 3.87Å; E431-V799 WeakPolarHBondContact O-CG2 3.06Å; E431-F800 HydrophobicContact CG-CD2 4.36Å
432	R	91.3	Very high	89.5	Confident	9 Å²	9	26.4 Å²	26.4	3%	0.034	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	156.8	-174.7	83.7	171.1	-178.7	93.7	12.4	112.8	T425 P426 F429 T443 Q444 S488	T425-R432 PolarHBondContact O-NH1 2.87Å; T425-R432 VanDerWaalsContact OG1-CB 3.31Å; T425-R432 WeakPolarHBondContact OG1-CB 3.38Å; P426-R432 WeakPolarHBondContact O-CD 3.45Å; F429-R432 HydrophobicContact CB-CB 3.77Å; R432-T443 CarbonylContact O-C 3.58Å; R432-T443 VanDerWaalsContact O-CA 3.32Å; R432-T443 WeakPolarHBondContact O-CA 3.39Å; R432-Q444 HydrophobicContact CG-CB 4.13Å; R432-Q444 VanDerWaalsContact CZ-OE1 3.28Å; R432-Q444 PolarHBondContact N-O 3.28Å; R432-Q444 PolarHBondContact O-N 2.94Å; R432-S488 PolarHBondContact NH2-O 2.66Å
433	F	95.1	Very high	89.6	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.018	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.6	170.3	-57.1	-62.2	0	0	0	110.3	A424 T425 W436 I441 T443 P797 V799 P803	A424-F433 WeakPolarHBondContact CA-O 3.2Å; T425-F433 HydrophobicContact CG2-CB 4.35Å; T425-F433 HydrophobicContact CG2-CD2 3.9Å; T425-F433 PolarHBondContact N-O 2.83Å; T425-F433 PolarHBondContact OG1-N 2.86Å; T425-F433 PolarHBondContact OG1-O 2.86Å; F433-W436 AromaticContact CD1-CE3 3.88Å; F433-W436 HydrophobicContact CD1-CE3 3.88Å; F433-W436 HydrophobicContact CD1-CZ3 4.28Å; F433-W436 HydrophobicContact CD2-CE3 4.22Å; F433-W436 AromaticContact CE1-CE3 3.73Å; F433-W436 HydrophobicContact CE1-CE3 3.73Å; F433-W436 AromaticContact CE1-CZ3 3.65Å; F433-W436 HydrophobicContact CE1-CZ3 3.65Å; F433-W436 HydrophobicContact CE2-CE3 4.08Å; F433-W436 HydrophobicContact CE2-CZ3 4.01Å; F433-W436 HydrophobicContact CG-CE3 4.13Å; F433-W436 AromaticContact CZ-CE3 3.84Å; F433-W436 HydrophobicContact CZ-CE3 3.84Å; F433-W436 AromaticContact CZ-CZ3 3.49Å; F433-W436 HydrophobicContact CZ-CZ3 3.49Å; F433-W436 VanDerWaalsContact CZ-CZ3 3.49Å; F433-I441 HydrophobicContact CD1-CG2 3.35Å; F433-I441 HydrophobicContact CE1-CG2 3.57Å; F433-I441 HydrophobicContact CG-CG2 4.47Å; F433-T443 HydrophobicContact CD1-CG2 3.42Å; F433-T443 VanDerWaalsContact CD1-CG2 3.42Å; F433-T443 HydrophobicContact CE1-CG2 3.45Å; F433-T443 VanDerWaalsContact CE1-CG2 3.45Å; F433-P797 HydrophobicContact CD2-CG 4.08Å; F433-P797 HydrophobicContact CE2-CB 4.4Å; F433-P797 HydrophobicContact CE2-CG 3.89Å; F433-V799 HydrophobicContact CD2-CG2 4.45Å; F433-V799 HydrophobicContact CE1-CG1 4.31Å; F433-V799 HydrophobicContact CE1-CG2 4.19Å; F433-V799 HydrophobicContact CE2-CG2 4.04Å; F433-V799 HydrophobicContact CZ-CB 4.18Å; F433-V799 HydrophobicContact CZ-CG1 4.3Å; F433-V799 HydrophobicContact CZ-CG2 3.9Å; F433-P803 HydrophobicContact CE2-CG 4.16Å; F433-P803 HydrophobicContact CZ-CG 4.01Å
434	M	94.8	Very high	89.6	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-34.8	169.5	-63.9	178.7	73.7	0	0	111.5	A424 V442 Q444 I466 M489 A490 L499	A424-M434 WeakPolarHBondContact CB-O 3.3Å; M434-V442 HydrophobicContact CB-CB 4.26Å; M434-V442 HydrophobicContact CB-CG1 4.07Å; M434-V442 HydrophobicContact CG-CG1 4.42Å; M434-V442 PolarHBondContact N-O 3Å; M434-V442 HydrophobicContact SD-CG1 3.91Å; M434-Q444 HydrophobicContact CG-CB 3.74Å; M434-Q444 HydrophobicContact SD-CB 3.83Å; M434-I466 HydrophobicContact CE-CD1 4.27Å; M434-I466 HydrophobicContact SD-CD1 3.92Å; M434-I466 HydrophobicContact SD-CG1 3.91Å; M434-I466 HydrophobicContact SD-CG2 4.33Å; M434-M489 VanDerWaalsContact CE-C 3.48Å; M434-M489 VanDerWaalsContact CE-O 3.29Å; M434-M489 WeakPolarHBondContact CE-O 3.11Å; M434-A490 HydrophobicContact CB-CB 3.79Å; M434-A490 HydrophobicContact CE-CB 3.89Å; M434-A490 HydrophobicContact SD-CB 4.38Å; M434-L499 HydrophobicContact CE-CD2 4.23Å
435	V	96.1	Very high	89.3	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.012	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	142.8	169.2	62.3	0	0	0	0	108.8	Q421 N437 V442 A490 L492	Q421-V435 HydrophobicContact CG-CB 4.41Å; Q421-V435 HydrophobicContact CG-CG2 4.4Å; V435-N437 HydrophobicContact CG2-CB 4.36Å; V435-V442 HydrophobicContact CG1-CB 3.8Å; V435-V442 HydrophobicContact CG1-CG2 3.57Å; V435-V442 PolarHBondContact O-N 2.9Å; V435-A490 HydrophobicContact CG1-CB 4.06Å; V435-L492 HydrophobicContact CG1-CB 4.4Å
436	W	95.6	Very high	88.7	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.015	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	112.1	167.4	-171.4	-44.8	0	0	0	107.4	G423 F433 I441 H471 V756 I789 P803 V805	G423-W436 WeakPolarHBondContact O-CB 3.13Å; G423-W436 PolarHBondContact O-N 2.96Å; G423-W436 VanDerWaalsContact O-N 3.09Å; F433-W436 AromaticContact CD1-CE3 3.88Å; F433-W436 HydrophobicContact CD1-CE3 3.88Å; F433-W436 HydrophobicContact CD1-CZ3 4.28Å; F433-W436 HydrophobicContact CD2-CE3 4.22Å; F433-W436 AromaticContact CE1-CE3 3.73Å; F433-W436 HydrophobicContact CE1-CE3 3.73Å; F433-W436 AromaticContact CE1-CZ3 3.65Å; F433-W436 HydrophobicContact CE1-CZ3 3.65Å; F433-W436 HydrophobicContact CE2-CE3 4.08Å; F433-W436 HydrophobicContact CE2-CZ3 4.01Å; F433-W436 HydrophobicContact CG-CE3 4.13Å; F433-W436 AromaticContact CZ-CE3 3.84Å; F433-W436 HydrophobicContact CZ-CE3 3.84Å; F433-W436 AromaticContact CZ-CZ3 3.49Å; F433-W436 HydrophobicContact CZ-CZ3 3.49Å; F433-W436 VanDerWaalsContact CZ-CZ3 3.49Å; W436-I441 HydrophobicContact CD2-CD1 3.96Å; W436-I441 HydrophobicContact CD2-CG1 3.73Å; W436-I441 HydrophobicContact CD2-CG2 4.28Å; W436-I441 HydrophobicContact CE3-CD1 3.86Å; W436-I441 HydrophobicContact CE3-CG1 3.96Å; W436-I441 HydrophobicContact CE3-CG2 3.86Å; W436-I441 HydrophobicContact CG-CG1 4.18Å; W436-I441 HydrophobicContact CH2-CD1 3.44Å; W436-I441 VanDerWaalsContact CH2-CD1 3.44Å; W436-I441 HydrophobicContact CH2-CG1 4.32Å; W436-I441 HydrophobicContact CZ2-CD1 3.53Å; W436-I441 HydrophobicContact CZ2-CG1 4.1Å; W436-I441 HydrophobicContact CZ3-CD1 3.62Å; W436-I441 HydrophobicContact CZ3-CG1 4.25Å; W436-I441 HydrophobicContact CZ3-CG2 4.33Å; W436-H471 AromaticContact CE2-CE1 3.9Å; W436-H471 AromaticContact NE1-CE1 3.46Å; W436-H471 PolarHBondContact NE1-CE1 3.01Å; W436-H471 AromaticContact NE1-NE2 3.62Å; W436-V756 HydrophobicContact CB-CG1 4.11Å; W436-V756 HydrophobicContact CD2-CG1 4.02Å; W436-V756 HydrophobicContact CG-CB 4.07Å; W436-V756 HydrophobicContact CG-CG1 3.64Å; W436-I789 HydrophobicContact CD2-CD1 4.39Å; W436-I789 HydrophobicContact CE3-CD1 4.14Å; W436-I789 HydrophobicContact CH2-CD1 4.03Å; W436-I789 HydrophobicContact CZ2-CD1 4.29Å; W436-I789 HydrophobicContact CZ3-CD1 3.95Å; W436-P803 HydrophobicContact CH2-CB 4.15Å; W436-P803 HydrophobicContact CH2-CG 4.32Å; W436-P803 HydrophobicContact CZ3-CB 4.32Å; W436-P803 HydrophobicContact CZ3-CG 4.06Å; W436-V805 HydrophobicContact CH2-CG2 4.43Å; W436-V805 HydrophobicContact CZ2-CG2 3.6Å
437	N	93.1	Very high	87.8	Confident	32 Å²	32	33.1 Å²	33.1	17%	0.171	15%	0.153	C	C	.	.			trans	-131.3	-164.3	179.8	70.6	18.5	0	0	0	110.7	V435 I439 G440 H471 L492	V435-N437 HydrophobicContact CG2-CB 4.36Å; N437-I439 VanDerWaalsContact C-N 3.3Å; N437-I439 PolarHBondContact O-N 2.83Å; N437-I439 WeakPolarHBondContact OD1-CB 3.48Å; N437-I439 PolarHBondContact OD1-N 2.79Å; N437-G440 PolarHBondContact N-O 3.05Å; N437-G440 PolarHBondContact OD1-N 3.46Å; N437-G440 VanDerWaalsContact OD1-N 3.13Å; N437-G440 PolarHBondContact OD1-O 3.27Å; N437-H471 PolarHBondContact O-CD2 3.15Å; N437-H471 PolarHBondContact O-NE2 3.39Å; N437-L492 PolarHBondContact ND2-O 2.91Å
438	R	88.2	Confident	86.5	Confident	81 Å²	81	32.3 Å²	32.3	31%	0.306	15%	0.152	S	C	.	.	S	Bend	trans	-73.6	-18.7	-178.2	-71.4	162.4	159.6	-87.7	5.6	114.2	H471 D704 V758 L759	R438-H471 PolarHBondContact O-CD2 3.2Å; R438-D704 IonicContact CZ-OD1 2.62Å; R438-D704 VanDerWaalsContact NH1-CB 3.33Å; R438-D704 VanDerWaalsContact NH2-CB 3.31Å; R438-D704 IonicContact NH2-OD1 3.48Å; R438-D704 PolarHBondContact NH2-OD1 3.07Å; R438-D704 IonicContact NH2-OD2 3.33Å; R438-V758 PolarHBondContact NH2-O 3.26Å; R438-L759 VanDerWaalsContact NH2-CD2 3.32Å
439	I	91	Very high	85.2	Confident	45 Å²	45	35.2 Å²	35.2	23%	0.231	18%	0.175	C	C	.	.	S	Bend	trans	-88.4	-45.3	-178.4	-55.5	-49.8	0	0	0	109.8	N437 F470 H471 L492 L494	N437-I439 VanDerWaalsContact C-N 3.3Å; N437-I439 PolarHBondContact O-N 2.83Å; N437-I439 WeakPolarHBondContact OD1-CB 3.48Å; N437-I439 PolarHBondContact OD1-N 2.79Å; I439-F470 HydrophobicContact CG2-CD1 3.85Å; I439-F470 HydrophobicContact CG2-CE1 4.03Å; I439-H471 PolarHBondContact O-N 2.78Å; I439-L492 HydrophobicContact CB-CD2 4.43Å; I439-L492 HydrophobicContact CB-CG 4.37Å; I439-L492 HydrophobicContact CG2-CD2 4.15Å; I439-L492 HydrophobicContact CG2-CG 4.04Å; I439-L494 HydrophobicContact CD1-CD1 4.44Å; I439-L494 HydrophobicContact CD1-CD2 4Å; I439-L494 HydrophobicContact CD1-CG 3.84Å; I439-L494 HydrophobicContact CG2-CD2 3.9Å; I439-L494 HydrophobicContact CG2-CG 4.47Å
440	G	92.9	Very high	83.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.3	-160.2	-176.4	0	0	0	0	0	113.7	N437 E469 H471	N437-G440 PolarHBondContact N-O 3.05Å; N437-G440 PolarHBondContact OD1-N 3.46Å; N437-G440 VanDerWaalsContact OD1-N 3.13Å; N437-G440 PolarHBondContact OD1-O 3.27Å; G440-E469 CarbonylContact C-O 3.44Å; G440-E469 WeakPolarHBondContact CA-O 3.17Å; G440-H471 PolarHBondContact N-CD2 2.78Å
441	I	95.8	Very high	81.8	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.6	-173.2	-48.7	171.8	0	0	0	107.3	F433 W436 T443 V468 E469	F433-I441 HydrophobicContact CD1-CG2 3.35Å; F433-I441 HydrophobicContact CE1-CG2 3.57Å; F433-I441 HydrophobicContact CG-CG2 4.47Å; W436-I441 HydrophobicContact CD2-CD1 3.96Å; W436-I441 HydrophobicContact CD2-CG1 3.73Å; W436-I441 HydrophobicContact CD2-CG2 4.28Å; W436-I441 HydrophobicContact CE3-CD1 3.86Å; W436-I441 HydrophobicContact CE3-CG1 3.96Å; W436-I441 HydrophobicContact CE3-CG2 3.86Å; W436-I441 HydrophobicContact CG-CG1 4.18Å; W436-I441 HydrophobicContact CH2-CD1 3.44Å; W436-I441 VanDerWaalsContact CH2-CD1 3.44Å; W436-I441 HydrophobicContact CH2-CG1 4.32Å; W436-I441 HydrophobicContact CZ2-CD1 3.53Å; W436-I441 HydrophobicContact CZ2-CG1 4.1Å; W436-I441 HydrophobicContact CZ3-CD1 3.62Å; W436-I441 HydrophobicContact CZ3-CG1 4.25Å; W436-I441 HydrophobicContact CZ3-CG2 4.33Å; I441-T443 HydrophobicContact CG2-CG2 4.04Å; I441-V468 WeakPolarHBondContact O-CA 3.45Å; I441-E469 PolarHBondContact N-O 3.46Å; I441-E469 PolarHBondContact O-N 2.98Å
442	V	96.5	Very high	79.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	115.8	168.8	-176.7	0	0	0	0	107.7	M434 V435 I466 E467 V468 A490 L492 L497	M434-V442 HydrophobicContact CB-CB 4.26Å; M434-V442 HydrophobicContact CB-CG1 4.07Å; M434-V442 HydrophobicContact CG-CG1 4.42Å; M434-V442 PolarHBondContact N-O 3Å; M434-V442 HydrophobicContact SD-CG1 3.91Å; V435-V442 HydrophobicContact CG1-CB 3.8Å; V435-V442 HydrophobicContact CG1-CG2 3.57Å; V435-V442 PolarHBondContact O-N 2.9Å; V442-I466 HydrophobicContact CG1-CG2 3.6Å; V442-E467 CarbonylContact C-O 3.47Å; V442-E467 WeakPolarHBondContact CA-O 3.19Å; V442-V468 HydrophobicContact CG1-CG2 4.31Å; V442-V468 HydrophobicContact CG2-CG1 4.26Å; V442-V468 HydrophobicContact CG2-CG2 4.27Å; V442-A490 HydrophobicContact CB-CB 4.28Å; V442-A490 HydrophobicContact CG1-CB 4Å; V442-A490 HydrophobicContact CG2-CB 4.42Å; V442-L492 HydrophobicContact CG2-CB 4.24Å; V442-L492 HydrophobicContact CG2-CD2 4.35Å; V442-L497 HydrophobicContact CG2-CD1 3.77Å
443	T	95.5	Very high	76.7	Confident	12 Å²	12	51.9 Å²	51.9	7%	0.074	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.5	178.9	41.1	0	0	0	0	110.7	R432 F433 I441 F445 I466 E467 V799	R432-T443 CarbonylContact O-C 3.58Å; R432-T443 VanDerWaalsContact O-CA 3.32Å; R432-T443 WeakPolarHBondContact O-CA 3.39Å; F433-T443 HydrophobicContact CD1-CG2 3.42Å; F433-T443 VanDerWaalsContact CD1-CG2 3.42Å; F433-T443 HydrophobicContact CE1-CG2 3.45Å; F433-T443 VanDerWaalsContact CE1-CG2 3.45Å; I441-T443 HydrophobicContact CG2-CG2 4.04Å; T443-F445 WeakPolarHBondContact OG1-CE2 3.4Å; T443-I466 CarbonylContact O-C 3.52Å; T443-I466 VanDerWaalsContact O-CA 3.28Å; T443-I466 WeakPolarHBondContact O-CA 3.41Å; T443-E467 PolarHBondContact N-O 3.46Å; T443-E467 PolarHBondContact O-N 3.49Å; T443-E467 WeakPolarHBondContact OG1-CB 3.46Å; T443-E467 PolarHBondContact OG1-O 3.46Å; T443-V799 HydrophobicContact CG2-CG1 4.09Å
444	Q	92.4	Very high	74	Confident	9 Å²	9	60.7 Å²	60.7	4%	0.042	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.7	169.5	174.1	172.3	54	0	0	109.2	E431 R432 M434 N483 Y487	E431-Q444 WeakPolarHBondContact CA-O 3.16Å; R432-Q444 HydrophobicContact CG-CB 4.13Å; R432-Q444 VanDerWaalsContact CZ-OE1 3.28Å; R432-Q444 PolarHBondContact N-O 3.28Å; R432-Q444 PolarHBondContact O-N 2.94Å; M434-Q444 HydrophobicContact CG-CB 3.74Å; M434-Q444 HydrophobicContact SD-CB 3.83Å; Q444-N483 PolarHBondContact NE2-ND2 2.88Å; Q444-Y487 PolarHBondContact NE2-O 2.83Å
445	F	89.4	Confident	71	Confident	33 Å²	33	68 Å²	68	15%	0.145	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.4	172	-59.4	-77.7	0	0	0	109.3	E431 T443 G464 S465 E467 V799 F800	E431-F445 HydrophobicContact CB-CD1 3.71Å; E431-F445 HydrophobicContact CB-CE1 3.79Å; T443-F445 WeakPolarHBondContact OG1-CE2 3.4Å; F445-G464 CarbonylContact O-C 3.49Å; F445-G464 WeakPolarHBondContact O-CA 3.41Å; F445-S465 PolarHBondContact N-O 2.77Å; F445-S465 PolarHBondContact O-N 2.91Å; F445-E467 HydrophobicContact CD2-CB 4.41Å; F445-E467 HydrophobicContact CE2-CB 3.75Å; F445-E467 VanDerWaalsContact CE2-OE2 3.32Å; F445-E467 WeakPolarHBondContact CE2-OE2 3.37Å; F445-V799 HydrophobicContact CE1-CG1 4.35Å; F445-F800 AromaticContact CE1-CE2 3.72Å; F445-F800 HydrophobicContact CE1-CE2 3.72Å; F445-F800 HydrophobicContact CE1-CZ 4.04Å; F445-F800 HydrophobicContact CZ-CE2 4.33Å; F445-F800 HydrophobicContact CZ-CZ 4.19Å
446	R	79.4	Confident	68.1	Low	70 Å²	70	74 Å²	74	26%	0.264	38%	0.376	S	S	.	.			trans	-97.5	130.3	169	-66.9	-175.6	179.7	179.2	0.9	109.2	N182 R430	N182-R446 PolarHBondContact OD1-NH1 3.31Å; R430-R446 PolarHBondContact O-N 2.99Å
447	D	65.2	Low	65.2	Low	94 Å²	94	79.4 Å²	79.4	50%	0.503	42%	0.422	S	S	.	.			trans	-66.8	148	176.7	-83.4	1.5	0	0	0	111.5	G463	D447-G463 WeakPolarHBondContact CB-O 3.43Å
448	T	55.6	Low	62.5	Low	66 Å²	66	83 Å²	83	41%	0.405	45%	0.449	S	S	.	.	S	Bend	trans	-91.8	-12.9	177.3	55.5	0	0	0	0	112.8	F186	F186-T448 HydrophobicContact CE2-CG2 4.11Å; F186-T448 WeakPolarHBondContact CE2-O 3.2Å; F186-T448 WeakPolarHBondContact CZ-O 3.5Å
449	A	46	Very low	59.9	Low	71 Å²	71	85 Å²	85	59%	0.587	47%	0.466	S	S	*	.			trans	-92.8	1	-149.9	0	0	0	0	0	117.2	Y451	A449-Y451 VanDerWaalsContact C-N 3.31Å; A449-Y451 PolarHBondContact O-N 3.34Å; A449-Y451 VanDerWaalsContact O-N 3.08Å
450	E	39.1	Very low	57.5	Low	89 Å²	89	91.9 Å²	91.9	42%	0.416	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	7.9	-166.1	-85.5	173.7	-158.8	0	0	117.6	S462 G463	E450-S462 WeakPolarHBondContact OE1-CA 3.18Å; E450-G463 PolarHBondContact OE1-N 3.14Å; E450-G463 VanDerWaalsContact OE1-N 3.09Å
451	Y	39.6	Very low	55.3	Low	195 Å²	195	94.5 Å²	94.5	77%	0.765	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.1	17.8	178.3	-72.2	-71.6	0	0	0	116.9	A449	A449-Y451 VanDerWaalsContact C-N 3.31Å; A449-Y451 PolarHBondContact O-N 3.34Å; A449-Y451 VanDerWaalsContact O-N 3.08Å
452	Q	35.9	Very low	53.2	Low	202 Å²	202	98.4 Å²	98.4	94%	0.944	54%	0.543	S	S	*	.	S	Bend	trans	-92.6	0.8	163.3	-81.6	-173.5	-0.1	0	0	114.2
453	A	34.6	Very low	51.4	Low	76 Å²	76	99.2 Å²	99.2	63%	0.628	55%	0.552	S	S	*	*			trans	-114.5	88.3	173.5	0	0	0	0	0	109.6	D455	A453-D455 PolarHBondContact O-N 2.81Å
454	E	36.8	Very low	50.7	Low	189 Å²	189	99 Å²	99	88%	0.883	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	2.1	175.3	-76.3	-162.1	156.3	0	0	114.1
455	D	33.4	Very low	50.6	Low	153 Å²	153	99.1 Å²	99.1	82%	0.818	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-8	-169.5	-75.4	-27.9	0	0	0	116.8	A453	A453-D455 PolarHBondContact O-N 2.81Å
456	D	34.1	Very low	50.8	Low	128 Å²	128	97.5 Å²	97.5	68%	0.684	55%	0.547	S	S	*	.			trans	-126.4	78.4	-177.9	-75.3	-39	0	0	0	113	S458	D456-S458 PolarHBondContact O-N 3.32Å
457	A	35.9	Very low	51.5	Low	119 Å²	119	97.6 Å²	97.6	98%	0.983	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	18.8	178.2	0	0	0	0	0	115.7
458	S	36.3	Very low	52.9	Low	106 Å²	106	93.1 Å²	93.1	74%	0.741	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	-4.4	-178.3	63	0	0	0	0	115.2	D456 Q460	D456-S458 PolarHBondContact O-N 3.32Å; S458-Q460 PolarHBondContact O-N 3.34Å
459	N	33.7	Very low	54.7	Low	123 Å²	123	92.7 Å²	92.7	66%	0.658	52%	0.52	S	S	*	.			trans	-104	67.8	-178.6	-136.7	20.9	0	0	0	111.7	S461	N459-S461 PolarHBondContact O-N 3.19Å
460	Q	39.6	Very low	56.9	Low	191 Å²	191	89.5 Å²	89.5	89%	0.893	49%	0.493	S	S	*	.			trans	-76.7	24.6	177.5	-148.1	169	35.8	0	0	112.9	S458 S462	S458-Q460 PolarHBondContact O-N 3.34Å; Q460-S462 PolarHBondContact O-N 2.94Å
461	S	46.3	Very low	59.3	Low	54 Å²	54	89.1 Å²	89.1	38%	0.378	49%	0.491	S	S	.	.			trans	-92.2	94.8	-179.5	66.6	0	0	0	0	109.3	N459 G463	N459-S461 PolarHBondContact O-N 3.19Å; S461-G463 VanDerWaalsContact C-N 3.29Å; S461-G463 PolarHBondContact O-N 3.26Å
462	S	52.6	Low	61.6	Low	86 Å²	86	83.5 Å²	83.5	60%	0.601	47%	0.474	S	S	*	.			trans	-49.9	92	170.2	-67.3	0	0	0	0	110.8	E450 Q460 G464	E450-S462 WeakPolarHBondContact OE1-CA 3.18Å; Q460-S462 PolarHBondContact O-N 2.94Å; S462-G464 VanDerWaalsContact C-N 3.34Å; S462-G464 PolarHBondContact O-N 2.94Å
463	G	58	Low	63.9	Low	18 Å²	18	78.6 Å²	78.6	19%	0.186	45%	0.454	C	S	.	.			trans	-78.5	78.3	-171.1	0	0	0	0	0	110.9	D447 E450 S461	D447-G463 WeakPolarHBondContact CB-O 3.43Å; E450-G463 PolarHBondContact OE1-N 3.14Å; E450-G463 VanDerWaalsContact OE1-N 3.09Å; S461-G463 VanDerWaalsContact C-N 3.29Å; S461-G463 PolarHBondContact O-N 3.26Å
464	G	80.3	Confident	66.1	Low	8 Å²	8	79.6 Å²	79.6	8%	0.082	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	169.1	169.3	0	0	0	0	0	111.8	F445 S462 N483	F445-G464 CarbonylContact O-C 3.49Å; F445-G464 WeakPolarHBondContact O-CA 3.41Å; S462-G464 VanDerWaalsContact C-N 3.34Å; S462-G464 PolarHBondContact O-N 2.94Å; G464-N483 WeakPolarHBondContact O-CA 2.83Å; G464-N483 WeakPolarHBondContact O-CB 3.37Å; G464-N483 PolarHBondContact O-N 3.27Å
465	S	91.2	Very high	68.1	Low	10 Å²	10	74.5 Å²	74.5	7%	0.07	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	153.6	161.5	57.5	0	0	0	0	111.2	F445 R480 L481	F445-S465 PolarHBondContact N-O 2.77Å; F445-S465 PolarHBondContact O-N 2.91Å; S465-R480 PolarHBondContact OG-NH2 3.11Å; S465-L481 CarbonylContact C-O 3.49Å; S465-L481 WeakPolarHBondContact CA-O 3.16Å; S465-L481 WeakPolarHBondContact CB-O 3.21Å
466	I	94	Very high	70.2	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.6	173.9	-70.1	163.6	0	0	0	107.5	M434 V442 T443 V468 R480 L481 N483 Y487 L499	M434-I466 HydrophobicContact CE-CD1 4.27Å; M434-I466 HydrophobicContact SD-CD1 3.92Å; M434-I466 HydrophobicContact SD-CG1 3.91Å; M434-I466 HydrophobicContact SD-CG2 4.33Å; V442-I466 HydrophobicContact CG1-CG2 3.6Å; T443-I466 CarbonylContact O-C 3.52Å; T443-I466 VanDerWaalsContact O-CA 3.28Å; T443-I466 WeakPolarHBondContact O-CA 3.41Å; I466-V468 HydrophobicContact CG2-CG2 4.4Å; I466-R480 CarbonylContact O-C 3.51Å; I466-R480 WeakPolarHBondContact O-CA 3.4Å; I466-L481 HydrophobicContact CB-CB 4.39Å; I466-L481 PolarHBondContact N-O 3.4Å; I466-L481 PolarHBondContact O-N 2.99Å; I466-N483 HydrophobicContact CD1-CB 3.91Å; I466-N483 WeakPolarHBondContact CD1-OD1 3.46Å; I466-N483 HydrophobicContact CG1-CB 3.96Å; I466-Y487 HydrophobicContact CD1-CD2 4.29Å; I466-L499 HydrophobicContact CD1-CD1 4.26Å; I466-L499 HydrophobicContact CD1-CD2 4.34Å
467	E	93.9	Very high	72.6	Confident	71 Å²	71	67.1 Å²	67.1	33%	0.332	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.2	174	-172.2	175.8	-162.3	0	0	109.1	V442 T443 F445 L479	V442-E467 CarbonylContact C-O 3.47Å; V442-E467 WeakPolarHBondContact CA-O 3.19Å; T443-E467 PolarHBondContact N-O 3.46Å; T443-E467 PolarHBondContact O-N 3.49Å; T443-E467 WeakPolarHBondContact OG1-CB 3.46Å; T443-E467 PolarHBondContact OG1-O 3.46Å; F445-E467 HydrophobicContact CD2-CB 4.41Å; F445-E467 HydrophobicContact CE2-CB 3.75Å; F445-E467 VanDerWaalsContact CE2-OE2 3.32Å; F445-E467 WeakPolarHBondContact CE2-OE2 3.37Å; E467-L479 CarbonylContact C-O 3.48Å; E467-L479 WeakPolarHBondContact CA-O 3.23Å
468	V	94.1	Very high	75.1	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	121	179.6	-174.8	0	0	0	0	107.4	I441 V442 I466 F470 S478 L479 L492 L497	I441-V468 WeakPolarHBondContact O-CA 3.45Å; V442-V468 HydrophobicContact CG1-CG2 4.31Å; V442-V468 HydrophobicContact CG2-CG1 4.26Å; V442-V468 HydrophobicContact CG2-CG2 4.27Å; I466-V468 HydrophobicContact CG2-CG2 4.4Å; V468-F470 HydrophobicContact CG1-CE2 3.92Å; V468-F470 HydrophobicContact CG1-CZ 4.03Å; V468-S478 CarbonylContact O-C 3.51Å; V468-S478 WeakPolarHBondContact O-CA 3.21Å; V468-S478 VanDerWaalsContact O-CB 3.27Å; V468-S478 WeakPolarHBondContact O-CB 3.33Å; V468-L479 HydrophobicContact CB-CB 4.12Å; V468-L479 HydrophobicContact CG2-CB 4.42Å; V468-L479 PolarHBondContact N-O 3.29Å; V468-L479 PolarHBondContact O-N 2.82Å; V468-L492 HydrophobicContact CG1-CD1 4.06Å; V468-L492 HydrophobicContact CG1-CD2 3.99Å; V468-L497 HydrophobicContact CG2-CD1 4.16Å; V468-L497 HydrophobicContact CG2-CD2 3.78Å
469	E	92.7	Very high	77.5	Confident	58 Å²	58	60.6 Å²	60.6	27%	0.271	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.1	178.6	-171.1	-166.8	143	0	0	108.8	G440 I441 R802	G440-E469 CarbonylContact C-O 3.44Å; G440-E469 WeakPolarHBondContact CA-O 3.17Å; I441-E469 PolarHBondContact N-O 3.46Å; I441-E469 PolarHBondContact O-N 2.98Å; E469-R802 IonicContact OE1-CZ 3.81Å; E469-R802 IonicContact OE1-NE 3.24Å; E469-R802 PolarHBondContact OE1-NE 2.88Å; E469-R802 IonicContact OE1-NH2 3.65Å; E469-R802 PolarHBondContact OE1-NH2 3.07Å; E469-R802 IonicContact OE2-NE 3.92Å; E469-R802 PolarHBondContact OE2-NE 3.47Å
470	F	92.6	Very high	80.2	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.018	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	142.2	174.6	-65.1	-90.9	0	0	0	109.5	I439 V468 D472 N473 H476 H477 L479 L492 L531	I439-F470 HydrophobicContact CG2-CD1 3.85Å; I439-F470 HydrophobicContact CG2-CE1 4.03Å; V468-F470 HydrophobicContact CG1-CE2 3.92Å; V468-F470 HydrophobicContact CG1-CZ 4.03Å; F470-D472 PolarHBondContact O-N 3.41Å; F470-N473 PolarHBondContact O-OD1 3.06Å; F470-H476 HydrophobicContact CD1-CB 4.05Å; F470-H476 HydrophobicContact CD2-CB 3.55Å; F470-H476 HydrophobicContact CE1-CB 3.96Å; F470-H476 HydrophobicContact CE2-CB 3.46Å; F470-H476 VanDerWaalsContact CE2-CB 3.46Å; F470-H476 HydrophobicContact CG-CB 3.86Å; F470-H476 HydrophobicContact CZ-CB 3.68Å; F470-H477 WeakPolarHBondContact CE2-O 3.48Å; F470-L479 HydrophobicContact CE2-CD1 4.4Å; F470-L492 HydrophobicContact CD1-CD2 4.34Å; F470-L492 HydrophobicContact CE1-CD1 3.87Å; F470-L492 HydrophobicContact CE1-CD2 4.06Å; F470-L492 HydrophobicContact CE1-CG 4.25Å; F470-L492 HydrophobicContact CZ-CD1 4.02Å; F470-L531 HydrophobicContact CE1-CD1 4.06Å; F470-L531 HydrophobicContact CZ-CD1 3.75Å
471	H	90.6	Very high	82.6	Confident	80 Å²	80	56.5 Å²	56.5	37%	0.37	31%	0.306	S	S	.	.	S	Bend	trans	-66.2	-31.8	175.1	-66	-56.6	0	0	0	111.3	W436 N437 R438 I439 G440	W436-H471 AromaticContact CE2-CE1 3.9Å; W436-H471 AromaticContact NE1-CE1 3.46Å; W436-H471 PolarHBondContact NE1-CE1 3.01Å; W436-H471 AromaticContact NE1-NE2 3.62Å; N437-H471 PolarHBondContact O-CD2 3.15Å; N437-H471 PolarHBondContact O-NE2 3.39Å; R438-H471 PolarHBondContact O-CD2 3.2Å; I439-H471 PolarHBondContact O-N 2.78Å; G440-H471 PolarHBondContact N-CD2 2.78Å
472	D	86.9	Confident	84.7	Confident	77 Å²	77	58.3 Å²	58.3	41%	0.412	32%	0.319	S	S	.	.	S	Bend	trans	-113.1	96.6	171.9	-172	-5	0	0	0	110.4	F470 S474 L475	F470-D472 PolarHBondContact O-N 3.41Å; D472-S474 PolarHBondContact O-N 3.13Å; D472-S474 VanDerWaalsContact O-N 3.1Å; D472-S474 WeakPolarHBondContact OD1-CB 3.35Å; D472-S474 PolarHBondContact OD1-N 2.87Å; D472-S474 PolarHBondContact OD1-OG 2.79Å; D472-S474 PolarHBondContact OD2-OG 2.77Å; D472-L475 HydrophobicContact CB-CD1 4.13Å; D472-L475 HydrophobicContact CB-CG 4.28Å; D472-L475 PolarHBondContact O-N 3.49Å; D472-L475 VanDerWaalsContact O-N 3.14Å
473	N	83.5	Confident	86.4	Confident	99 Å²	99	54.5 Å²	54.5	53%	0.529	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-8.4	177.9	-70.3	-12	0	0	0	113.6	F470 L475 H476	F470-N473 PolarHBondContact O-OD1 3.06Å; N473-L475 VanDerWaalsContact C-N 3.32Å; N473-H476 WeakPolarHBondContact CA-O 3.27Å
474	S	82.6	Confident	87.5	Confident	98 Å²	98	57.6 Å²	57.6	69%	0.685	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-23.4	173.9	76	0	0	0	0	112.8	D472	D472-S474 PolarHBondContact O-N 3.13Å; D472-S474 VanDerWaalsContact O-N 3.1Å; D472-S474 WeakPolarHBondContact OD1-CB 3.35Å; D472-S474 PolarHBondContact OD1-N 2.87Å; D472-S474 PolarHBondContact OD1-OG 2.79Å; D472-S474 PolarHBondContact OD2-OG 2.77Å
475	L	78.4	Confident	87.7	Confident	82 Å²	82	59.2 Å²	59.2	43%	0.429	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-48.3	176.5	-61.6	175.2	0	0	0	110.8	D472 N473 L494	D472-L475 HydrophobicContact CB-CD1 4.13Å; D472-L475 HydrophobicContact CB-CG 4.28Å; D472-L475 PolarHBondContact O-N 3.49Å; D472-L475 VanDerWaalsContact O-N 3.14Å; N473-L475 VanDerWaalsContact C-N 3.32Å; L475-L494 HydrophobicContact CD1-CD2 3.73Å
476	H	78	Confident	87.4	Confident	19 Å²	19	60.7 Å²	60.7	9%	0.088	34%	0.338	C	S	.	.			trans	-146.6	145.4	177.3	-79.9	-76.7	0	0	0	111.7	F470 N473 L494 D532	F470-H476 HydrophobicContact CD1-CB 4.05Å; F470-H476 HydrophobicContact CD2-CB 3.55Å; F470-H476 HydrophobicContact CE1-CB 3.96Å; F470-H476 HydrophobicContact CE2-CB 3.46Å; F470-H476 VanDerWaalsContact CE2-CB 3.46Å; F470-H476 HydrophobicContact CG-CB 3.86Å; F470-H476 HydrophobicContact CZ-CB 3.68Å; N473-H476 WeakPolarHBondContact CA-O 3.27Å; H476-L494 PolarHBondContact NE2-O 3.18Å; H476-D532 VanDerWaalsContact CE1-C 3.43Å; H476-D532 PolarHBondContact CE1-O 2.74Å
477	H	84.1	Confident	87.3	Confident	107 Å²	107	61.1 Å²	61.1	50%	0.495	34%	0.339	S	S	.	.			trans	-75	154.5	171	63.7	-82.9	0	0	0	110.7	F470	F470-H477 WeakPolarHBondContact CE2-O 3.48Å
478	S	86.9	Confident	87.2	Confident	52 Å²	52	58.8 Å²	58.8	36%	0.364	33%	0.331	S	S	.	.			trans	-63.2	141.6	174.5	-53.7	0	0	0	0	111.5	V468	V468-S478 CarbonylContact O-C 3.51Å; V468-S478 WeakPolarHBondContact O-CA 3.21Å; V468-S478 VanDerWaalsContact O-CB 3.27Å; V468-S478 WeakPolarHBondContact O-CB 3.33Å
479	L	88.6	Confident	87.2	Confident	35 Å²	35	59.8 Å²	59.8	18%	0.183	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.3	-178.2	-58.2	160.5	0	0	0	109.7	E467 V468 F470 L529 L531	E467-L479 CarbonylContact C-O 3.48Å; E467-L479 WeakPolarHBondContact CA-O 3.23Å; V468-L479 HydrophobicContact CB-CB 4.12Å; V468-L479 HydrophobicContact CG2-CB 4.42Å; V468-L479 PolarHBondContact N-O 3.29Å; V468-L479 PolarHBondContact O-N 2.82Å; F470-L479 HydrophobicContact CE2-CD1 4.4Å; L479-L529 HydrophobicContact CD1-CD2 4.33Å; L479-L531 HydrophobicContact CD1-CD2 3.76Å
480	R	90.3	Very high	87.3	Confident	179 Å²	179	57 Å²	57	68%	0.675	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	124	170.4	-171.8	171.9	-177.3	176.5	-0	109.8	S465 I466	S465-R480 PolarHBondContact OG-NH2 3.11Å; I466-R480 CarbonylContact O-C 3.51Å; I466-R480 WeakPolarHBondContact O-CA 3.4Å
481	L	90.2	Very high	87.5	Confident	49 Å²	49	57.5 Å²	57.5	26%	0.257	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	144.6	-176.6	-56.3	175.6	0	0	0	109.6	S465 I466 L497 L499 L529	S465-L481 CarbonylContact C-O 3.49Å; S465-L481 WeakPolarHBondContact CA-O 3.16Å; S465-L481 WeakPolarHBondContact CB-O 3.21Å; I466-L481 HydrophobicContact CB-CB 4.39Å; I466-L481 PolarHBondContact N-O 3.4Å; I466-L481 PolarHBondContact O-N 2.99Å; L481-L497 HydrophobicContact CD1-CD2 3.8Å; L481-L499 HydrophobicContact CD1-CD1 3.98Å; L481-L529 HydrophobicContact CD1-CD2 4.46Å
482	S	88.3	Confident	87.7	Confident	92 Å²	92	53.9 Å²	53.9	64%	0.643	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	137.2	166.4	-178.5	0	0	0	0	109.2
483	N	89	Confident	87.9	Confident	6 Å²	6	50.9 Å²	50.9	3%	0.032	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	45.1	-178.5	-167.9	35.8	0	0	0	112.1	Q444 G464 I466 S485 G486 Y487	Q444-N483 PolarHBondContact NE2-ND2 2.88Å; G464-N483 WeakPolarHBondContact O-CA 2.83Å; G464-N483 WeakPolarHBondContact O-CB 3.37Å; G464-N483 PolarHBondContact O-N 3.27Å; I466-N483 HydrophobicContact CD1-CB 3.91Å; I466-N483 WeakPolarHBondContact CD1-OD1 3.46Å; I466-N483 HydrophobicContact CG1-CB 3.96Å; N483-S485 PolarHBondContact O-N 3.48Å; N483-G486 PolarHBondContact O-N 2.81Å; N483-G486 VanDerWaalsContact O-N 3.17Å; N483-Y487 PolarHBondContact ND2-O 2.81Å; N483-Y487 WeakPolarHBondContact OD1-CB 3.32Å; N483-Y487 WeakPolarHBondContact OD1-CD2 3.44Å; N483-Y487 PolarHBondContact OD1-N 2.8Å
484	S	82.3	Confident	87.9	Confident	83 Å²	83	48.4 Å²	48.4	58%	0.58	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-24.6	177.1	55.3	0	0	0	0	113.1	G486	S484-G486 VanDerWaalsContact C-N 3.35Å
485	S	83.4	Confident	88	Confident	42 Å²	42	45.1 Å²	45.1	29%	0.294	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	0.4	177.7	-67.5	0	0	0	0	114.4	N483 Y487	N483-S485 PolarHBondContact O-N 3.48Å; S485-Y487 PolarHBondContact O-N 3.38Å
486	G	85.2	Confident	88.5	Confident	42 Å²	42	41.2 Å²	41.2	43%	0.433	24%	0.236	S	C	.	.			trans	68.2	31.9	174.3	0	0	0	0	0	115.6	N483 S484 S488	N483-G486 PolarHBondContact O-N 2.81Å; N483-G486 VanDerWaalsContact O-N 3.17Å; S484-G486 VanDerWaalsContact C-N 3.35Å; G486-S488 PolarHBondContact O-N 2.92Å
487	Y	92.2	Very high	89.3	Confident	8 Å²	8	40.4 Å²	40.4	3%	0.031	23%	0.232	C	C	.	.			trans	-57.5	137.9	176.1	-60.3	-66.3	0	0	0	111.4	Q444 I466 N483 S485 L499 R525 A527 E544	Q444-Y487 PolarHBondContact NE2-O 2.83Å; I466-Y487 HydrophobicContact CD1-CD2 4.29Å; N483-Y487 PolarHBondContact ND2-O 2.81Å; N483-Y487 WeakPolarHBondContact OD1-CB 3.32Å; N483-Y487 WeakPolarHBondContact OD1-CD2 3.44Å; N483-Y487 PolarHBondContact OD1-N 2.8Å; S485-Y487 PolarHBondContact O-N 3.38Å; Y487-L499 HydrophobicContact CD1-CB 3.85Å; Y487-L499 HydrophobicContact CD2-CB 4.15Å; Y487-L499 HydrophobicContact CD2-CD1 4.02Å; Y487-L499 HydrophobicContact CE1-CB 4.23Å; Y487-L499 HydrophobicContact CE2-CD1 4.34Å; Y487-L499 HydrophobicContact CG-CB 3.81Å; Y487-L499 HydrophobicContact CG-CD1 4.45Å; Y487-R525 HydrophobicContact CE1-CB 4.36Å; Y487-R525 HydrophobicContact CE1-CG 4.15Å; Y487-A527 HydrophobicContact CE1-CB 3.91Å; Y487-A527 WeakPolarHBondContact OH-CB 3.4Å; Y487-E544 PolarHBondContact OH-OE1 2.79Å
488	S	90.6	Very high	89.8	Confident	22 Å²	22	35.3 Å²	35.3	15%	0.154	21%	0.209	C	C	.	.			trans	-130.2	-10.6	-174.7	66.2	0	0	0	0	113.7	R432 G486 A500	R432-S488 PolarHBondContact NH2-O 2.66Å; G486-S488 PolarHBondContact O-N 2.92Å; S488-A500 PolarHBondContact N-O 2.9Å
489	M	94.5	Very high	90.2	Very high	21 Å²	21	33 Å²	33	10%	0.103	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.1	177.2	-64	165.6	-73.3	0	0	109.5	M434 L499 A500 K502 C555 V558	M434-M489 VanDerWaalsContact CE-C 3.48Å; M434-M489 VanDerWaalsContact CE-O 3.29Å; M434-M489 WeakPolarHBondContact CE-O 3.11Å; M489-L499 WeakPolarHBondContact O-CA 3.44Å; M489-A500 HydrophobicContact CB-CB 4.36Å; M489-A500 HydrophobicContact CE-CB 4.07Å; M489-A500 PolarHBondContact N-O 3.07Å; M489-A500 PolarHBondContact O-N 3.39Å; M489-K502 HydrophobicContact CE-CB 4.03Å; M489-C555 HydrophobicContact CE-CB 3.85Å; M489-C555 WeakPolarHBondContact CE-O 3.46Å; M489-C555 WeakPolarHBondContact CE-SG 3.34Å; M489-V558 HydrophobicContact CB-CG2 4.06Å
490	A	96.1	Very high	90.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.8	177.1	0	0	0	0	0	111.7	Q421 M434 V435 V442 L498 L499	Q421-A490 WeakPolarHBondContact CG-O 3.48Å; M434-A490 HydrophobicContact CB-CB 3.79Å; M434-A490 HydrophobicContact CE-CB 3.89Å; M434-A490 HydrophobicContact SD-CB 4.38Å; V435-A490 HydrophobicContact CG1-CB 4.06Å; V442-A490 HydrophobicContact CB-CB 4.28Å; V442-A490 HydrophobicContact CG1-CB 4Å; V442-A490 HydrophobicContact CG2-CB 4.42Å; A490-L498 CarbonylContact C-O 3.57Å; A490-L498 WeakPolarHBondContact CA-O 3.32Å; A490-L498 WeakPolarHBondContact CB-O 3.4Å; A490-L499 HydrophobicContact CB-CD2 3.72Å
491	D	96.2	Very high	90.6	Very high	14 Å²	14	23.1 Å²	23.1	8%	0.075	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.9	160.5	-163.3	15.2	0	0	0	109.7	L498 C559 L560	D491-L498 HydrophobicContact CB-CB 4.42Å; D491-L498 HydrophobicContact CB-CD2 4.46Å; D491-L498 PolarHBondContact N-O 2.84Å; D491-L498 PolarHBondContact O-N 3.13Å; D491-C559 WeakPolarHBondContact OD2-CA 3.41Å; D491-L560 HydrophobicContact CB-CD1 4.39Å; D491-L560 HydrophobicContact CB-CG 4.31Å; D491-L560 PolarHBondContact OD2-N 3.35Å
492	L	94.1	Very high	90.5	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.021	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.6	-173.3	-177.6	65.3	0	0	0	111	V435 N437 I439 V442 V468 F470 L497 L531	V435-L492 HydrophobicContact CG1-CB 4.4Å; N437-L492 PolarHBondContact ND2-O 2.91Å; I439-L492 HydrophobicContact CB-CD2 4.43Å; I439-L492 HydrophobicContact CB-CG 4.37Å; I439-L492 HydrophobicContact CG2-CD2 4.15Å; I439-L492 HydrophobicContact CG2-CG 4.04Å; V442-L492 HydrophobicContact CG2-CB 4.24Å; V442-L492 HydrophobicContact CG2-CD2 4.35Å; V468-L492 HydrophobicContact CG1-CD1 4.06Å; V468-L492 HydrophobicContact CG1-CD2 3.99Å; F470-L492 HydrophobicContact CD1-CD2 4.34Å; F470-L492 HydrophobicContact CE1-CD1 3.87Å; F470-L492 HydrophobicContact CE1-CD2 4.06Å; F470-L492 HydrophobicContact CE1-CG 4.25Å; F470-L492 HydrophobicContact CZ-CD1 4.02Å; L492-L497 HydrophobicContact CD1-CB 4.16Å; L492-L497 HydrophobicContact CD1-CD1 3.97Å; L492-L531 HydrophobicContact CD1-CD1 4.08Å
493	S	90.4	Very high	90.2	Very high	15 Å²	15	21.1 Å²	21.1	11%	0.105	14%	0.136	C	C	.	.			trans	-122.8	177.7	172.6	73	0	0	0	0	110.2	T495 A496	S493-T495 PolarHBondContact O-N 2.99Å; S493-T495 PolarHBondContact OG-N 2.86Å; S493-T495 PolarHBondContact OG-OG1 2.83Å; S493-A496 PolarHBondContact N-O 2.84Å; S493-A496 PolarHBondContact OG-N 3.13Å; S493-A496 PolarHBondContact OG-O 3.07Å
494	L	84.6	Confident	89.6	Confident	46 Å²	46	22.8 Å²	22.8	24%	0.241	15%	0.149	C	C	.	.	S	Bend	trans	-70.1	-20.3	173	-67.6	174.9	0	0	0	113	I439 L475 H476 V533	I439-L494 HydrophobicContact CD1-CD1 4.44Å; I439-L494 HydrophobicContact CD1-CD2 4Å; I439-L494 HydrophobicContact CD1-CG 3.84Å; I439-L494 HydrophobicContact CG2-CD2 3.9Å; I439-L494 HydrophobicContact CG2-CG 4.47Å; L475-L494 HydrophobicContact CD1-CD2 3.73Å; H476-L494 PolarHBondContact NE2-O 3.18Å; L494-V533 WeakPolarHBondContact O-CG2 3.2Å
495	T	84.7	Confident	88.7	Confident	30 Å²	30	23.4 Å²	23.4	18%	0.184	15%	0.146	C	C	.	.	S	Bend	trans	-110.8	-16.1	-171	54.8	0	0	0	0	113	S493 L531 V533 Q589	S493-T495 PolarHBondContact O-N 2.99Å; S493-T495 PolarHBondContact OG-N 2.86Å; S493-T495 PolarHBondContact OG-OG1 2.83Å; T495-L531 PolarHBondContact O-N 2.9Å; T495-V533 HydrophobicContact CG2-CG2 4.41Å; T495-Q589 PolarHBondContact O-NE2 3.33Å; T495-Q589 PolarHBondContact OG1-NE2 3.5Å
496	A	89.7	Confident	87.6	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	156.3	176.4	0	0	0	0	0	113.1	S493 I528 L529 L560 Q589	S493-A496 PolarHBondContact N-O 2.84Å; S493-A496 PolarHBondContact OG-N 3.13Å; S493-A496 PolarHBondContact OG-O 3.07Å; A496-I528 HydrophobicContact CB-CG2 3.92Å; A496-L529 CarbonylContact C-O 3.52Å; A496-L529 VanDerWaalsContact CA-O 3.29Å; A496-L529 WeakPolarHBondContact CA-O 3.04Å; A496-L560 HydrophobicContact CB-CD1 4.36Å; A496-L560 HydrophobicContact CB-CD2 4.38Å; A496-L560 WeakPolarHBondContact O-CD1 3.28Å; A496-Q589 HydrophobicContact CB-CG 3.73Å
497	L	93.1	Very high	86	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129	161.8	170.1	74.3	0	0	0	108.8	V442 V468 L481 L492 L499 I528 L529	V442-L497 HydrophobicContact CG2-CD1 3.77Å; V468-L497 HydrophobicContact CG2-CD1 4.16Å; V468-L497 HydrophobicContact CG2-CD2 3.78Å; L481-L497 HydrophobicContact CD1-CD2 3.8Å; L492-L497 HydrophobicContact CD1-CB 4.16Å; L492-L497 HydrophobicContact CD1-CD1 3.97Å; L497-L499 HydrophobicContact CD1-CD2 4.18Å; L497-L499 HydrophobicContact CD2-CD1 4.26Å; L497-L499 HydrophobicContact CD2-CD2 4.4Å; L497-L499 HydrophobicContact CD2-CG 4.27Å; L497-L499 HydrophobicContact CG-CD2 4.28Å; L497-L499 HydrophobicContact CG-CG 4.2Å; L497-I528 WeakPolarHBondContact O-CA 3.49Å; L497-L529 HydrophobicContact CB-CB 4.27Å; L497-L529 HydrophobicContact CD2-CD2 4.25Å; L497-L529 PolarHBondContact N-O 3.27Å; L497-L529 PolarHBondContact O-N 3.19Å
498	L	95.1	Very high	84.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.9	175.7	172.8	60.5	0	0	0	108.9	A490 D491 I526 I528 V558 L560 A575	A490-L498 CarbonylContact C-O 3.57Å; A490-L498 WeakPolarHBondContact CA-O 3.32Å; A490-L498 WeakPolarHBondContact CB-O 3.4Å; D491-L498 HydrophobicContact CB-CB 4.42Å; D491-L498 HydrophobicContact CB-CD2 4.46Å; D491-L498 PolarHBondContact N-O 2.84Å; D491-L498 PolarHBondContact O-N 3.13Å; L498-I526 HydrophobicContact CD1-CG2 3.86Å; L498-I528 HydrophobicContact CD1-CD1 4.21Å; L498-I528 HydrophobicContact CD1-CG1 3.8Å; L498-V558 HydrophobicContact CD2-CB 3.73Å; L498-V558 HydrophobicContact CD2-CG2 4.26Å; L498-V558 HydrophobicContact CG-CB 4.23Å; L498-V558 HydrophobicContact CG-CG2 4.42Å; L498-L560 HydrophobicContact CB-CD1 3.89Å; L498-L560 HydrophobicContact CB-CD2 3.9Å; L498-L560 HydrophobicContact CB-CG 3.77Å; L498-L560 HydrophobicContact CD2-CD2 4.11Å; L498-L560 HydrophobicContact CD2-CG 4.02Å; L498-A575 HydrophobicContact CD1-CB 4.32Å; L498-A575 HydrophobicContact CD2-CB 4.15Å
499	L	95.9	Very high	82.4	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.3	175.5	-60.6	176.1	0	0	0	109.6	M434 I466 L481 Y487 M489 A490 L497 A527	M434-L499 HydrophobicContact CE-CD2 4.23Å; I466-L499 HydrophobicContact CD1-CD1 4.26Å; I466-L499 HydrophobicContact CD1-CD2 4.34Å; L481-L499 HydrophobicContact CD1-CD1 3.98Å; Y487-L499 HydrophobicContact CD1-CB 3.85Å; Y487-L499 HydrophobicContact CD2-CB 4.15Å; Y487-L499 HydrophobicContact CD2-CD1 4.02Å; Y487-L499 HydrophobicContact CE1-CB 4.23Å; Y487-L499 HydrophobicContact CE2-CD1 4.34Å; Y487-L499 HydrophobicContact CG-CB 3.81Å; Y487-L499 HydrophobicContact CG-CD1 4.45Å; M489-L499 WeakPolarHBondContact O-CA 3.44Å; A490-L499 HydrophobicContact CB-CD2 3.72Å; L497-L499 HydrophobicContact CD1-CD2 4.18Å; L497-L499 HydrophobicContact CD2-CD1 4.26Å; L497-L499 HydrophobicContact CD2-CD2 4.4Å; L497-L499 HydrophobicContact CD2-CG 4.27Å; L497-L499 HydrophobicContact CG-CD2 4.28Å; L497-L499 HydrophobicContact CG-CG 4.2Å; L499-A527 HydrophobicContact CB-CB 4.38Å; L499-A527 PolarHBondContact N-O 3.1Å; L499-A527 PolarHBondContact O-N 2.87Å
500	A	94.9	Very high	80.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	147.5	175.2	0	0	0	0	0	113.2	S488 M489 R525 I526 V558	S488-A500 PolarHBondContact N-O 2.9Å; M489-A500 HydrophobicContact CB-CB 4.36Å; M489-A500 HydrophobicContact CE-CB 4.07Å; M489-A500 PolarHBondContact N-O 3.07Å; M489-A500 PolarHBondContact O-N 3.39Å; A500-R525 CarbonylContact C-O 3.45Å; A500-R525 WeakPolarHBondContact CA-O 3.13Å; A500-I526 HydrophobicContact CB-CG1 4.43Å; A500-V558 HydrophobicContact CB-CG1 3.63Å
501	S	92.5	Very high	78.4	Confident	6 Å²	6	44.7 Å²	44.7	4%	0.042	25%	0.25	C	C	.	.			trans	-105.5	145	168	69.8	0	0	0	0	109.4	G503 S524 R525 C555	S501-G503 VanDerWaalsContact C-N 3.27Å; S501-G503 PolarHBondContact O-N 2.82Å; S501-S524 WeakPolarHBondContact O-CB 3.48Å; S501-R525 PolarHBondContact N-O 3.36Å; S501-R525 WeakPolarHBondContact OG-CB 3.38Å; S501-R525 PolarHBondContact OG-N 2.81Å; S501-C555 WeakPolarHBondContact O-CB 3.4Å
502	K	86.8	Confident	76.3	Confident	79 Å²	79	46.9 Å²	46.9	34%	0.343	26%	0.261	S	S	.	.			trans	-70.3	-23.9	-178	178.2	155.7	-171.2	147.3	0	113.1	M489 S524 L554 C555 D556	M489-K502 HydrophobicContact CE-CB 4.03Å; K502-S524 PolarHBondContact O-OG 2.67Å; K502-L554 HydrophobicContact CG-CB 4.41Å; K502-L554 WeakPolarHBondContact O-CA 3.49Å; K502-L554 WeakPolarHBondContact O-CB 3.41Å; K502-C555 WeakPolarHBondContact CG-O 3.23Å; K502-C555 PolarHBondContact O-N 3.38Å; K502-D556 WeakPolarHBondContact CE-OD1 3.43Å; K502-D556 IonicContact NZ-OD1 3.91Å; K502-D556 PolarHBondContact NZ-OD1 3.02Å
503	G	83.2	Confident	74.3	Confident	19 Å²	19	52.4 Å²	52.4	20%	0.196	29%	0.291	C	S	.	.			trans	69.2	177.9	-167	0	0	0	0	0	112.6	S501 D522	S501-G503 VanDerWaalsContact C-N 3.27Å; S501-G503 PolarHBondContact O-N 2.82Å; G503-D522 CarbonylContact C-O 3.58Å; G503-D522 WeakPolarHBondContact CA-O 3.27Å
504	S	75.7	Confident	72.6	Confident	41 Å²	41	57.4 Å²	57.4	29%	0.287	32%	0.317	S	S	.	.			trans	-114	150.9	174.7	76.5	0	0	0	0	111.4	D522 L554	S504-D522 PolarHBondContact N-O 2.97Å; S504-L554 WeakPolarHBondContact O-CD2 3.46Å
505	D	64.7	Low	71	Confident	97 Å²	97	62.1 Å²	62.1	52%	0.519	34%	0.342	S	S	.	.			trans	-123	44.4	179	-149.3	25.2	0	0	0	108.5	P507 L554	D505-P507 VanDerWaalsContact O-CD 3.25Å; D505-P507 WeakPolarHBondContact O-CD 3.38Å; D505-L554 HydrophobicContact CB-CD1 3.7Å; D505-L554 HydrophobicContact CB-CD2 4.02Å; D505-L554 HydrophobicContact CB-CG 4.19Å
506	D	59.3	Low	69.4	Low	86 Å²	86	66 Å²	66	46%	0.46	36%	0.358	S	S	.	.			trans	-75.8	113.1	-173	-149.9	-16.6	0	0	0	109.4	N508 L509	D506-N508 PolarHBondContact O-N 2.79Å; D506-N508 VanDerWaalsContact O-N 3.15Å; D506-L509 HydrophobicContact CB-CD1 4.33Å; D506-L509 HydrophobicContact CB-CG 4.48Å; D506-L509 PolarHBondContact O-N 2.82Å
507	P	52.5	Low	67.4	Low	87 Å²	87	67.9 Å²	67.9	57%	0.565	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-65.2	-20	-173.7	25.9	-36.1	0	0	0	113.2	D505 L509 D510	D505-P507 VanDerWaalsContact O-CD 3.25Å; D505-P507 WeakPolarHBondContact O-CD 3.38Å; P507-L509 PolarHBondContact O-N 2.93Å; P507-L509 VanDerWaalsContact O-N 3.15Å; P507-D510 PolarHBondContact O-N 2.81Å
508	N	54.2	Low	65.3	Low	128 Å²	128	72.7 Å²	72.7	68%	0.684	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-66.1	-12	177.9	-72.2	-18.1	0	0	0	113.3	D506	D506-N508 PolarHBondContact O-N 2.79Å; D506-N508 VanDerWaalsContact O-N 3.15Å
509	L	52.1	Low	63.2	Low	21 Å²	21	81.3 Å²	81.3	11%	0.11	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-83.9	-19.3	177.1	-66.3	175.8	0	0	0	113.2	D506 P507 D511 L512 L520 Y521	D506-L509 HydrophobicContact CB-CD1 4.33Å; D506-L509 HydrophobicContact CB-CG 4.48Å; D506-L509 PolarHBondContact O-N 2.82Å; P507-L509 PolarHBondContact O-N 2.93Å; P507-L509 VanDerWaalsContact O-N 3.15Å; L509-D511 PolarHBondContact O-N 2.65Å; L509-L512 HydrophobicContact CD2-CD1 4.41Å; L509-L512 PolarHBondContact O-N 3.34Å; L509-L520 HydrophobicContact CD2-CB 3.87Å; L509-L520 HydrophobicContact CD2-CD2 3.29Å; L509-L520 HydrophobicContact CD2-CG 3.57Å; L509-Y521 HydrophobicContact CB-CD1 3.97Å; L509-Y521 HydrophobicContact CB-CE1 3.42Å; L509-Y521 VanDerWaalsContact CB-CE1 3.42Å; L509-Y521 HydrophobicContact CB-CE2 4.33Å; L509-Y521 HydrophobicContact CD1-CD1 3.43Å; L509-Y521 VanDerWaalsContact CD1-CD1 3.43Å; L509-Y521 HydrophobicContact CD1-CE1 3.78Å; L509-Y521 HydrophobicContact CD1-CG 4.04Å; L509-Y521 HydrophobicContact CG-CD1 4.34Å; L509-Y521 HydrophobicContact CG-CE1 4.24Å
510	D	52.2	Low	61.1	Low	104 Å²	104	86 Å²	86	56%	0.556	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.9	-176.7	-70.5	-5.5	0	0	0	112.9	P507 L512 Y521	P507-D510 PolarHBondContact O-N 2.81Å; D510-L512 VanDerWaalsContact C-N 3.31Å; D510-L512 PolarHBondContact O-N 2.66Å; D510-Y521 PolarHBondContact OD1-OH 3.34Å
511	D	54.3	Low	59.2	Low	155 Å²	155	87.2 Å²	87.2	83%	0.829	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	0.5	-179	-81.9	-19.6	0	0	0	114	L509	L509-D511 PolarHBondContact O-N 2.65Å
512	L	52.4	Low	58.2	Low	60 Å²	60	91.8 Å²	91.8	31%	0.314	49%	0.486	S	S	.	.	S	Bend	trans	-96.2	163.3	-179.5	-62.8	175.1	0	0	0	112.3	L509 D510 E516 Q517 L520	L509-L512 HydrophobicContact CD2-CD1 4.41Å; L509-L512 PolarHBondContact O-N 3.34Å; D510-L512 VanDerWaalsContact C-N 3.31Å; D510-L512 PolarHBondContact O-N 2.66Å; L512-E516 HydrophobicContact CB-CB 4.46Å; L512-Q517 HydrophobicContact CB-CG 4.17Å; L512-Q517 WeakPolarHBondContact O-CG 3.36Å; L512-Q517 PolarHBondContact O-NE2 3.44Å; L512-L520 HydrophobicContact CD1-CD2 3.37Å
513	N	53	Low	58.1	Low	120 Å²	120	89.8 Å²	89.8	64%	0.642	48%	0.479	S	S	*	.			trans	-71.8	150	176.3	-72	-41.1	0	0	0	111.6	D515 E516 Q517	N513-D515 PolarHBondContact O-N 3.49Å; N513-E516 PolarHBondContact O-N 3.43Å; N513-Q517 WeakPolarHBondContact O-CB 3.43Å; N513-Q517 WeakPolarHBondContact O-CG 3.28Å; N513-Q517 PolarHBondContact O-N 3.02Å
514	D	53.1	Low	58.5	Low	121 Å²	121	89 Å²	89	65%	0.647	47%	0.47	S	S	*	.	H	α-helix	trans	-48.2	-34.8	-177.7	-67.2	-25.5	0	0	0	115	Q517 N518	D514-Q517 PolarHBondContact OD1-OE1 3.46Å; D514-N518 PolarHBondContact O-N 3.35Å
515	D	51.9	Low	59.3	Low	144 Å²	144	91.9 Å²	91.9	77%	0.77	48%	0.475	S	S	*	.	H	α-helix	trans	-75.5	-38.5	179	-70.1	-37.3	0	0	0	112.6	N513	N513-D515 PolarHBondContact O-N 3.49Å
516	E	51	Low	60.7	Low	112 Å²	112	87.3 Å²	87.3	52%	0.523	45%	0.45	S	S	.	.	H	α-helix	trans	-76.7	-31.1	174.8	-69.8	178	167.1	0	0	111.3	L512 N513 E519 L520	L512-E516 HydrophobicContact CB-CB 4.46Å; N513-E516 PolarHBondContact O-N 3.43Å; E516-E519 PolarHBondContact O-N 3.47Å; E516-L520 WeakPolarHBondContact O-CB 3.47Å; E516-L520 PolarHBondContact O-N 3.02Å
517	Q	47.3	Very low	62.3	Low	40 Å²	40	83.2 Å²	83.2	19%	0.187	43%	0.429	C	S	.	.	H	α-helix	trans	-55.6	-51.5	175.6	-83.7	177.8	15.9	0	0	111.6	L512 N513 D514 E519 L520 Y521	L512-Q517 HydrophobicContact CB-CG 4.17Å; L512-Q517 WeakPolarHBondContact O-CG 3.36Å; L512-Q517 PolarHBondContact O-NE2 3.44Å; N513-Q517 WeakPolarHBondContact O-CB 3.43Å; N513-Q517 WeakPolarHBondContact O-CG 3.28Å; N513-Q517 PolarHBondContact O-N 3.02Å; D514-Q517 PolarHBondContact OD1-OE1 3.46Å; Q517-E519 VanDerWaalsContact C-N 3.27Å; Q517-E519 PolarHBondContact O-N 3.21Å; Q517-L520 PolarHBondContact O-N 3.42Å; Q517-L520 VanDerWaalsContact O-N 3.1Å; Q517-Y521 HydrophobicContact CB-CD2 4.08Å; Q517-Y521 HydrophobicContact CB-CE2 3.7Å; Q517-Y521 HydrophobicContact CG-CE2 3.87Å; Q517-Y521 WeakPolarHBondContact O-CD2 3.31Å; Q517-Y521 PolarHBondContact O-N 2.86Å
518	N	48.4	Very low	64.2	Low	102 Å²	102	79.1 Å²	79.1	55%	0.545	40%	0.402	S	S	.	.	H	α-helix	trans	-64.2	-28.7	-176.3	-90.7	-27.6	0	0	0	113.9	D514	D514-N518 PolarHBondContact O-N 3.35Å
519	E	51.7	Low	65.9	Low	181 Å²	181	73.9 Å²	73.9	85%	0.846	37%	0.374	S	S	*	.	H	α-helix	trans	-81.1	-21.9	176.5	-68.6	-168.9	166.9	0	0	112.5	E516 Q517	E516-E519 PolarHBondContact O-N 3.47Å; Q517-E519 VanDerWaalsContact C-N 3.27Å; Q517-E519 PolarHBondContact O-N 3.21Å
520	L	51.7	Low	67.5	Low	102 Å²	102	73 Å²	73	53%	0.534	37%	0.37	S	S	.	.	H	α-helix	trans	-102.5	-24	-172.6	-146.8	70.9	0	0	0	114.4	L509 L512 E516 Q517 D522	L509-L520 HydrophobicContact CD2-CB 3.87Å; L509-L520 HydrophobicContact CD2-CD2 3.29Å; L509-L520 HydrophobicContact CD2-CG 3.57Å; L512-L520 HydrophobicContact CD1-CD2 3.37Å; E516-L520 WeakPolarHBondContact O-CB 3.47Å; E516-L520 PolarHBondContact O-N 3.02Å; Q517-L520 PolarHBondContact O-N 3.42Å; Q517-L520 VanDerWaalsContact O-N 3.1Å; L520-D522 PolarHBondContact O-N 3.46Å
521	Y	55.1	Low	69	Low	27 Å²	27	68.6 Å²	68.6	11%	0.106	35%	0.346	C	S	.	.			trans	-68.7	120.7	173.4	-75.6	-73.8	0	0	0	111.5	L509 D510 Q517 L523 P551	L509-Y521 HydrophobicContact CB-CD1 3.97Å; L509-Y521 HydrophobicContact CB-CE1 3.42Å; L509-Y521 VanDerWaalsContact CB-CE1 3.42Å; L509-Y521 HydrophobicContact CB-CE2 4.33Å; L509-Y521 HydrophobicContact CD1-CD1 3.43Å; L509-Y521 VanDerWaalsContact CD1-CD1 3.43Å; L509-Y521 HydrophobicContact CD1-CE1 3.78Å; L509-Y521 HydrophobicContact CD1-CG 4.04Å; L509-Y521 HydrophobicContact CG-CD1 4.34Å; L509-Y521 HydrophobicContact CG-CE1 4.24Å; D510-Y521 PolarHBondContact OD1-OH 3.34Å; Q517-Y521 HydrophobicContact CB-CD2 4.08Å; Q517-Y521 HydrophobicContact CB-CE2 3.7Å; Q517-Y521 HydrophobicContact CG-CE2 3.87Å; Q517-Y521 WeakPolarHBondContact O-CD2 3.31Å; Q517-Y521 PolarHBondContact O-N 2.86Å; Y521-L523 PolarHBondContact O-N 2.71Å; Y521-P551 HydrophobicContact CD2-CB 4.41Å
522	D	72	Confident	69.7	Low	101 Å²	101	64.6 Å²	64.6	54%	0.54	33%	0.325	S	S	.	.			trans	-70.9	83.5	162.1	-172.4	20.1	0	0	0	108.9	G503 S504 L520	G503-D522 CarbonylContact C-O 3.58Å; G503-D522 WeakPolarHBondContact CA-O 3.27Å; S504-D522 PolarHBondContact N-O 2.97Å; L520-D522 PolarHBondContact O-N 3.46Å
523	L	85.3	Confident	69.9	Low	38 Å²	38	65.1 Å²	65.1	20%	0.199	33%	0.33	C	S	.	.			trans	-68.6	147.1	-178	-63.5	178	0	0	0	111.4	Y521 R525 T548 P551	Y521-L523 PolarHBondContact O-N 2.71Å; L523-R525 PolarHBondContact O-N 3.07Å; L523-T548 HydrophobicContact CB-CG2 4.46Å; L523-P551 HydrophobicContact CD2-CB 4.08Å; L523-P551 HydrophobicContact CD2-CG 3.93Å
524	S	91	Very high	69.9	Low	2 Å²	2	62.6 Å²	62.6	1%	0.014	33%	0.333	C	S	.	.			trans	-61	123.7	170.1	-45.5	0	0	0	0	110.1	S501 K502 T548 L549 E553 L554 C555	S501-S524 WeakPolarHBondContact O-CB 3.48Å; K502-S524 PolarHBondContact O-OG 2.67Å; S524-T548 CarbonylContact O-C 3.59Å; S524-T548 VanDerWaalsContact O-CA 3.32Å; S524-T548 WeakPolarHBondContact O-CA 3.37Å; S524-L549 PolarHBondContact O-N 3.07Å; S524-E553 PolarHBondContact OG-O 2.87Å; S524-L554 VanDerWaalsContact OG-CA 3.27Å; S524-L554 WeakPolarHBondContact OG-CA 3.11Å; S524-C555 PolarHBondContact OG-N 3.34Å
525	R	92.5	Very high	69.4	Low	102 Å²	102	59.3 Å²	59.3	39%	0.385	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.7	179.4	-169.3	172.3	-118.3	136.2	0.5	110	Y487 A500 S501 L523 T548	Y487-R525 HydrophobicContact CE1-CB 4.36Å; Y487-R525 HydrophobicContact CE1-CG 4.15Å; A500-R525 CarbonylContact C-O 3.45Å; A500-R525 WeakPolarHBondContact CA-O 3.13Å; S501-R525 PolarHBondContact N-O 3.36Å; S501-R525 WeakPolarHBondContact OG-CB 3.38Å; S501-R525 PolarHBondContact OG-N 2.81Å; L523-R525 PolarHBondContact O-N 3.07Å; R525-T548 HydrophobicContact CG-CG2 4.42Å
526	I	94.3	Very high	69	Low	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.7	177.4	-59.8	152.4	0	0	0	107.2	L498 A500 T546 T547 L549 V577 F587 L602	L498-I526 HydrophobicContact CD1-CG2 3.86Å; A500-I526 HydrophobicContact CB-CG1 4.43Å; I526-T546 CarbonylContact O-C 3.53Å; I526-T546 VanDerWaalsContact O-CA 3.24Å; I526-T546 WeakPolarHBondContact O-CA 3.32Å; I526-T547 HydrophobicContact CB-CG2 3.99Å; I526-T547 HydrophobicContact CD1-CG2 4.16Å; I526-T547 PolarHBondContact N-O 3.23Å; I526-T547 PolarHBondContact O-N 2.67Å; I526-L549 HydrophobicContact CD1-CD1 4.36Å; I526-L549 HydrophobicContact CD1-CD2 3.5Å; I526-L549 VanDerWaalsContact CD1-CD2 3.5Å; I526-L549 HydrophobicContact CD1-CG 3.79Å; I526-V577 HydrophobicContact CD1-CB 4.24Å; I526-V577 HydrophobicContact CD1-CG1 4.06Å; I526-V577 HydrophobicContact CD1-CG2 3.78Å; I526-V577 HydrophobicContact CG1-CG1 4.5Å; I526-V577 HydrophobicContact CG1-CG2 4.11Å; I526-V577 HydrophobicContact CG2-CG2 4.2Å; I526-F587 HydrophobicContact CD1-CE2 3.93Å; I526-F587 HydrophobicContact CD1-CZ 4.06Å; I526-L602 HydrophobicContact CG2-CD2 4.01Å
527	A	92.3	Very high	68.6	Low	1 Å²	1	58.6 Å²	58.6	1%	0.008	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.9	176.5	0	0	0	0	0	111.1	Y487 L499 E544 W545 T546	Y487-A527 HydrophobicContact CE1-CB 3.91Å; Y487-A527 WeakPolarHBondContact OH-CB 3.4Å; L499-A527 HydrophobicContact CB-CB 4.38Å; L499-A527 PolarHBondContact N-O 3.1Å; L499-A527 PolarHBondContact O-N 2.87Å; A527-E544 HydrophobicContact CB-CG 3.95Å; A527-E544 WeakPolarHBondContact CB-OE1 3.35Å; A527-W545 CarbonylContact C-O 3.56Å; A527-W545 VanDerWaalsContact CA-O 3.31Å; A527-W545 WeakPolarHBondContact CA-O 3.49Å; A527-T546 HydrophobicContact CB-CG2 3.87Å
528	I	92.1	Very high	68.4	Low	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.5	175	-48.9	-167.4	0	0	0	108.6	A496 L497 L498 W545 A575 Q589 P590 L602	A496-I528 HydrophobicContact CB-CG2 3.92Å; L497-I528 WeakPolarHBondContact O-CA 3.49Å; L498-I528 HydrophobicContact CD1-CD1 4.21Å; L498-I528 HydrophobicContact CD1-CG1 3.8Å; I528-W545 PolarHBondContact N-O 3.24Å; I528-W545 PolarHBondContact O-N 2.93Å; I528-A575 HydrophobicContact CD1-CB 3.23Å; I528-A575 HydrophobicContact CG1-CB 4.41Å; I528-Q589 HydrophobicContact CG2-CG 4.36Å; I528-P590 HydrophobicContact CB-CG 4.39Å; I528-P590 HydrophobicContact CG2-CG 4.15Å; I528-L602 HydrophobicContact CB-CD1 4.37Å; I528-L602 HydrophobicContact CD1-CD1 3.42Å; I528-L602 VanDerWaalsContact CD1-CD1 3.42Å; I528-L602 HydrophobicContact CD1-CD2 3.76Å; I528-L602 HydrophobicContact CD1-CG 4.24Å; I528-L602 HydrophobicContact CG1-CD1 3.89Å; I528-L602 HydrophobicContact CG1-CD2 4.02Å
529	L	89.6	Confident	67.9	Low	19 Å²	19	61.4 Å²	61.4	10%	0.099	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	110.2	172.4	-173.6	70.5	0	0	0	108.3	L479 L481 A496 L497 S542 E544	L479-L529 HydrophobicContact CD1-CD2 4.33Å; L481-L529 HydrophobicContact CD1-CD2 4.46Å; A496-L529 CarbonylContact C-O 3.52Å; A496-L529 VanDerWaalsContact CA-O 3.29Å; A496-L529 WeakPolarHBondContact CA-O 3.04Å; L497-L529 HydrophobicContact CB-CB 4.27Å; L497-L529 HydrophobicContact CD2-CD2 4.25Å; L497-L529 PolarHBondContact N-O 3.27Å; L497-L529 PolarHBondContact O-N 3.19Å; L529-S542 WeakPolarHBondContact CD1-O 3.46Å; L529-S542 WeakPolarHBondContact CD1-OG 3.33Å; L529-E544 HydrophobicContact CD1-CB 4.38Å
530	P	86.8	Confident	67.5	Low	3 Å²	3	60 Å²	60	2%	0.019	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	140.4	174.4	27.7	-30.9	0	0	0	110.5	S542 A543 P590 P592	P530-S542 WeakPolarHBondContact O-CB 3.28Å; P530-S542 PolarHBondContact O-OG 2.82Å; P530-A543 WeakPolarHBondContact CD-O 3.43Å; P530-P590 HydrophobicContact CB-CG 4.24Å; P530-P590 WeakPolarHBondContact CB-O 3.46Å; P530-P590 HydrophobicContact CG-CG 4.1Å; P530-P592 HydrophobicContact CB-CG 4.14Å
531	L	82.6	Confident	67.3	Low	11 Å²	11	61.3 Å²	61.3	6%	0.058	37%	0.368	C	S	.	.			trans	-110.4	125.2	179.1	-61	173.7	0	0	0	108.9	F470 L479 L492 T495	F470-L531 HydrophobicContact CE1-CD1 4.06Å; F470-L531 HydrophobicContact CZ-CD1 3.75Å; L479-L531 HydrophobicContact CD1-CD2 3.76Å; L492-L531 HydrophobicContact CD1-CD1 4.08Å; T495-L531 PolarHBondContact O-N 2.9Å
532	D	69.4	Low	67.3	Low	71 Å²	71	62.7 Å²	62.7	38%	0.38	38%	0.381	S	S	.	.			trans	-87.7	109.3	-178.6	-172.2	-7.2	0	0	0	111.9	H476 G534 S535 P592	H476-D532 VanDerWaalsContact CE1-C 3.43Å; H476-D532 PolarHBondContact CE1-O 2.74Å; D532-G534 VanDerWaalsContact C-N 3.29Å; D532-G534 PolarHBondContact O-N 3.49Å; D532-G534 PolarHBondContact OD1-N 2.86Å; D532-S535 PolarHBondContact OD1-N 2.79Å; D532-S535 VanDerWaalsContact OD1-N 3.16Å; D532-S535 WeakPolarHBondContact OD2-CB 3.12Å; D532-S535 PolarHBondContact OD2-OG 2.68Å; D532-P592 HydrophobicContact CB-CB 4.18Å; D532-P592 HydrophobicContact CB-CG 4.05Å
533	V	57.4	Low	67	Low	70 Å²	70	59.3 Å²	59.3	42%	0.424	37%	0.368	S	S	.	.	S	Bend	trans	-82.8	-3.1	-176.1	-165.4	0	0	0	0	112.2	L494 T495	L494-V533 WeakPolarHBondContact O-CG2 3.2Å; T495-V533 HydrophobicContact CG2-CG2 4.41Å
534	G	51.5	Low	66.6	Low	68 Å²	68	61.2 Å²	61.2	70%	0.701	38%	0.375	S	S	*	.	S	Bend	trans	-140.8	-13.1	-163.7	0	0	0	0	0	118.6	D532	D532-G534 VanDerWaalsContact C-N 3.29Å; D532-G534 PolarHBondContact O-N 3.49Å; D532-G534 PolarHBondContact OD1-N 2.86Å
535	S	42.9	Very low	66.5	Low	52 Å²	52	61.8 Å²	61.8	36%	0.364	38%	0.377	S	S	.	.			trans	-102.8	129.9	-178.5	94.8	0	0	0	0	113.4	D532 N537	D532-S535 PolarHBondContact OD1-N 2.79Å; D532-S535 VanDerWaalsContact OD1-N 3.16Å; D532-S535 WeakPolarHBondContact OD2-CB 3.12Å; D532-S535 PolarHBondContact OD2-OG 2.68Å; S535-N537 PolarHBondContact O-N 2.78Å
536	S	45	Very low	66.3	Low	105 Å²	105	58.8 Å²	58.8	73%	0.734	37%	0.37	S	S	*	.	S	Bend	trans	-68.2	7.6	171.6	55.9	0	0	0	0	113.7	I538	S536-I538 VanDerWaalsContact C-N 3.31Å; S536-I538 PolarHBondContact O-N 2.93Å
537	N	41.2	Very low	66.2	Low	136 Å²	136	60.6 Å²	60.6	73%	0.727	38%	0.381	S	S	*	.			trans	-91.2	69.4	178.2	-74.8	-9.8	0	0	0	109.6	S535 G539	S535-N537 PolarHBondContact O-N 2.78Å; N537-G539 PolarHBondContact O-N 2.81Å
538	I	42.9	Very low	66.1	Low	136 Å²	136	63.6 Å²	63.6	70%	0.697	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	14.6	-171.7	-70.3	149.7	0	0	0	113.6	S536	S536-I538 VanDerWaalsContact C-N 3.31Å; S536-I538 PolarHBondContact O-N 2.93Å
539	G	39.3	Very low	66.1	Low	64 Å²	64	63.7 Å²	63.7	66%	0.66	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-31	-166.4	0	0	0	0	0	117.7	N537	N537-G539 PolarHBondContact O-N 2.81Å
540	D	42.1	Very low	65.9	Low	151 Å²	151	65.5 Å²	65.5	81%	0.807	41%	0.413	S	S	*	.	S	Bend	trans	-110.8	104.6	-161.9	-75.8	-24.1	0	0	0	111.6	S542	D540-S542 PolarHBondContact O-N 2.86Å; D540-S542 VanDerWaalsContact O-N 3.13Å
541	T	47.8	Very low	65.6	Low	131 Å²	131	68.5 Å²	68.5	80%	0.804	43%	0.432	S	S	*	.			trans	15.2	88.9	151.6	53.7	0	0	0	0	114.3	A543	T541-A543 PolarHBondContact O-N 3.26Å
542	S	55.3	Low	65.4	Low	55 Å²	55	69 Å²	69	39%	0.385	44%	0.44	S	S	.	.			trans	-60.9	113.5	158.5	47.5	0	0	0	0	106	L529 P530 D540 E544	L529-S542 WeakPolarHBondContact CD1-O 3.46Å; L529-S542 WeakPolarHBondContact CD1-OG 3.33Å; P530-S542 WeakPolarHBondContact O-CB 3.28Å; P530-S542 PolarHBondContact O-OG 2.82Å; D540-S542 PolarHBondContact O-N 2.86Å; D540-S542 VanDerWaalsContact O-N 3.13Å; S542-E544 PolarHBondContact O-N 2.96Å
543	A	65.8	Low	66.2	Low	31 Å²	31	66.2 Å²	66.2	26%	0.256	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-56.3	126.8	177.7	0	0	0	0	0	107.5	P530 T541	P530-A543 WeakPolarHBondContact CD-O 3.43Å; T541-A543 PolarHBondContact O-N 3.26Å
544	E	77.6	Confident	67.8	Low	77 Å²	77	63.9 Å²	63.9	36%	0.36	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-74.2	123.4	171.8	-177.8	-175.7	-160.1	0	0	107.9	Y487 A527 L529 S542 T546 N600	Y487-E544 PolarHBondContact OH-OE1 2.79Å; A527-E544 HydrophobicContact CB-CG 3.95Å; A527-E544 WeakPolarHBondContact CB-OE1 3.35Å; L529-E544 HydrophobicContact CD1-CB 4.38Å; S542-E544 PolarHBondContact O-N 2.96Å; E544-T546 HydrophobicContact CG-CG2 3.79Å; E544-N600 WeakPolarHBondContact O-CB 2.9Å
545	W	87.8	Confident	69.7	Low	15 Å²	15	60.6 Å²	60.6	6%	0.057	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	121.9	178.1	-73.4	49.6	0	0	0	108.7	A527 I528 P590 A597 N600 N601 L602 H603	A527-W545 CarbonylContact C-O 3.56Å; A527-W545 VanDerWaalsContact CA-O 3.31Å; A527-W545 WeakPolarHBondContact CA-O 3.49Å; I528-W545 PolarHBondContact N-O 3.24Å; I528-W545 PolarHBondContact O-N 2.93Å; W545-P590 HydrophobicContact CB-CG 4.15Å; W545-P590 HydrophobicContact CD2-CB 3.66Å; W545-P590 HydrophobicContact CD2-CG 4.08Å; W545-P590 HydrophobicContact CE3-CB 4.11Å; W545-P590 HydrophobicContact CG-CB 3.92Å; W545-P590 HydrophobicContact CG-CG 3.82Å; W545-P590 HydrophobicContact CZ2-CB 4.15Å; W545-A597 HydrophobicContact CH2-CB 4.25Å; W545-N600 CarbonylContact C-O 3.6Å; W545-N600 WeakPolarHBondContact CA-O 3.47Å; W545-N601 VanDerWaalsContact CZ3-O 3.31Å; W545-N601 WeakPolarHBondContact CZ3-O 3.46Å; W545-L602 HydrophobicContact CB-CD1 4.45Å; W545-H603 AromaticContact CZ3-CD2 3.69Å; W545-H603 AromaticContact CZ3-NE2 3.73Å
546	T	88.8	Confident	71.9	Confident	38 Å²	38	58.4 Å²	58.4	23%	0.233	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	156.1	-174.2	69.8	0	0	0	0	111.8	I526 A527 E544 N600 L602	I526-T546 CarbonylContact O-C 3.53Å; I526-T546 VanDerWaalsContact O-CA 3.24Å; I526-T546 WeakPolarHBondContact O-CA 3.32Å; A527-T546 HydrophobicContact CB-CG2 3.87Å; E544-T546 HydrophobicContact CG-CG2 3.79Å; T546-N600 PolarHBondContact N-O 2.77Å; T546-L602 PolarHBondContact O-N 3.07Å
547	T	91.8	Very high	74.2	Confident	38 Å²	38	53.4 Å²	53.4	23%	0.233	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	157.6	167.6	-171.8	0	0	0	0	109	I526 F587 L602	I526-T547 HydrophobicContact CB-CG2 3.99Å; I526-T547 HydrophobicContact CD1-CG2 4.16Å; I526-T547 PolarHBondContact N-O 3.23Å; I526-T547 PolarHBondContact O-N 2.67Å; T547-F587 HydrophobicContact CG2-CE1 3.84Å; T547-F587 HydrophobicContact CG2-CZ 4.04Å; T547-L602 HydrophobicContact CG2-CB 3.82Å; T547-L602 HydrophobicContact CG2-CD2 3.76Å; T547-L602 HydrophobicContact CG2-CG 4.36Å
548	T	90.9	Very high	76.8	Confident	64 Å²	64	47 Å²	47	39%	0.393	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	151.8	169.4	51.1	0	0	0	0	110.3	L523 S524 R525	L523-T548 HydrophobicContact CB-CG2 4.46Å; S524-T548 CarbonylContact O-C 3.59Å; S524-T548 VanDerWaalsContact O-CA 3.32Å; S524-T548 WeakPolarHBondContact O-CA 3.37Å; R525-T548 HydrophobicContact CG-CG2 4.42Å
549	L	90.7	Very high	79.3	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.016	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-80.1	155.2	167.7	-63.6	-175.1	0	0	0	110.3	S524 I526 E553 C555 V577 T579	S524-L549 PolarHBondContact O-N 3.07Å; I526-L549 HydrophobicContact CD1-CD1 4.36Å; I526-L549 HydrophobicContact CD1-CD2 3.5Å; I526-L549 VanDerWaalsContact CD1-CD2 3.5Å; I526-L549 HydrophobicContact CD1-CG 3.79Å; L549-E553 HydrophobicContact CD1-CG 4.43Å; L549-C555 HydrophobicContact CD1-CB 3.99Å; L549-V577 HydrophobicContact CD1-CG1 4.41Å; L549-T579 HydrophobicContact CD1-CG2 3.87Å
550	P	85.9	Confident	81.9	Confident	56 Å²	56	37.8 Å²	37.8	36%	0.364	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-58.3	152.3	173.6	-23.4	34.7	0	0	0	112.6	E553	P550-E553 WeakPolarHBondContact O-CB 3.45Å; P550-E553 PolarHBondContact O-N 2.78Å; P550-E553 VanDerWaalsContact O-N 3.12Å
551	P	80.3	Confident	84.2	Confident	66 Å²	66	30.6 Å²	30.6	43%	0.429	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	141.8	174.7	-24	31.3	0	0	0	113.1	Y521 L523 E553	Y521-P551 HydrophobicContact CD2-CB 4.41Å; L523-P551 HydrophobicContact CD2-CB 4.08Å; L523-P551 HydrophobicContact CD2-CG 3.93Å; P551-E553 PolarHBondContact O-N 3.09Å
552	G	78.8	Confident	85.8	Confident	21 Å²	21	26.2 Å²	26.2	22%	0.216	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	0.2	-176.2	0	0	0	0	0	115.1	K581	G552-K581 WeakPolarHBondContact O-CE 3.31Å; G552-K581 PolarHBondContact O-NZ 2.75Å
553	E	87	Confident	86.8	Confident	13 Å²	13	24.9 Å²	24.9	6%	0.061	15%	0.151	C	C	.	.			trans	-107.2	105.4	174.3	-169.8	171.9	174.4	0	0	111	S524 L549 P550 P551 T579 K581 R585	S524-E553 PolarHBondContact OG-O 2.87Å; L549-E553 HydrophobicContact CD1-CG 4.43Å; P550-E553 WeakPolarHBondContact O-CB 3.45Å; P550-E553 PolarHBondContact O-N 2.78Å; P550-E553 VanDerWaalsContact O-N 3.12Å; P551-E553 PolarHBondContact O-N 3.09Å; E553-T579 VanDerWaalsContact CG-CB 3.49Å; E553-T579 HydrophobicContact CG-CG2 3.95Å; E553-T579 WeakPolarHBondContact OE1-CB 2.81Å; E553-T579 WeakPolarHBondContact OE1-CG2 3.25Å; E553-T579 PolarHBondContact OE1-OG1 3Å; E553-K581 HydrophobicContact CB-CG 4.12Å; E553-K581 HydrophobicContact CG-CB 4.26Å; E553-K581 HydrophobicContact CG-CG 3.94Å; E553-R585 VanDerWaalsContact CD-NE 3.34Å; E553-R585 IonicContact OE1-CZ 2.84Å; E553-R585 IonicContact OE1-NE 2.81Å; E553-R585 PolarHBondContact OE1-NE 2.9Å; E553-R585 IonicContact OE1-NH2 3.52Å; E553-R585 IonicContact OE2-CZ 3.32Å; E553-R585 IonicContact OE2-NE 3.34Å; E553-R585 PolarHBondContact OE2-NE 3.07Å; E553-R585 IonicContact OE2-NH2 3.26Å; E553-R585 PolarHBondContact OE2-NH2 2.96Å
554	L	89.5	Confident	86.7	Confident	21 Å²	21	27.3 Å²	27.3	11%	0.11	16%	0.157	C	C	.	.			trans	-86.4	145	-179.2	-51.7	-179.7	0	0	0	110.9	K502 S504 D505 S524 T579 S580	K502-L554 HydrophobicContact CG-CB 4.41Å; K502-L554 WeakPolarHBondContact O-CA 3.49Å; K502-L554 WeakPolarHBondContact O-CB 3.41Å; S504-L554 WeakPolarHBondContact O-CD2 3.46Å; D505-L554 HydrophobicContact CB-CD1 3.7Å; D505-L554 HydrophobicContact CB-CD2 4.02Å; D505-L554 HydrophobicContact CB-CG 4.19Å; S524-L554 VanDerWaalsContact OG-CA 3.27Å; S524-L554 WeakPolarHBondContact OG-CA 3.11Å; L554-T579 CarbonylContact O-C 3.57Å; L554-T579 WeakPolarHBondContact O-CA 3.44Å; L554-T579 WeakPolarHBondContact O-CB 3.2Å; L554-S580 PolarHBondContact N-OG 3.17Å; L554-S580 PolarHBondContact O-N 3.27Å
555	C	91.9	Very high	85.6	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.5	170	-179.9	0	0	0	0	110.3	M489 S501 K502 S524 L549 V577	M489-C555 HydrophobicContact CE-CB 3.85Å; M489-C555 WeakPolarHBondContact CE-O 3.46Å; M489-C555 WeakPolarHBondContact CE-SG 3.34Å; S501-C555 WeakPolarHBondContact O-CB 3.4Å; K502-C555 WeakPolarHBondContact CG-O 3.23Å; K502-C555 PolarHBondContact O-N 3.38Å; S524-C555 PolarHBondContact OG-N 3.34Å; L549-C555 HydrophobicContact CD1-CB 3.99Å; C555-V577 HydrophobicContact CB-CG1 4.3Å; C555-V577 WeakPolarHBondContact SG-CG1 3.41Å
556	D	89.9	Confident	83.8	Confident	6 Å²	6	31.1 Å²	31.1	3%	0.032	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-39.5	-177.5	-78.3	-39.8	0	0	0	114.1	A419 K502 A578 T579 S580 H621	A419-D556 HydrophobicContact CB-CB 4.02Å; A419-D556 WeakPolarHBondContact CB-O 3.26Å; K502-D556 WeakPolarHBondContact CE-OD1 3.43Å; K502-D556 IonicContact NZ-OD1 3.91Å; K502-D556 PolarHBondContact NZ-OD1 3.02Å; D556-A578 PolarHBondContact N-O 2.54Å; D556-T579 VanDerWaalsContact OD2-C 3.31Å; D556-S580 WeakPolarHBondContact OD2-CA 3.47Å; D556-S580 PolarHBondContact OD2-N 3.16Å; D556-S580 VanDerWaalsContact OD2-N 3.07Å; D556-H621 VanDerWaalsContact CG-NE2 3.34Å; D556-H621 IonicContact OD1-CE1 3.79Å; D556-H621 PolarHBondContact OD1-CE1 3.05Å; D556-H621 IonicContact OD1-NE2 3.03Å; D556-H621 PolarHBondContact OD1-NE2 3.38Å; D556-H621 IonicContact OD2-CD2 2.65Å; D556-H621 IonicContact OD2-CE1 2.68Å; D556-H621 PolarHBondContact OD2-CE1 3.17Å; D556-H621 IonicContact OD2-ND1 3.83Å; D556-H621 IonicContact OD2-NE2 3.71Å; D556-H621 PolarHBondContact OD2-NE2 2.86Å
557	A	92.7	Very high	81.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	152.7	178.5	0	0	0	0	0	110.8	A578 L625	A557-A578 HydrophobicContact CB-CB 4.3Å; A557-A578 PolarHBondContact N-O 3.02Å; A557-A578 PolarHBondContact O-N 2.83Å; A557-L625 HydrophobicContact CB-CD1 4.1Å; A557-L625 HydrophobicContact CB-CG 3.97Å
558	V	95.5	Very high	80	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.9	-177.6	-63.2	0	0	0	0	111.4	Q421 M489 L498 A500 V576 V577	Q421-V558 PolarHBondContact NE2-O 3.17Å; Q421-V558 PolarHBondContact OE1-O 3.07Å; Q421-V558 VanDerWaalsContact OE1-O 3.13Å; M489-V558 HydrophobicContact CB-CG2 4.06Å; L498-V558 HydrophobicContact CD2-CB 3.73Å; L498-V558 HydrophobicContact CD2-CG2 4.26Å; L498-V558 HydrophobicContact CG-CB 4.23Å; L498-V558 HydrophobicContact CG-CG2 4.42Å; A500-V558 HydrophobicContact CB-CG1 3.63Å; V558-V576 CarbonylContact C-O 3.54Å; V558-V576 WeakPolarHBondContact CA-O 3.27Å; V558-V577 HydrophobicContact CG1-CG1 4.36Å; V558-V577 HydrophobicContact CG1-CG2 4.15Å
559	C	95	Very high	78.1	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.014	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	136.4	177.7	-169.7	0	0	0	0	111.9	D491 V576 L625 S627 L634	D491-C559 WeakPolarHBondContact OD2-CA 3.41Å; C559-V576 PolarHBondContact N-O 2.75Å; C559-V576 PolarHBondContact O-N 2.95Å; C559-L625 HydrophobicContact CB-CB 3.66Å; C559-L625 HydrophobicContact CB-CD1 3.94Å; C559-L625 HydrophobicContact CB-CG 4.47Å; C559-S627 VanDerWaalsContact SG-CB 3.51Å; C559-S627 PolarHBondContact SG-N 2.85Å; C559-L634 HydrophobicContact CB-CD1 4.12Å
560	L	93.9	Very high	76.2	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	127.6	169.3	-72	169.8	0	0	0	109.6	D491 A496 L498 A575 S627	D491-L560 HydrophobicContact CB-CD1 4.39Å; D491-L560 HydrophobicContact CB-CG 4.31Å; D491-L560 PolarHBondContact OD2-N 3.35Å; A496-L560 HydrophobicContact CB-CD1 4.36Å; A496-L560 HydrophobicContact CB-CD2 4.38Å; A496-L560 WeakPolarHBondContact O-CD1 3.28Å; L498-L560 HydrophobicContact CB-CD1 3.89Å; L498-L560 HydrophobicContact CB-CD2 3.9Å; L498-L560 HydrophobicContact CB-CG 3.77Å; L498-L560 HydrophobicContact CD2-CD2 4.11Å; L498-L560 HydrophobicContact CD2-CG 4.02Å; L560-A575 HydrophobicContact CD2-CB 4.02Å; L560-S627 WeakPolarHBondContact O-CB 3.07Å; L560-S627 PolarHBondContact O-OG 3.45Å
561	V	90.4	Very high	74.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.7	-179.9	-178.3	0	0	0	0	108.5	G573 Y574 V576 P632 L634 L652	V561-G573 CarbonylContact O-C 3.51Å; V561-G573 VanDerWaalsContact O-CA 3.27Å; V561-G573 WeakPolarHBondContact O-CA 3.15Å; V561-Y574 PolarHBondContact N-O 3.31Å; V561-Y574 PolarHBondContact O-N 2.87Å; V561-V576 HydrophobicContact CG2-CG2 3.85Å; V561-P632 HydrophobicContact CG1-CB 4.47Å; V561-L634 HydrophobicContact CG2-CB 4.26Å; V561-L634 HydrophobicContact CG2-CD1 3.95Å; V561-L652 HydrophobicContact CB-CD1 4.39Å; V561-L652 HydrophobicContact CG1-CD1 4.21Å; V561-L652 HydrophobicContact CG2-CD1 4.14Å
562	T	83.2	Confident	74.3	Confident	39 Å²	39	45.1 Å²	45.1	24%	0.239	24%	0.241	C	C	.	.			trans	-73.6	150.3	177.9	51.7	0	0	0	0	111.2	H628 S630 N631 P632	T562-H628 PolarHBondContact OG1-O 2.87Å; T562-S630 WeakPolarHBondContact OG1-CA 3.46Å; T562-S630 PolarHBondContact OG1-N 2.7Å; T562-N631 PolarHBondContact OG1-N 2.9Å; T562-P632 WeakPolarHBondContact O-CA 3.38Å; T562-P632 VanDerWaalsContact O-CB 3.32Å; T562-P632 WeakPolarHBondContact O-CB 3.27Å
563	E	75.3	Confident	74.5	Confident	27 Å²	27	44.2 Å²	44.2	13%	0.126	23%	0.232	C	C	.	.			trans	-88.2	155.7	172.1	-162.7	175.1	-163.8	0	0	111.3	G565 S571 Y574	E563-G565 PolarHBondContact O-N 3.08Å; E563-S571 VanDerWaalsContact OE2-CB 3.27Å; E563-S571 WeakPolarHBondContact OE2-CB 3.47Å; E563-Y574 HydrophobicContact CB-CE2 4.38Å; E563-Y574 HydrophobicContact CG-CE2 4.1Å; E563-Y574 PolarHBondContact OE1-OH 3.11Å
564	E	63.3	Low	74.6	Confident	82 Å²	82	43.6 Å²	43.6	38%	0.383	23%	0.229	S	C	.	.	S	Bend	trans	-71.7	108.9	166.8	-111.7	168.3	-141.9	0	0	110.2	P632 Y651	E564-P632 HydrophobicContact CB-CG 4.07Å; E564-P632 HydrophobicContact CG-CG 3.97Å; E564-Y651 WeakPolarHBondContact OE1-CE2 3.35Å; E564-Y651 VanDerWaalsContact OE1-CZ 3.29Å; E564-Y651 PolarHBondContact OE1-OH 3.46Å; E564-Y651 PolarHBondContact OE2-OH 3.33Å
565	G	56.1	Low	74.8	Confident	26 Å²	26	42.6 Å²	42.6	27%	0.268	22%	0.223	S	C	.	.			trans	-168.5	144.7	176	0	0	0	0	0	113	E563 D567	E563-G565 PolarHBondContact O-N 3.08Å; G565-D567 VanDerWaalsContact C-N 3.33Å
566	N	49.4	Very low	74.9	Confident	146 Å²	146	42.6 Å²	42.6	78%	0.781	22%	0.223	S	C	*	.	S	Bend	trans	-67.7	-36.1	173.4	-95.7	24.5	0	0	0	111.7	T845	N566-T845 PolarHBondContact OD1-O 2.9Å; N566-T845 VanDerWaalsContact OD1-O 3.12Å
567	D	49.5	Very low	75	Confident	92 Å²	92	42.3 Å²	42.3	49%	0.492	22%	0.222	S	C	.	.			trans	-99.1	92	-179.7	-121.6	-37.4	0	0	0	109.6	G565 T569 E570	G565-D567 VanDerWaalsContact C-N 3.33Å; D567-T569 PolarHBondContact O-N 3.06Å; D567-T569 PolarHBondContact OD1-OG1 3.19Å; D567-E570 PolarHBondContact O-N 2.97Å; D567-E570 VanDerWaalsContact O-N 3.13Å
568	R	50.8	Low	75	Confident	156 Å²	156	42.3 Å²	42.3	59%	0.589	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-17.7	173.1	-70.7	-176.6	173.6	-179.2	-0.5	113
569	T	50.7	Low	74.8	Confident	89 Å²	89	42.3 Å²	42.3	55%	0.546	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-27.4	-177.1	61.5	0	0	0	0	113.5	D567	D567-T569 PolarHBondContact O-N 3.06Å; D567-T569 PolarHBondContact OD1-OG1 3.19Å
570	E	51.5	Low	74.3	Confident	155 Å²	155	44.2 Å²	44.2	72%	0.724	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.7	-20.8	-170.1	-68.4	-164.7	162.6	0	0	115.1	D567 P572	D567-E570 PolarHBondContact O-N 2.97Å; D567-E570 VanDerWaalsContact O-N 3.13Å; E570-P572 VanDerWaalsContact O-CD 3.26Å; E570-P572 WeakPolarHBondContact O-CD 3.18Å
571	S	57.8	Low	73.7	Confident	34 Å²	34	50 Å²	50	24%	0.238	26%	0.26	C	S	.	.	S	Bend	trans	-108.9	94.1	-174	67.2	0	0	0	0	111.1	E563	E563-S571 VanDerWaalsContact OE2-CB 3.27Å; E563-S571 WeakPolarHBondContact OE2-CB 3.47Å
572	P	69	Low	73.3	Confident	32 Å²	32	51.8 Å²	51.8	21%	0.208	27%	0.267	C	S	.	.			trans	-68.6	138.8	-177.4	31.8	-36.5	0	0	0	110	E570 Q589	E570-P572 VanDerWaalsContact O-CD 3.26Å; E570-P572 WeakPolarHBondContact O-CD 3.18Å; P572-Q589 HydrophobicContact CB-CB 4.03Å; P572-Q589 HydrophobicContact CB-CG 4.36Å; P572-Q589 WeakPolarHBondContact CB-O 3.15Å; P572-Q589 WeakPolarHBondContact CG-O 3.2Å
573	G	83.1	Confident	73.5	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.021	26%	0.264	C	S	.	.			trans	-68.4	-159.9	-176.9	0	0	0	0	0	114.6	V561 Q589	V561-G573 CarbonylContact O-C 3.51Å; V561-G573 VanDerWaalsContact O-CA 3.27Å; V561-G573 WeakPolarHBondContact O-CA 3.15Å; G573-Q589 WeakPolarHBondContact O-CB 3.47Å; G573-Q589 PolarHBondContact O-N 2.99Å
574	Y	89.3	Confident	74.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	143.3	176.7	-53.2	-82.7	0	0	0	110	V561 E563 I586 F587 L605 P632 L652 I655 M656	V561-Y574 PolarHBondContact N-O 3.31Å; V561-Y574 PolarHBondContact O-N 2.87Å; E563-Y574 HydrophobicContact CB-CE2 4.38Å; E563-Y574 HydrophobicContact CG-CE2 4.1Å; E563-Y574 PolarHBondContact OE1-OH 3.11Å; Y574-I586 HydrophobicContact CD1-CG2 4.02Å; Y574-I586 HydrophobicContact CG-CG2 4.33Å; Y574-F587 WeakPolarHBondContact CA-O 3.47Å; Y574-L605 HydrophobicContact CD1-CD1 3.6Å; Y574-L605 HydrophobicContact CE1-CD1 3.62Å; Y574-P632 HydrophobicContact CE2-CB 4.47Å; Y574-L652 HydrophobicContact CD2-CB 4.3Å; Y574-L652 HydrophobicContact CE2-CB 4.42Å; Y574-I655 HydrophobicContact CE1-CB 3.92Å; Y574-I655 HydrophobicContact CE1-CG2 4.2Å; Y574-M656 HydrophobicContact CE1-CG 3.72Å; Y574-M656 WeakPolarHBondContact OH-CG 3.3Å; Y574-M656 PolarHBondContact OH-N 2.84Å
575	A	92.1	Very high	75.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125.5	165.7	0	0	0	0	0	109.5	L498 I528 L560 F587	L498-A575 HydrophobicContact CD1-CB 4.32Å; L498-A575 HydrophobicContact CD2-CB 4.15Å; I528-A575 HydrophobicContact CD1-CB 3.23Å; I528-A575 HydrophobicContact CG1-CB 4.41Å; L560-A575 HydrophobicContact CD2-CB 4.02Å; A575-F587 HydrophobicContact CB-CB 4.38Å; A575-F587 PolarHBondContact N-O 2.92Å; A575-F587 PolarHBondContact O-N 3.42Å
576	V	93.6	Very high	77.2	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.5	-177.3	-174.5	0	0	0	0	109.2	V558 C559 V561 L584 R585 I586 L625 L634 L652	V558-V576 CarbonylContact C-O 3.54Å; V558-V576 WeakPolarHBondContact CA-O 3.27Å; C559-V576 PolarHBondContact N-O 2.75Å; C559-V576 PolarHBondContact O-N 2.95Å; V561-V576 HydrophobicContact CG2-CG2 3.85Å; V576-L584 HydrophobicContact CG1-CB 4.31Å; V576-L584 HydrophobicContact CG1-CD2 4.07Å; V576-R585 WeakPolarHBondContact CA-O 3.45Å; V576-I586 HydrophobicContact CG2-CG1 4.35Å; V576-L625 HydrophobicContact CG1-CD1 4.43Å; V576-L634 HydrophobicContact CB-CD2 4.41Å; V576-L634 HydrophobicContact CG1-CD2 3.82Å; V576-L634 HydrophobicContact CG2-CD2 4.27Å; V576-L652 HydrophobicContact CG2-CD1 3.94Å
577	V	94	Very high	79.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.2	176.3	-178.1	0	0	0	0	109.2	I526 L549 C555 V558 T579 L584 R585 F587	I526-V577 HydrophobicContact CD1-CB 4.24Å; I526-V577 HydrophobicContact CD1-CG1 4.06Å; I526-V577 HydrophobicContact CD1-CG2 3.78Å; I526-V577 HydrophobicContact CG1-CG1 4.5Å; I526-V577 HydrophobicContact CG1-CG2 4.11Å; I526-V577 HydrophobicContact CG2-CG2 4.2Å; L549-V577 HydrophobicContact CD1-CG1 4.41Å; C555-V577 HydrophobicContact CB-CG1 4.3Å; C555-V577 WeakPolarHBondContact SG-CG1 3.41Å; V558-V577 HydrophobicContact CG1-CG1 4.36Å; V558-V577 HydrophobicContact CG1-CG2 4.15Å; V577-T579 HydrophobicContact CG1-CG2 4.3Å; V577-L584 WeakPolarHBondContact O-CA 3.43Å; V577-R585 HydrophobicContact CB-CB 4.49Å; V577-R585 PolarHBondContact N-O 2.99Å; V577-R585 PolarHBondContact O-N 3.27Å; V577-F587 HydrophobicContact CB-CE2 4.25Å; V577-F587 HydrophobicContact CG2-CD2 4.21Å; V577-F587 HydrophobicContact CG2-CE2 3.96Å
578	A	92.3	Very high	80.9	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	139.4	170.8	0	0	0	0	0	110.6	D556 A557 L583 L584 T622 L625	D556-A578 PolarHBondContact N-O 2.54Å; A557-A578 HydrophobicContact CB-CB 4.3Å; A557-A578 PolarHBondContact N-O 3.02Å; A557-A578 PolarHBondContact O-N 2.83Å; A578-L583 WeakPolarHBondContact CA-O 3.08Å; A578-L584 HydrophobicContact CB-CD2 3.78Å; A578-T622 HydrophobicContact CB-CG2 3.63Å; A578-L625 HydrophobicContact CB-CD1 3.98Å; A578-L625 HydrophobicContact CB-CD2 4.36Å; A578-L625 HydrophobicContact CB-CG 4.41Å
579	T	89.8	Confident	82.5	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	162.9	-171.2	76.8	0	0	0	0	114.1	L549 E553 L554 D556 V577 K581 R582 L583 R585	L549-T579 HydrophobicContact CD1-CG2 3.87Å; E553-T579 VanDerWaalsContact CG-CB 3.49Å; E553-T579 HydrophobicContact CG-CG2 3.95Å; E553-T579 WeakPolarHBondContact OE1-CB 2.81Å; E553-T579 WeakPolarHBondContact OE1-CG2 3.25Å; E553-T579 PolarHBondContact OE1-OG1 3Å; L554-T579 CarbonylContact O-C 3.57Å; L554-T579 WeakPolarHBondContact O-CA 3.44Å; L554-T579 WeakPolarHBondContact O-CB 3.2Å; D556-T579 VanDerWaalsContact OD2-C 3.31Å; V577-T579 HydrophobicContact CG1-CG2 4.3Å; T579-K581 PolarHBondContact O-N 2.84Å; T579-R582 PolarHBondContact O-N 3.2Å; T579-L583 PolarHBondContact N-O 3.12Å; T579-L583 PolarHBondContact OG1-N 2.88Å; T579-L583 PolarHBondContact OG1-O 3.05Å; T579-R585 HydrophobicContact CG2-CG 4.46Å
580	S	85.2	Confident	83.7	Confident	42 Å²	42	25 Å²	25	29%	0.294	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.1	177.1	64.3	0	0	0	0	112.9	L554 D556 R582	L554-S580 PolarHBondContact N-OG 3.17Å; L554-S580 PolarHBondContact O-N 3.27Å; D556-S580 WeakPolarHBondContact OD2-CA 3.47Å; D556-S580 PolarHBondContact OD2-N 3.16Å; D556-S580 VanDerWaalsContact OD2-N 3.07Å; S580-R582 PolarHBondContact O-N 3.19Å
581	K	82	Confident	84.6	Confident	125 Å²	125	18.6 Å²	18.6	54%	0.543	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	12	174.5	-58.7	-67.3	171.4	-179.8	0	113.4	G552 E553 T579 L583	G552-K581 WeakPolarHBondContact O-CE 3.31Å; G552-K581 PolarHBondContact O-NZ 2.75Å; E553-K581 HydrophobicContact CB-CG 4.12Å; E553-K581 HydrophobicContact CG-CB 4.26Å; E553-K581 HydrophobicContact CG-CG 3.94Å; T579-K581 PolarHBondContact O-N 2.84Å; K581-L583 VanDerWaalsContact C-N 3.29Å; K581-L583 HydrophobicContact CB-CD1 4.37Å; K581-L583 HydrophobicContact CB-CG 4.34Å; K581-L583 PolarHBondContact O-N 3.31Å
582	R	81.3	Confident	84.7	Confident	39 Å²	39	19.2 Å²	19.2	15%	0.147	10%	0.102	C	C	.	.	S	Bend	trans	63.9	37	175.5	-167.6	169.4	-174.5	-141.5	-5.2	112.1	T579 S580 L610 G611 S612 H620	T579-R582 PolarHBondContact O-N 3.2Å; S580-R582 PolarHBondContact O-N 3.19Å; R582-L610 VanDerWaalsContact CD-O 3.25Å; R582-L610 WeakPolarHBondContact CD-O 3.47Å; R582-L610 HydrophobicContact CG-CB 3.64Å; R582-L610 HydrophobicContact CG-CD1 4.36Å; R582-L610 VanDerWaalsContact CG-O 3.31Å; R582-L610 WeakPolarHBondContact CG-O 3.41Å; R582-L610 PolarHBondContact NE-O 3.39Å; R582-L610 PolarHBondContact NH1-O 3.13Å; R582-L610 PolarHBondContact NH2-O 3.25Å; R582-L610 PolarHBondContact O-N 2.83Å; R582-G611 PolarHBondContact NH2-O 3.15Å; R582-S612 VanDerWaalsContact NH1-CB 3.3Å; R582-S612 VanDerWaalsContact NH1-N 3.14Å; R582-S612 PolarHBondContact NH1-OG 3.44Å; R582-S612 VanDerWaalsContact NH2-CA 3.29Å; R582-H620 PolarHBondContact NH2-CD2 3.06Å
583	L	86.7	Confident	84.2	Confident	33 Å²	33	22.1 Å²	22.1	17%	0.173	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.2	175.3	-56.6	177.3	0	0	0	109.4	A578 T579 K581 I607 N608 K609	A578-L583 WeakPolarHBondContact CA-O 3.08Å; T579-L583 PolarHBondContact N-O 3.12Å; T579-L583 PolarHBondContact OG1-N 2.88Å; T579-L583 PolarHBondContact OG1-O 3.05Å; K581-L583 VanDerWaalsContact C-N 3.29Å; K581-L583 HydrophobicContact CB-CD1 4.37Å; K581-L583 HydrophobicContact CB-CG 4.34Å; K581-L583 PolarHBondContact O-N 3.31Å; L583-I607 HydrophobicContact CB-CG2 3.95Å; L583-I607 HydrophobicContact CD1-CG2 3.92Å; L583-I607 HydrophobicContact CD2-CG2 3.89Å; L583-I607 HydrophobicContact CG-CG2 4.13Å; L583-N608 CarbonylContact C-O 3.39Å; L583-N608 WeakPolarHBondContact CA-O 3.13Å; L583-K609 HydrophobicContact CD2-CB 4.2Å; L583-K609 HydrophobicContact CD2-CG 4.36Å
584	L	89.4	Confident	82.7	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	111.4	160.3	-65.7	179.6	0	0	0	107.4	V576 V577 A578 I607 N608 L610 L625 L634 V636 F650	V576-L584 HydrophobicContact CG1-CB 4.31Å; V576-L584 HydrophobicContact CG1-CD2 4.07Å; V577-L584 WeakPolarHBondContact O-CA 3.43Å; A578-L584 HydrophobicContact CB-CD2 3.78Å; L584-I607 CarbonylContact O-C 3.47Å; L584-I607 WeakPolarHBondContact O-CA 3.2Å; L584-N608 HydrophobicContact CB-CB 4.15Å; L584-N608 PolarHBondContact N-O 2.86Å; L584-N608 PolarHBondContact O-N 2.82Å; L584-L610 HydrophobicContact CD1-CD2 3.68Å; L584-L610 HydrophobicContact CD1-CG 4.4Å; L584-L610 HydrophobicContact CD2-CD1 4.22Å; L584-L610 HydrophobicContact CD2-CD2 4.49Å; L584-L610 HydrophobicContact CG-CD1 4.16Å; L584-L610 HydrophobicContact CG-CD2 3.83Å; L584-L610 HydrophobicContact CG-CG 4Å; L584-L625 HydrophobicContact CD2-CD2 4.22Å; L584-L634 HydrophobicContact CD1-CD2 4.02Å; L584-V636 HydrophobicContact CD1-CG2 4.2Å; L584-F650 HydrophobicContact CD1-CE2 4.49Å
585	R	91.4	Very high	80.8	Confident	25 Å²	25	29.3 Å²	29.3	9%	0.094	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	119.4	172.8	-67.1	177.3	172.4	-89.6	-1.2	108.2	E553 V576 V577 T579 F587 L604 I607	E553-R585 VanDerWaalsContact CD-NE 3.34Å; E553-R585 IonicContact OE1-CZ 2.84Å; E553-R585 IonicContact OE1-NE 2.81Å; E553-R585 PolarHBondContact OE1-NE 2.9Å; E553-R585 IonicContact OE1-NH2 3.52Å; E553-R585 IonicContact OE2-CZ 3.32Å; E553-R585 IonicContact OE2-NE 3.34Å; E553-R585 PolarHBondContact OE2-NE 3.07Å; E553-R585 IonicContact OE2-NH2 3.26Å; E553-R585 PolarHBondContact OE2-NH2 2.96Å; V576-R585 WeakPolarHBondContact CA-O 3.45Å; V577-R585 HydrophobicContact CB-CB 4.49Å; V577-R585 PolarHBondContact N-O 2.99Å; V577-R585 PolarHBondContact O-N 3.27Å; T579-R585 HydrophobicContact CG2-CG 4.46Å; R585-F587 HydrophobicContact CB-CD2 4.38Å; R585-F587 HydrophobicContact CB-CE2 3.59Å; R585-F587 HydrophobicContact CB-CZ 4Å; R585-L604 HydrophobicContact CB-CD1 3.93Å; R585-L604 HydrophobicContact CG-CD1 4.4Å; R585-I607 HydrophobicContact CG-CG1 4.43Å
586	I	91.4	Very high	78.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.5	-177.5	-54.5	174.9	0	0	0	107.3	Y574 V576 L605 Q606 N608 L652 I655	Y574-I586 HydrophobicContact CD1-CG2 4.02Å; Y574-I586 HydrophobicContact CG-CG2 4.33Å; V576-I586 HydrophobicContact CG2-CG1 4.35Å; I586-L605 HydrophobicContact CG2-CD1 4.43Å; I586-L605 WeakPolarHBondContact O-CB 3.42Å; I586-L605 PolarHBondContact O-N 2.9Å; I586-Q606 HydrophobicContact CB-CB 4.47Å; I586-Q606 HydrophobicContact CD1-CB 4.45Å; I586-Q606 PolarHBondContact N-O 3.22Å; I586-Q606 PolarHBondContact O-N 3.19Å; I586-N608 WeakPolarHBondContact CD1-ND2 3.33Å; I586-L652 HydrophobicContact CD1-CD1 4.4Å; I586-L652 HydrophobicContact CD1-CD2 3.73Å; I586-I655 HydrophobicContact CD1-CD1 4.36Å
587	F	90.6	Very high	76.5	Confident	5 Å²	5	37 Å²	37	2%	0.022	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	150.2	179	-60.8	-87.9	0	0	0	110.4	I526 T547 Y574 A575 V577 R585 L602 H603 L604	I526-F587 HydrophobicContact CD1-CE2 3.93Å; I526-F587 HydrophobicContact CD1-CZ 4.06Å; T547-F587 HydrophobicContact CG2-CE1 3.84Å; T547-F587 HydrophobicContact CG2-CZ 4.04Å; Y574-F587 WeakPolarHBondContact CA-O 3.47Å; A575-F587 HydrophobicContact CB-CB 4.38Å; A575-F587 PolarHBondContact N-O 2.92Å; A575-F587 PolarHBondContact O-N 3.42Å; V577-F587 HydrophobicContact CB-CE2 4.25Å; V577-F587 HydrophobicContact CG2-CD2 4.21Å; V577-F587 HydrophobicContact CG2-CE2 3.96Å; R585-F587 HydrophobicContact CB-CD2 4.38Å; R585-F587 HydrophobicContact CB-CE2 3.59Å; R585-F587 HydrophobicContact CB-CZ 4Å; F587-L602 HydrophobicContact CB-CD1 4.17Å; F587-L602 HydrophobicContact CB-CD2 3.58Å; F587-L602 HydrophobicContact CB-CG 3.75Å; F587-L602 HydrophobicContact CD1-CB 4.37Å; F587-L602 HydrophobicContact CD1-CD2 3.46Å; F587-L602 VanDerWaalsContact CD1-CD2 3.46Å; F587-L602 HydrophobicContact CD1-CG 3.61Å; F587-L602 HydrophobicContact CD2-CD2 3.98Å; F587-L602 HydrophobicContact CE1-CD2 4.06Å; F587-L602 HydrophobicContact CE1-CG 4.42Å; F587-L602 HydrophobicContact CG-CD2 3.4Å; F587-L602 VanDerWaalsContact CG-CD2 3.4Å; F587-L602 HydrophobicContact CG-CG 3.86Å; F587-H603 VanDerWaalsContact CA-O 3.27Å; F587-H603 WeakPolarHBondContact CA-O 3.18Å; F587-L604 HydrophobicContact CD1-CB 3.95Å; F587-L604 HydrophobicContact CD1-CD1 3.99Å; F587-L604 HydrophobicContact CE1-CB 3.82Å; F587-L604 HydrophobicContact CE1-CD1 3.68Å; F587-L604 HydrophobicContact CE1-CG 4.31Å; F587-L604 HydrophobicContact CE2-CD1 4.32Å; F587-L604 HydrophobicContact CG-CD1 4.44Å; F587-L604 HydrophobicContact CZ-CD1 3.87Å
588	T	87	Confident	74.4	Confident	16 Å²	16	46.3 Å²	46.3	10%	0.098	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	135.1	168.7	61.1	0	0	0	0	109.5	L602 H603 L605 M656	T588-L602 WeakPolarHBondContact O-CD1 3.42Å; T588-H603 HydrophobicContact CG2-CB 4.21Å; T588-H603 PolarHBondContact N-O 3.44Å; T588-L605 HydrophobicContact CG2-CD1 3.58Å; T588-L605 HydrophobicContact CG2-CD2 3.52Å; T588-L605 HydrophobicContact CG2-CG 3.41Å; T588-L605 VanDerWaalsContact CG2-CG 3.41Å; T588-M656 VanDerWaalsContact CB-CE 3.44Å; T588-M656 HydrophobicContact CG2-CE 3.25Å; T588-M656 HydrophobicContact CG2-SD 3.65Å
589	Q	84.8	Confident	73	Confident	7 Å²	7	48.6 Å²	48.6	3%	0.033	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-72.3	133	163.1	-172.4	-178.8	-41.5	0	0	108.8	T495 A496 I528 P572 G573	T495-Q589 PolarHBondContact O-NE2 3.33Å; T495-Q589 PolarHBondContact OG1-NE2 3.5Å; A496-Q589 HydrophobicContact CB-CG 3.73Å; I528-Q589 HydrophobicContact CG2-CG 4.36Å; P572-Q589 HydrophobicContact CB-CB 4.03Å; P572-Q589 HydrophobicContact CB-CG 4.36Å; P572-Q589 WeakPolarHBondContact CB-O 3.15Å; P572-Q589 WeakPolarHBondContact CG-O 3.2Å; G573-Q589 WeakPolarHBondContact O-CB 3.47Å; G573-Q589 PolarHBondContact O-N 2.99Å
590	P	76.4	Confident	72	Confident	7 Å²	7	52.3 Å²	52.3	5%	0.045	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-71.4	149.8	174.4	28.5	-32.1	0	0	0	110.6	I528 P530 W545	I528-P590 HydrophobicContact CB-CG 4.39Å; I528-P590 HydrophobicContact CG2-CG 4.15Å; P530-P590 HydrophobicContact CB-CG 4.24Å; P530-P590 WeakPolarHBondContact CB-O 3.46Å; P530-P590 HydrophobicContact CG-CG 4.1Å; W545-P590 HydrophobicContact CB-CG 4.15Å; W545-P590 HydrophobicContact CD2-CB 3.66Å; W545-P590 HydrophobicContact CD2-CG 4.08Å; W545-P590 HydrophobicContact CE3-CB 4.11Å; W545-P590 HydrophobicContact CG-CB 3.92Å; W545-P590 HydrophobicContact CG-CG 3.82Å; W545-P590 HydrophobicContact CZ2-CB 4.15Å
591	S	69.5	Low	71.8	Confident	20 Å²	20	55 Å²	55	14%	0.14	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-93.3	141.2	169.8	176.7	0	0	0	0	110.1	S593 S594	S591-S593 PolarHBondContact O-N 2.96Å; S591-S593 PolarHBondContact OG-N 3.48Å; S591-S593 PolarHBondContact OG-OG 3.35Å; S591-S594 WeakPolarHBondContact O-CB 2.98Å; S591-S594 PolarHBondContact O-N 3.47Å
592	P	60.1	Low	71.8	Confident	48 Å²	48	49.7 Å²	49.7	31%	0.312	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-54.5	-34.5	174.6	-21.3	29.1	0	0	0	113.2	P530 D532 S594	P530-P592 HydrophobicContact CB-CG 4.14Å; D532-P592 HydrophobicContact CB-CB 4.18Å; D532-P592 HydrophobicContact CB-CG 4.05Å; P592-S594 VanDerWaalsContact C-N 3.28Å; P592-S594 PolarHBondContact O-N 3.4Å
593	S	58.2	Low	72	Confident	93 Å²	93	52.4 Å²	52.4	65%	0.65	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-75.2	-14.1	179.8	58.9	0	0	0	0	113.8	S591 S595	S591-S593 PolarHBondContact O-N 2.96Å; S591-S593 PolarHBondContact OG-N 3.48Å; S591-S593 PolarHBondContact OG-OG 3.35Å; S593-S595 PolarHBondContact O-N 3.48Å
594	S	51.9	Low	72	Confident	56 Å²	56	54.4 Å²	54.4	39%	0.392	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-80.8	14.9	179.6	-65.9	0	0	0	0	114	S591 P592 V596 A597	S591-S594 WeakPolarHBondContact O-CB 2.98Å; S591-S594 PolarHBondContact O-N 3.47Å; P592-S594 VanDerWaalsContact C-N 3.28Å; P592-S594 PolarHBondContact O-N 3.4Å; S594-V596 PolarHBondContact O-N 3.46Å; S594-A597 PolarHBondContact O-N 3.23Å; S594-A597 VanDerWaalsContact O-N 3.13Å
595	S	49.3	Very low	71.7	Confident	97 Å²	97	57.3 Å²	57.3	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-1.9	178.4	57.1	0	0	0	0	115.2	S593	S593-S595 PolarHBondContact O-N 3.48Å
596	V	46.9	Very low	71.3	Confident	113 Å²	113	59.6 Å²	59.6	69%	0.685	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-11.6	177.1	-171.3	0	0	0	0	113.2	S594 H598	S594-V596 PolarHBondContact O-N 3.46Å; V596-H598 PolarHBondContact O-N 3.25Å; V596-H598 PolarHBondContact O-ND1 3.47Å
597	A	48.6	Very low	71	Confident	47 Å²	47	63.3 Å²	63.3	39%	0.388	36%	0.363	S	S	.	.	S	Bend	trans	-76.9	115.7	173.6	0	0	0	0	0	110.2	W545 S594 S599	W545-A597 HydrophobicContact CH2-CB 4.25Å; S594-A597 PolarHBondContact O-N 3.23Å; S594-A597 VanDerWaalsContact O-N 3.13Å; A597-S599 PolarHBondContact O-N 3.1Å
598	H	50.4	Low	70.6	Confident	196 Å²	196	64.9 Å²	64.9	91%	0.907	37%	0.371	S	S	*	.	S	Bend	trans	-67.1	15.2	-169.9	-70.8	51.7	0	0	0	115.6	V596	V596-H598 PolarHBondContact O-N 3.25Å; V596-H598 PolarHBondContact O-ND1 3.47Å
599	S	61.3	Low	70.2	Confident	48 Å²	48	72 Å²	72	34%	0.336	40%	0.401	S	S	.	.			trans	-139.4	121.6	175.4	64.7	0	0	0	0	110.6	A597 N601	A597-S599 PolarHBondContact O-N 3.1Å; S599-N601 PolarHBondContact O-N 2.96Å
600	N	69.7	Low	69.8	Low	80 Å²	80	71.8 Å²	71.8	43%	0.428	40%	0.4	S	S	.	.			trans	-74.6	36.3	170.8	-66.4	-10.3	0	0	0	111.9	E544 W545 T546	E544-N600 WeakPolarHBondContact O-CB 2.9Å; W545-N600 CarbonylContact C-O 3.6Å; W545-N600 WeakPolarHBondContact CA-O 3.47Å; T546-N600 PolarHBondContact N-O 2.77Å
601	N	80.2	Confident	69	Low	99 Å²	99	73.1 Å²	73.1	53%	0.529	42%	0.415	S	S	.	.	B	Isolated β-bridge	trans	-98.1	127.1	-176.8	-76.9	-11.1	0	0	0	109.7	W545 S599 H603	W545-N601 VanDerWaalsContact CZ3-O 3.31Å; W545-N601 WeakPolarHBondContact CZ3-O 3.46Å; S599-N601 PolarHBondContact O-N 2.96Å; N601-H603 PolarHBondContact O-N 3.48Å
602	L	83.6	Confident	68.3	Low	12 Å²	12	74.7 Å²	74.7	6%	0.063	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-68.2	128.9	179.8	-169.6	66.5	0	0	0	112	I526 I528 W545 T546 T547 F587 T588	I526-L602 HydrophobicContact CG2-CD2 4.01Å; I528-L602 HydrophobicContact CB-CD1 4.37Å; I528-L602 HydrophobicContact CD1-CD1 3.42Å; I528-L602 VanDerWaalsContact CD1-CD1 3.42Å; I528-L602 HydrophobicContact CD1-CD2 3.76Å; I528-L602 HydrophobicContact CD1-CG 4.24Å; I528-L602 HydrophobicContact CG1-CD1 3.89Å; I528-L602 HydrophobicContact CG1-CD2 4.02Å; W545-L602 HydrophobicContact CB-CD1 4.45Å; T546-L602 PolarHBondContact O-N 3.07Å; T547-L602 HydrophobicContact CG2-CB 3.82Å; T547-L602 HydrophobicContact CG2-CD2 3.76Å; T547-L602 HydrophobicContact CG2-CG 4.36Å; F587-L602 HydrophobicContact CB-CD1 4.17Å; F587-L602 HydrophobicContact CB-CD2 3.58Å; F587-L602 HydrophobicContact CB-CG 3.75Å; F587-L602 HydrophobicContact CD1-CB 4.37Å; F587-L602 HydrophobicContact CD1-CD2 3.46Å; F587-L602 VanDerWaalsContact CD1-CD2 3.46Å; F587-L602 HydrophobicContact CD1-CG 3.61Å; F587-L602 HydrophobicContact CD2-CD2 3.98Å; F587-L602 HydrophobicContact CE1-CD2 4.06Å; F587-L602 HydrophobicContact CE1-CG 4.42Å; F587-L602 HydrophobicContact CG-CD2 3.4Å; F587-L602 VanDerWaalsContact CG-CD2 3.4Å; F587-L602 HydrophobicContact CG-CG 3.86Å; T588-L602 WeakPolarHBondContact O-CD1 3.42Å
603	H	84.1	Confident	67.7	Low	97 Å²	97	75.7 Å²	75.7	45%	0.449	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-84.9	119.2	-179.9	-62.4	-68.3	0	0	0	112.1	W545 F587 T588 N601	W545-H603 AromaticContact CZ3-CD2 3.69Å; W545-H603 AromaticContact CZ3-NE2 3.73Å; F587-H603 VanDerWaalsContact CA-O 3.27Å; F587-H603 WeakPolarHBondContact CA-O 3.18Å; T588-H603 HydrophobicContact CG2-CB 4.21Å; T588-H603 PolarHBondContact N-O 3.44Å; N601-H603 PolarHBondContact O-N 3.48Å
604	L	88	Confident	67	Low	74 Å²	74	77.6 Å²	77.6	39%	0.387	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.7	172.2	-179.2	68.2	0	0	0	110.3	R585 F587 I607	R585-L604 HydrophobicContact CB-CD1 3.93Å; R585-L604 HydrophobicContact CG-CD1 4.4Å; F587-L604 HydrophobicContact CD1-CB 3.95Å; F587-L604 HydrophobicContact CD1-CD1 3.99Å; F587-L604 HydrophobicContact CE1-CB 3.82Å; F587-L604 HydrophobicContact CE1-CD1 3.68Å; F587-L604 HydrophobicContact CE1-CG 4.31Å; F587-L604 HydrophobicContact CE2-CD1 4.32Å; F587-L604 HydrophobicContact CG-CD1 4.44Å; F587-L604 HydrophobicContact CZ-CD1 3.87Å; L604-I607 HydrophobicContact CD1-CG1 4.27Å; L604-I607 HydrophobicContact CD2-CD1 3.91Å; L604-I607 HydrophobicContact CD2-CG1 3.86Å; L604-I607 HydrophobicContact CG-CG1 4.41Å
605	L	82.9	Confident	66.5	Low	63 Å²	63	81.2 Å²	81.2	33%	0.33	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-48.6	177.2	-72.4	168.4	0	0	0	112.3	Y574 I586 T588 I655 M656	Y574-L605 HydrophobicContact CD1-CD1 3.6Å; Y574-L605 HydrophobicContact CE1-CD1 3.62Å; I586-L605 HydrophobicContact CG2-CD1 4.43Å; I586-L605 WeakPolarHBondContact O-CB 3.42Å; I586-L605 PolarHBondContact O-N 2.9Å; T588-L605 HydrophobicContact CG2-CD1 3.58Å; T588-L605 HydrophobicContact CG2-CD2 3.52Å; T588-L605 HydrophobicContact CG2-CG 3.41Å; T588-L605 VanDerWaalsContact CG2-CG 3.41Å; L605-I655 HydrophobicContact CB-CG2 4.11Å; L605-I655 HydrophobicContact CD1-CG2 3.88Å; L605-I655 HydrophobicContact CG-CG2 4.43Å; L605-M656 HydrophobicContact CD1-SD 4.01Å; L605-M656 HydrophobicContact CD2-SD 3.92Å
606	Q	83.6	Confident	65.8	Low	74 Å²	74	82.3 Å²	82.3	35%	0.346	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	146.8	-168.6	-175	167.8	-19.7	0	0	111.1	I586 N608	I586-Q606 HydrophobicContact CB-CB 4.47Å; I586-Q606 HydrophobicContact CD1-CB 4.45Å; I586-Q606 PolarHBondContact N-O 3.22Å; I586-Q606 PolarHBondContact O-N 3.19Å; Q606-N608 PolarHBondContact NE2-ND2 3.5Å; Q606-N608 PolarHBondContact NE2-OD1 2.98Å
607	I	84.2	Confident	65.4	Low	77 Å²	77	82.2 Å²	82.2	40%	0.395	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.4	169.5	-55.4	177.4	0	0	0	107.3	L583 L584 R585 L604	L583-I607 HydrophobicContact CB-CG2 3.95Å; L583-I607 HydrophobicContact CD1-CG2 3.92Å; L583-I607 HydrophobicContact CD2-CG2 3.89Å; L583-I607 HydrophobicContact CG-CG2 4.13Å; L584-I607 CarbonylContact O-C 3.47Å; L584-I607 WeakPolarHBondContact O-CA 3.2Å; R585-I607 HydrophobicContact CG-CG1 4.43Å; L604-I607 HydrophobicContact CD1-CG1 4.27Å; L604-I607 HydrophobicContact CD2-CD1 3.91Å; L604-I607 HydrophobicContact CD2-CG1 3.86Å; L604-I607 HydrophobicContact CG-CG1 4.41Å
608	N	82.4	Confident	64.9	Low	39 Å²	39	85.7 Å²	85.7	21%	0.209	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.2	176.3	-77	-33.3	0	0	0	110.2	L583 L584 I586 Q606 L610	L583-N608 CarbonylContact C-O 3.39Å; L583-N608 WeakPolarHBondContact CA-O 3.13Å; L584-N608 HydrophobicContact CB-CB 4.15Å; L584-N608 PolarHBondContact N-O 2.86Å; L584-N608 PolarHBondContact O-N 2.82Å; I586-N608 WeakPolarHBondContact CD1-ND2 3.33Å; Q606-N608 PolarHBondContact NE2-ND2 3.5Å; Q606-N608 PolarHBondContact NE2-OD1 2.98Å; N608-L610 PolarHBondContact O-N 2.85Å
609	K	79.2	Confident	64.9	Low	165 Å²	165	77.8 Å²	77.8	72%	0.717	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.3	170.5	-170.5	172.2	-175.7	174.3	0	108.9	L583 G611	L583-K609 HydrophobicContact CD2-CB 4.2Å; L583-K609 HydrophobicContact CD2-CG 4.36Å; K609-G611 VanDerWaalsContact C-N 3.28Å; K609-G611 PolarHBondContact O-N 3.34Å
610	L	75.2	Confident	64.8	Low	3 Å²	3	77 Å²	77	2%	0.016	44%	0.443	C	S	.	.			trans	-72.6	91.6	166.4	-58	163.7	0	0	0	105.6	R582 L584 N608 T622 V636 T638 F650 W675	R582-L610 VanDerWaalsContact CD-O 3.25Å; R582-L610 WeakPolarHBondContact CD-O 3.47Å; R582-L610 HydrophobicContact CG-CB 3.64Å; R582-L610 HydrophobicContact CG-CD1 4.36Å; R582-L610 VanDerWaalsContact CG-O 3.31Å; R582-L610 WeakPolarHBondContact CG-O 3.41Å; R582-L610 PolarHBondContact NE-O 3.39Å; R582-L610 PolarHBondContact NH1-O 3.13Å; R582-L610 PolarHBondContact NH2-O 3.25Å; R582-L610 PolarHBondContact O-N 2.83Å; L584-L610 HydrophobicContact CD1-CD2 3.68Å; L584-L610 HydrophobicContact CD1-CG 4.4Å; L584-L610 HydrophobicContact CD2-CD1 4.22Å; L584-L610 HydrophobicContact CD2-CD2 4.49Å; L584-L610 HydrophobicContact CG-CD1 4.16Å; L584-L610 HydrophobicContact CG-CD2 3.83Å; L584-L610 HydrophobicContact CG-CG 4Å; N608-L610 PolarHBondContact O-N 2.85Å; L610-T622 WeakPolarHBondContact CD1-OG1 3.44Å; L610-V636 HydrophobicContact CD1-CG1 4.44Å; L610-V636 HydrophobicContact CD2-CG1 4.25Å; L610-T638 HydrophobicContact CD1-CG2 4.34Å; L610-F650 HydrophobicContact CD2-CE2 4.23Å; L610-F650 HydrophobicContact CD2-CZ 3.85Å; L610-W675 HydrophobicContact CB-CZ2 4.18Å; L610-W675 HydrophobicContact CD2-CH2 4.02Å; L610-W675 HydrophobicContact CD2-CZ2 3.76Å
611	G	59.1	Low	65.1	Low	35 Å²	35	75.4 Å²	75.4	36%	0.361	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-72.2	142.4	176	0	0	0	0	0	110.8	R582 K609 W675	R582-G611 PolarHBondContact NH2-O 3.15Å; K609-G611 VanDerWaalsContact C-N 3.28Å; K609-G611 PolarHBondContact O-N 3.34Å; G611-W675 PolarHBondContact O-NE1 3.16Å
612	S	54.6	Low	65.2	Low	52 Å²	52	70.8 Å²	70.8	36%	0.364	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-86.4	165	163.2	46.6	0	0	0	0	109.4	R582	R582-S612 VanDerWaalsContact NH1-CB 3.3Å; R582-S612 VanDerWaalsContact NH1-N 3.14Å; R582-S612 PolarHBondContact NH1-OG 3.44Å; R582-S612 VanDerWaalsContact NH2-CA 3.29Å
613	P	49.1	Very low	65.1	Low	70 Å²	70	70.2 Å²	70.2	46%	0.455	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-52.8	154.1	151.7	-17.5	30.2	0	0	0	110.5	I615	P613-I615 PolarHBondContact O-N 3.33Å
614	P	42.6	Very low	65.5	Low	133 Å²	133	65.6 Å²	65.6	86%	0.864	38%	0.384	S	S	*	.	S	Bend	trans	-68.7	8.4	-166.1	-17.4	30.8	0	0	0	117	S616	P614-S616 PolarHBondContact O-N 2.8Å
615	I	40.8	Very low	65.8	Low	132 Å²	132	62.2 Å²	62.2	68%	0.677	37%	0.366	S	S	*	.	S	Bend	trans	-95.8	93.1	-171.3	-56.9	167.7	0	0	0	109.4	P613 L617	P613-I615 PolarHBondContact O-N 3.33Å; I615-L617 PolarHBondContact O-N 2.77Å
616	S	36.2	Very low	66.4	Low	119 Å²	119	59.6 Å²	59.6	83%	0.832	35%	0.353	S	S	*	.			trans	22.8	18.3	144.8	-162.8	0	0	0	0	123.2	P614 S618	P614-S616 PolarHBondContact O-N 2.8Å; S616-S618 PolarHBondContact O-N 2.82Å
617	L	37.4	Very low	66.8	Low	112 Å²	112	57.6 Å²	57.6	59%	0.586	35%	0.348	S	S	*	.			trans	-94.7	99.2	175.9	-76.4	163.8	0	0	0	110.4	I615 G619 H620	I615-L617 PolarHBondContact O-N 2.77Å; L617-G619 PolarHBondContact O-N 3.18Å; L617-H620 PolarHBondContact O-ND1 2.86Å
618	S	38.5	Very low	67.1	Low	119 Å²	119	54 Å²	54	83%	0.832	33%	0.329	S	S	*	.			trans	-53.2	127.9	160.7	43	0	0	0	0	110.3	S616	S616-S618 PolarHBondContact O-N 2.82Å
619	G	49.4	Very low	67.2	Low	30 Å²	30	54.6 Å²	54.6	31%	0.309	34%	0.335	S	S	.	.			trans	137.9	11	169.8	0	0	0	0	0	118.4	L416 L617 H621 C639	L416-G619 WeakPolarHBondContact CD1-O 3.21Å; L416-G619 VanDerWaalsContact CD2-O 3.28Å; L416-G619 WeakPolarHBondContact CD2-O 3.26Å; L617-G619 PolarHBondContact O-N 3.18Å; G619-H621 PolarHBondContact O-N 2.96Å; G619-C639 VanDerWaalsContact O-O 3.09Å
620	H	59.6	Low	67.2	Low	32 Å²	32	47.1 Å²	47.1	15%	0.148	30%	0.304	C	S	.	.			trans	-83	115.6	-176.6	-66.1	49.7	0	0	0	112.9	R582 L617 C639 N640	R582-H620 PolarHBondContact NH2-CD2 3.06Å; L617-H620 PolarHBondContact O-ND1 2.86Å; H620-C639 CarbonylContact C-O 3.52Å; H620-C639 WeakPolarHBondContact CA-O 3.12Å; H620-N640 PolarHBondContact CD2-OD1 2.9Å; H620-N640 PolarHBondContact CE1-ND2 3.28Å; H620-N640 VanDerWaalsContact CE1-ND2 3.34Å; H620-N640 PolarHBondContact CE1-OD1 3.31Å; H620-N640 PolarHBondContact ND1-OD1 3Å; H620-N640 PolarHBondContact NE2-ND2 3.38Å; H620-N640 PolarHBondContact NE2-OD1 2.95Å
621	H	75.5	Confident	67.5	Low	46 Å²	46	47.2 Å²	47.2	21%	0.213	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	142.2	174.2	-164.2	-77.1	0	0	0	110.5	D556 G619 V623 T638 C639	D556-H621 VanDerWaalsContact CG-NE2 3.34Å; D556-H621 IonicContact OD1-CE1 3.79Å; D556-H621 PolarHBondContact OD1-CE1 3.05Å; D556-H621 IonicContact OD1-NE2 3.03Å; D556-H621 PolarHBondContact OD1-NE2 3.38Å; D556-H621 IonicContact OD2-CD2 2.65Å; D556-H621 IonicContact OD2-CE1 2.68Å; D556-H621 PolarHBondContact OD2-CE1 3.17Å; D556-H621 IonicContact OD2-ND1 3.83Å; D556-H621 IonicContact OD2-NE2 3.71Å; D556-H621 PolarHBondContact OD2-NE2 2.86Å; G619-H621 PolarHBondContact O-N 2.96Å; H621-V623 PolarHBondContact O-N 3.26Å; H621-T638 CarbonylContact O-C 3.16Å; H621-T638 VanDerWaalsContact O-CA 3.32Å; H621-T638 WeakPolarHBondContact O-CA 3.43Å; H621-C639 PolarHBondContact N-O 2.89Å; H621-C639 PolarHBondContact O-N 3.31Å
622	T	82.2	Confident	68.7	Low	3 Å²	3	45.5 Å²	45.5	2%	0.018	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	127.7	171.8	-55.3	0	0	0	0	109	A419 A578 L610 L625 V636	A419-T622 WeakPolarHBondContact CB-O 3.41Å; A578-T622 HydrophobicContact CB-CG2 3.63Å; L610-T622 WeakPolarHBondContact CD1-OG1 3.44Å; T622-L625 HydrophobicContact CG2-CD2 4.09Å; T622-V636 HydrophobicContact CG2-CG1 4.16Å
623	V	82.2	Confident	70.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	-49.1	-176.8	179.3	0	0	0	0	111.2	Q417 A419 F420 H621 V637 C639 L645	Q417-V623 HydrophobicContact CG-CG1 4.11Å; A419-V623 CarbonylContact C-O 3.44Å; A419-V623 WeakPolarHBondContact CA-O 3.42Å; F420-V623 HydrophobicContact CD1-CG1 3.97Å; F420-V623 HydrophobicContact CE1-CG1 3.74Å; F420-V623 PolarHBondContact N-O 3.31Å; H621-V623 PolarHBondContact O-N 3.26Å; V623-V637 HydrophobicContact CB-CG1 4.3Å; V623-V637 PolarHBondContact N-O 2.91Å; V623-C639 HydrophobicContact CG2-CB 3.41Å; V623-C639 VanDerWaalsContact CG2-CB 3.41Å; V623-L645 HydrophobicContact CG2-CD2 4.01Å
624	V	93.1	Very high	72.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	151.4	-174.7	61.9	0	0	0	0	110.4	F420 V637 L697 F700	F420-V624 HydrophobicContact CE1-CB 4.13Å; F420-V624 HydrophobicContact CE1-CG1 4.34Å; F420-V624 HydrophobicContact CE2-CG2 4.26Å; F420-V624 HydrophobicContact CZ-CB 4.15Å; F420-V624 HydrophobicContact CZ-CG1 4.3Å; F420-V624 HydrophobicContact CZ-CG2 4.22Å; V624-V637 HydrophobicContact CG1-CB 3.85Å; V624-V637 HydrophobicContact CG1-CG2 3.98Å; V624-V637 PolarHBondContact O-N 2.76Å; V624-L697 HydrophobicContact CG1-CD2 3.76Å; V624-F700 HydrophobicContact CG1-CB 3.65Å; V624-F700 HydrophobicContact CG1-CD1 3.83Å; V624-F700 HydrophobicContact CG1-CG 3.98Å; V624-F700 HydrophobicContact CG2-CB 4.15Å; V624-F700 HydrophobicContact CG2-CD1 4.46Å
625	L	95	Very high	74.6	Confident	3 Å²	3	33.5 Å²	33.5	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.8	175.1	-59.5	178.6	0	0	0	109.5	A557 C559 V576 A578 L584 T622 L634 V636	A557-L625 HydrophobicContact CB-CD1 4.1Å; A557-L625 HydrophobicContact CB-CG 3.97Å; C559-L625 HydrophobicContact CB-CB 3.66Å; C559-L625 HydrophobicContact CB-CD1 3.94Å; C559-L625 HydrophobicContact CB-CG 4.47Å; V576-L625 HydrophobicContact CG1-CD1 4.43Å; A578-L625 HydrophobicContact CB-CD1 3.98Å; A578-L625 HydrophobicContact CB-CD2 4.36Å; A578-L625 HydrophobicContact CB-CG 4.41Å; L584-L625 HydrophobicContact CD2-CD2 4.22Å; T622-L625 HydrophobicContact CG2-CD2 4.09Å; L625-L634 HydrophobicContact CB-CD1 4.36Å; L625-V636 HydrophobicContact CD2-CB 4.16Å; L625-V636 HydrophobicContact CD2-CG1 3.83Å; L625-V636 HydrophobicContact CD2-CG2 3.73Å
626	A	94.1	Very high	77	Confident	8 Å²	8	27.2 Å²	27.2	7%	0.066	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	143.2	169.4	0	0	0	0	0	110.4	A635 F700 F702	A626-A635 PolarHBondContact N-O 3.04Å; A626-A635 PolarHBondContact O-N 2.78Å; A626-F700 HydrophobicContact CB-CD1 3.62Å; A626-F700 HydrophobicContact CB-CE1 3.74Å; A626-F702 HydrophobicContact CB-CD2 4.04Å; A626-F702 HydrophobicContact CB-CE2 4.15Å
627	S	92.6	Very high	79.6	Confident	32 Å²	32	21.6 Å²	21.6	22%	0.224	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	149.8	177	57.8	0	0	0	0	111.8	C559 L560 I633 F702	C559-S627 VanDerWaalsContact SG-CB 3.51Å; C559-S627 PolarHBondContact SG-N 2.85Å; L560-S627 WeakPolarHBondContact O-CB 3.07Å; L560-S627 PolarHBondContact O-OG 3.45Å; S627-I633 WeakPolarHBondContact CA-O 3.22Å; S627-F702 WeakPolarHBondContact O-CD2 3.33Å
628	H	90.2	Very high	82	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	11%	0.108	C	C	.	.			trans	-70.2	141.8	171.5	-169.9	-85.3	0	0	0	110	T562 S630 N631 I633 F702 G706 W840	T562-H628 PolarHBondContact OG1-O 2.87Å; H628-S630 PolarHBondContact CE1-OG 2.84Å; H628-S630 PolarHBondContact ND1-N 2.83Å; H628-S630 PolarHBondContact ND1-OG 3.06Å; H628-S630 VanDerWaalsContact ND1-OG 3.12Å; H628-S630 PolarHBondContact O-N 3.46Å; H628-S630 VanDerWaalsContact O-N 3.11Å; H628-N631 HydrophobicContact CB-CB 4.43Å; H628-N631 PolarHBondContact CE1-ND2 3.1Å; H628-N631 VanDerWaalsContact CE1-ND2 3.34Å; H628-N631 WeakPolarHBondContact ND1-CB 3.27Å; H628-N631 PolarHBondContact ND1-N 3.44Å; H628-N631 VanDerWaalsContact ND1-N 3.18Å; H628-I633 HydrophobicContact CB-CB 3.72Å; H628-I633 HydrophobicContact CB-CG2 4.34Å; H628-I633 PolarHBondContact N-O 2.97Å; H628-F702 HydrophobicContact CB-CE1 4.45Å; H628-F702 HydrophobicContact CB-CZ 4.46Å; H628-F702 AromaticContact CD2-CD1 3.9Å; H628-F702 AromaticContact CD2-CE1 4Å; H628-G706 WeakPolarHBondContact NE2-CA 3.46Å; H628-W840 AromaticContact CD2-CD1 3.91Å; H628-W840 AromaticContact NE2-CD1 3.9Å
629	P	84.8	Confident	84	Confident	52 Å²	52	10.6 Å²	10.6	34%	0.338	7%	0.068	S	C	.	.	S	Bend	trans	-64.8	-18.4	-172.8	24.8	-37.1	0	0	0	115
630	S	78.5	Confident	84.9	Confident	9 Å²	9	10 Å²	10	6%	0.063	6%	0.058	C	C	.	.	S	Bend	trans	-143.4	-14.4	-169.4	58.9	0	0	0	0	116	T562 H628 N843	T562-S630 WeakPolarHBondContact OG1-CA 3.46Å; T562-S630 PolarHBondContact OG1-N 2.7Å; H628-S630 PolarHBondContact CE1-OG 2.84Å; H628-S630 PolarHBondContact ND1-N 2.83Å; H628-S630 PolarHBondContact ND1-OG 3.06Å; H628-S630 VanDerWaalsContact ND1-OG 3.12Å; H628-S630 PolarHBondContact O-N 3.46Å; H628-S630 VanDerWaalsContact O-N 3.11Å; S630-N843 WeakPolarHBondContact CB-OD1 3.26Å; S630-N843 PolarHBondContact OG-OD1 2.91Å
631	N	82.3	Confident	85.2	Confident	4 Å²	4	10.7 Å²	10.7	2%	0.021	7%	0.065	C	C	.	.	S	Bend	trans	-118.3	150.7	-175.2	-68.5	-27.3	0	0	0	107	T562 H628 I633 W840	T562-N631 PolarHBondContact OG1-N 2.9Å; H628-N631 HydrophobicContact CB-CB 4.43Å; H628-N631 PolarHBondContact CE1-ND2 3.1Å; H628-N631 VanDerWaalsContact CE1-ND2 3.34Å; H628-N631 WeakPolarHBondContact ND1-CB 3.27Å; H628-N631 PolarHBondContact ND1-N 3.44Å; H628-N631 VanDerWaalsContact ND1-N 3.18Å; N631-I633 HydrophobicContact CB-CD1 3.77Å; N631-I633 HydrophobicContact CB-CG1 4Å; N631-I633 PolarHBondContact O-N 3Å; N631-W840 PolarHBondContact ND2-O 3.41Å
632	P	84.8	Confident	84.5	Confident	0 Å²	0	9.1 Å²	9.1	0%	0	6%	0.058	C	C	.	.	S	Bend	trans	-75.7	62.9	-178.9	32.2	-37	0	0	0	111.1	V561 T562 E564 Y574 Y651 L652	V561-P632 HydrophobicContact CG1-CB 4.47Å; T562-P632 WeakPolarHBondContact O-CA 3.38Å; T562-P632 VanDerWaalsContact O-CB 3.32Å; T562-P632 WeakPolarHBondContact O-CB 3.27Å; E564-P632 HydrophobicContact CB-CG 4.07Å; E564-P632 HydrophobicContact CG-CG 3.97Å; Y574-P632 HydrophobicContact CE2-CB 4.47Å; P632-Y651 HydrophobicContact CG-CD2 4.18Å; P632-Y651 HydrophobicContact CG-CE2 3.75Å; P632-Y651 CarbonylContact O-C 3.56Å; P632-Y651 WeakPolarHBondContact O-CA 3.26Å; P632-L652 HydrophobicContact CB-CB 4.34Å; P632-L652 PolarHBondContact O-N 2.93Å
633	I	86.9	Confident	83.7	Confident	3 Å²	3	10.1 Å²	10.1	2%	0.015	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.1	-174	-63.3	173.4	0	0	0	108.6	S627 H628 N631 V649 F650 Y651 F702 W840	S627-I633 WeakPolarHBondContact CA-O 3.22Å; H628-I633 HydrophobicContact CB-CB 3.72Å; H628-I633 HydrophobicContact CB-CG2 4.34Å; H628-I633 PolarHBondContact N-O 2.97Å; N631-I633 HydrophobicContact CB-CD1 3.77Å; N631-I633 HydrophobicContact CB-CG1 4Å; N631-I633 PolarHBondContact O-N 3Å; I633-V649 HydrophobicContact CG2-CG1 3.37Å; I633-F650 WeakPolarHBondContact CA-O 3.17Å; I633-Y651 HydrophobicContact CG1-CD2 3.96Å; I633-F702 HydrophobicContact CG2-CZ 4.17Å; I633-W840 HydrophobicContact CD1-CB 3.46Å; I633-W840 VanDerWaalsContact CD1-CB 3.46Å; I633-W840 HydrophobicContact CD1-CG 4.01Å
634	L	90.6	Very high	83.5	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.7	178.2	177.8	76.9	0	0	0	109.2	C559 V561 V576 L584 L625 V636 V649 F650 L652	C559-L634 HydrophobicContact CB-CD1 4.12Å; V561-L634 HydrophobicContact CG2-CB 4.26Å; V561-L634 HydrophobicContact CG2-CD1 3.95Å; V576-L634 HydrophobicContact CB-CD2 4.41Å; V576-L634 HydrophobicContact CG1-CD2 3.82Å; V576-L634 HydrophobicContact CG2-CD2 4.27Å; L584-L634 HydrophobicContact CD1-CD2 4.02Å; L625-L634 HydrophobicContact CB-CD1 4.36Å; L634-V636 HydrophobicContact CD2-CG2 3.78Å; L634-V636 HydrophobicContact CG-CG2 3.91Å; L634-V649 CarbonylContact O-C 3.55Å; L634-V649 WeakPolarHBondContact O-CA 3.4Å; L634-F650 HydrophobicContact CB-CB 4.39Å; L634-F650 PolarHBondContact N-O 2.93Å; L634-F650 PolarHBondContact O-N 3.45Å; L634-L652 HydrophobicContact CB-CD1 4.28Å
635	A	91.4	Very high	83.3	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	137.5	168.3	0	0	0	0	0	110.1	A626 R648 V649 F700 F702 L708	A626-A635 PolarHBondContact N-O 3.04Å; A626-A635 PolarHBondContact O-N 2.78Å; A635-R648 WeakPolarHBondContact CA-O 3.38Å; A635-V649 HydrophobicContact CB-CG2 4.1Å; A635-F700 HydrophobicContact CB-CE1 3.65Å; A635-F700 HydrophobicContact CB-CZ 3.59Å; A635-F702 HydrophobicContact CB-CE2 3.75Å; A635-F702 HydrophobicContact CB-CZ 3.83Å; A635-L708 HydrophobicContact CB-CD1 4.07Å; A635-L708 HydrophobicContact CB-CD2 4.26Å
636	V	91.3	Very high	82.9	Confident	0 Å²	0	17 Å²	17	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.6	-174.7	-176	0	0	0	0	109	L584 L610 T622 L625 L634 T638 W647 R648 F650 W675	L584-V636 HydrophobicContact CD1-CG2 4.2Å; L610-V636 HydrophobicContact CD1-CG1 4.44Å; L610-V636 HydrophobicContact CD2-CG1 4.25Å; T622-V636 HydrophobicContact CG2-CG1 4.16Å; L625-V636 HydrophobicContact CD2-CB 4.16Å; L625-V636 HydrophobicContact CD2-CG1 3.83Å; L625-V636 HydrophobicContact CD2-CG2 3.73Å; L634-V636 HydrophobicContact CD2-CG2 3.78Å; L634-V636 HydrophobicContact CG-CG2 3.91Å; V636-T638 HydrophobicContact CG1-CG2 4.37Å; V636-W647 CarbonylContact O-C 3.44Å; V636-W647 VanDerWaalsContact O-CA 3.24Å; V636-W647 WeakPolarHBondContact O-CA 3.45Å; V636-R648 PolarHBondContact N-O 3Å; V636-R648 PolarHBondContact O-N 2.7Å; V636-F650 HydrophobicContact CB-CD2 4.44Å; V636-F650 HydrophobicContact CB-CE2 4Å; V636-F650 HydrophobicContact CG2-CD2 3.7Å; V636-F650 HydrophobicContact CG2-CE2 3.62Å; V636-W675 HydrophobicContact CB-CH2 4.32Å; V636-W675 HydrophobicContact CG1-CH2 4.04Å
637	V	91.3	Very high	82.7	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.7	171.7	-178.8	0	0	0	0	109.8	V623 V624 L645 E646 W647 L678 L697 F700	V623-V637 HydrophobicContact CB-CG1 4.3Å; V623-V637 PolarHBondContact N-O 2.91Å; V624-V637 HydrophobicContact CG1-CB 3.85Å; V624-V637 HydrophobicContact CG1-CG2 3.98Å; V624-V637 PolarHBondContact O-N 2.76Å; V637-L645 HydrophobicContact CG1-CB 4.13Å; V637-L645 HydrophobicContact CG1-CD1 4.34Å; V637-L645 HydrophobicContact CG1-CD2 4.41Å; V637-E646 CarbonylContact C-O 3.58Å; V637-E646 VanDerWaalsContact CA-O 3.26Å; V637-E646 WeakPolarHBondContact CA-O 3.36Å; V637-W647 HydrophobicContact CG2-CB 4.12Å; V637-L678 HydrophobicContact CG1-CD2 3.87Å; V637-L678 HydrophobicContact CG2-CD2 4.05Å; V637-L697 HydrophobicContact CG1-CD2 4.12Å; V637-L697 HydrophobicContact CG2-CD2 4.36Å; V637-F700 HydrophobicContact CG2-CD1 3.99Å; V637-F700 HydrophobicContact CG2-CD2 4.17Å; V637-F700 HydrophobicContact CG2-CE1 3.77Å; V637-F700 HydrophobicContact CG2-CE2 3.95Å; V637-F700 HydrophobicContact CG2-CG 4.16Å; V637-F700 HydrophobicContact CG2-CZ 3.72Å
638	T	87.7	Confident	82.4	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.006	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	154.9	174.8	56.8	0	0	0	0	110.8	L610 H621 V636 L645 E646 W675	L610-T638 HydrophobicContact CD1-CG2 4.34Å; H621-T638 CarbonylContact O-C 3.16Å; H621-T638 VanDerWaalsContact O-CA 3.32Å; H621-T638 WeakPolarHBondContact O-CA 3.43Å; V636-T638 HydrophobicContact CG1-CG2 4.37Å; T638-L645 WeakPolarHBondContact O-CA 3.32Å; T638-E646 PolarHBondContact N-O 3.44Å; T638-E646 PolarHBondContact O-N 2.87Å; T638-W675 HydrophobicContact CG2-CH2 3.57Å; T638-W675 HydrophobicContact CG2-CZ2 4.33Å; T638-W675 HydrophobicContact CG2-CZ3 3.92Å; T638-W675 WeakPolarHBondContact OG1-CZ3 3.38Å
639	C	81.3	Confident	82.3	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.7	178.1	175.7	0	0	0	0	109.5	G619 H620 H621 V623 V641 L645	G619-C639 VanDerWaalsContact O-O 3.09Å; H620-C639 CarbonylContact C-O 3.52Å; H620-C639 WeakPolarHBondContact CA-O 3.12Å; H621-C639 PolarHBondContact N-O 2.89Å; H621-C639 PolarHBondContact O-N 3.31Å; V623-C639 HydrophobicContact CG2-CB 3.41Å; V623-C639 VanDerWaalsContact CG2-CB 3.41Å; C639-V641 PolarHBondContact SG-O 2.84Å; C639-L645 HydrophobicContact CB-CD2 3.58Å
640	N	68.2	Low	82.2	Confident	16 Å²	16	17.3 Å²	17.3	9%	0.086	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-43.4	-179.7	-56.3	-2.1	0	0	0	111.1	L416 H620 E644 E646	L416-N640 WeakPolarHBondContact CD2-O 3.46Å; H620-N640 PolarHBondContact CD2-OD1 2.9Å; H620-N640 PolarHBondContact CE1-ND2 3.28Å; H620-N640 VanDerWaalsContact CE1-ND2 3.34Å; H620-N640 PolarHBondContact CE1-OD1 3.31Å; H620-N640 PolarHBondContact ND1-OD1 3Å; H620-N640 PolarHBondContact NE2-ND2 3.38Å; H620-N640 PolarHBondContact NE2-OD1 2.95Å; N640-E644 PolarHBondContact N-O 3.21Å; N640-E646 PolarHBondContact ND2-OE1 3.1Å
641	V	64.3	Low	82.5	Confident	48 Å²	48	18.8 Å²	18.8	29%	0.291	10%	0.095	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	153.5	175.6	-176.1	0	0	0	0	106	Q414 C639 G643 E644	Q414-V641 HydrophobicContact CB-CG1 4.28Å; C639-V641 PolarHBondContact SG-O 2.84Å; V641-G643 PolarHBondContact O-N 3.21Å; V641-E644 PolarHBondContact O-N 3.26Å
642	V	62	Low	82.3	Confident	12 Å²	12	18.8 Å²	18.8	7%	0.073	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	127.9	-176.8	-154.4	0	0	0	0	111	Q414 S415 E644 V694	Q414-V642 HydrophobicContact CB-CB 4.15Å; Q414-V642 HydrophobicContact CB-CG2 3.5Å; Q414-V642 VanDerWaalsContact CB-CG2 3.5Å; Q414-V642 WeakPolarHBondContact O-CG2 3.4Å; S415-V642 VanDerWaalsContact N-CG2 3.26Å; S415-V642 WeakPolarHBondContact O-CG2 3.38Å; V642-E644 PolarHBondContact O-N 2.95Å; V642-V694 HydrophobicContact CB-CG1 4.21Å; V642-V694 HydrophobicContact CG1-CB 4.31Å; V642-V694 HydrophobicContact CG1-CG1 3.56Å
643	G	64.9	Low	81.6	Confident	25 Å²	25	19.4 Å²	19.4	26%	0.258	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	-15.1	-177.1	0	0	0	0	0	113.6	V641	V641-G643 PolarHBondContact O-N 3.21Å
644	E	78.7	Confident	80.4	Confident	105 Å²	105	20.6 Å²	20.6	49%	0.491	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	96.1	171.7	-69.1	-170.7	172.8	0	0	110.3	N640 V641 V642	N640-E644 PolarHBondContact N-O 3.21Å; V641-E644 PolarHBondContact O-N 3.26Å; V642-E644 PolarHBondContact O-N 2.95Å
645	L	87.5	Confident	78.7	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	141.2	176.6	-62.1	-176.5	0	0	0	109.9	V623 V637 T638 C639 H677 L678 L680 L697	V623-L645 HydrophobicContact CG2-CD2 4.01Å; V637-L645 HydrophobicContact CG1-CB 4.13Å; V637-L645 HydrophobicContact CG1-CD1 4.34Å; V637-L645 HydrophobicContact CG1-CD2 4.41Å; T638-L645 WeakPolarHBondContact O-CA 3.32Å; C639-L645 HydrophobicContact CB-CD2 3.58Å; L645-H677 PolarHBondContact O-ND1 3Å; L645-L678 HydrophobicContact CB-CB 3.82Å; L645-L678 HydrophobicContact CB-CD2 4.1Å; L645-L678 HydrophobicContact CB-CG 4.45Å; L645-L678 HydrophobicContact CD1-CD2 4.08Å; L645-L678 PolarHBondContact O-N 3.09Å; L645-L680 HydrophobicContact CD1-CD1 3.84Å; L645-L680 HydrophobicContact CD1-CD2 4.22Å; L645-L680 HydrophobicContact CD1-CG 4.28Å; L645-L680 HydrophobicContact CG-CD1 4.3Å; L645-L697 HydrophobicContact CD1-CB 3.62Å; L645-L697 HydrophobicContact CD1-CD2 4.1Å; L645-L697 HydrophobicContact CD1-CG 4.44Å
646	E	87.9	Confident	76.7	Confident	41 Å²	41	26 Å²	26	19%	0.192	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.7	171.8	-67.2	-176.1	164.9	0	0	109.5	V637 T638 N640 W675 Q676	V637-E646 CarbonylContact C-O 3.58Å; V637-E646 VanDerWaalsContact CA-O 3.26Å; V637-E646 WeakPolarHBondContact CA-O 3.36Å; T638-E646 PolarHBondContact N-O 3.44Å; T638-E646 PolarHBondContact O-N 2.87Å; N640-E646 PolarHBondContact ND2-OE1 3.1Å; E646-W675 HydrophobicContact CB-CE3 3.97Å; E646-Q676 CarbonylContact C-O 3.59Å; E646-Q676 WeakPolarHBondContact CA-O 3.38Å
647	W	89.8	Confident	74.4	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.008	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	154.1	-179.9	70.8	-76.4	0	0	0	111.7	V636 V637 V649 L672 Q676 H677 L678 L708 L720 F731 W733	V636-W647 CarbonylContact O-C 3.44Å; V636-W647 VanDerWaalsContact O-CA 3.24Å; V636-W647 WeakPolarHBondContact O-CA 3.45Å; V637-W647 HydrophobicContact CG2-CB 4.12Å; W647-V649 HydrophobicContact CE3-CG2 4.18Å; W647-V649 HydrophobicContact CZ3-CG2 3.81Å; W647-L672 HydrophobicContact CH2-CD2 3.54Å; W647-L672 HydrophobicContact CZ3-CD2 3.75Å; W647-Q676 HydrophobicContact CZ2-CB 4.19Å; W647-Q676 PolarHBondContact N-O 2.82Å; W647-Q676 PolarHBondContact O-N 2.64Å; W647-H677 PolarHBondContact NE1-O 3.32Å; W647-L678 HydrophobicContact CB-CB 4.47Å; W647-L678 HydrophobicContact CG-CB 4.41Å; W647-L678 HydrophobicContact CG-CD1 4.2Å; W647-L708 HydrophobicContact CE3-CD2 4.24Å; W647-L708 HydrophobicContact CZ3-CD2 4.26Å; W647-L720 HydrophobicContact CH2-CD1 3.85Å; W647-L720 HydrophobicContact CH2-CD2 3.4Å; W647-L720 HydrophobicContact CH2-CG 4.27Å; W647-L720 HydrophobicContact CZ2-CD1 3.8Å; W647-L720 HydrophobicContact CZ2-CD2 4.19Å; W647-L720 HydrophobicContact CZ3-CD2 3.7Å; W647-F731 HydrophobicContact CH2-CB 4.39Å; W647-F731 HydrophobicContact CH2-CG 4.4Å; W647-F731 HydrophobicContact CZ2-CB 4.29Å; W647-W733 AromaticContact CD1-NE1 3.89Å; W647-W733 HydrophobicContact CD2-CZ2 4.12Å; W647-W733 AromaticContact CE2-NE1 3.5Å; W647-W733 HydrophobicContact CE3-CZ2 4.5Å; W647-W733 HydrophobicContact CG-CZ2 4.45Å; W647-W733 AromaticContact CZ2-NE1 3.86Å; W647-W733 AromaticContact NE1-NE1 3.2Å
648	R	86.7	Confident	72.1	Confident	65 Å²	65	35 Å²	35	25%	0.245	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	150.9	175.9	-176.8	172	172.8	174.5	1.9	111.2	A635 V636 F650 S673 W675	A635-R648 WeakPolarHBondContact CA-O 3.38Å; V636-R648 PolarHBondContact N-O 3Å; V636-R648 PolarHBondContact O-N 2.7Å; R648-F650 HydrophobicContact CB-CE2 4.09Å; R648-F650 HydrophobicContact CG-CD2 4.46Å; R648-F650 HydrophobicContact CG-CE2 3.94Å; R648-F650 HydrophobicContact CG-CZ 4.11Å; R648-S673 PolarHBondContact NE-O 3.06Å; R648-S673 VanDerWaalsContact NE-O 3.17Å; R648-S673 PolarHBondContact NH1-O 3.06Å; R648-S673 PolarHBondContact NH2-O 2.99Å; R648-W675 HydrophobicContact CB-CD2 3.87Å; R648-W675 HydrophobicContact CB-CE3 3.59Å; R648-W675 HydrophobicContact CB-CH2 4.09Å; R648-W675 HydrophobicContact CB-CZ2 4.35Å; R648-W675 HydrophobicContact CB-CZ3 3.71Å
649	V	86.6	Confident	69.7	Low	2 Å²	2	38.2 Å²	38.2	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.2	174.6	179.3	0	0	0	0	110.1	I633 L634 A635 W647 W840	I633-V649 HydrophobicContact CG2-CG1 3.37Å; L634-V649 CarbonylContact O-C 3.55Å; L634-V649 WeakPolarHBondContact O-CA 3.4Å; A635-V649 HydrophobicContact CB-CG2 4.1Å; W647-V649 HydrophobicContact CE3-CG2 4.18Å; W647-V649 HydrophobicContact CZ3-CG2 3.81Å; V649-W840 HydrophobicContact CB-CZ3 4.45Å; V649-W840 HydrophobicContact CG1-CE3 4.5Å; V649-W840 HydrophobicContact CG1-CZ3 4.36Å; V649-W840 HydrophobicContact CG2-CH2 4.07Å; V649-W840 HydrophobicContact CG2-CZ3 4.02Å
650	F	84.2	Confident	67.8	Low	31 Å²	31	45 Å²	45	14%	0.136	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.7	178.6	-62.9	-95.7	0	0	0	109.5	L584 L610 I633 L634 V636 R648 W675	L584-F650 HydrophobicContact CD1-CE2 4.49Å; L610-F650 HydrophobicContact CD2-CE2 4.23Å; L610-F650 HydrophobicContact CD2-CZ 3.85Å; I633-F650 WeakPolarHBondContact CA-O 3.17Å; L634-F650 HydrophobicContact CB-CB 4.39Å; L634-F650 PolarHBondContact N-O 2.93Å; L634-F650 PolarHBondContact O-N 3.45Å; V636-F650 HydrophobicContact CB-CD2 4.44Å; V636-F650 HydrophobicContact CB-CE2 4Å; V636-F650 HydrophobicContact CG2-CD2 3.7Å; V636-F650 HydrophobicContact CG2-CE2 3.62Å; R648-F650 HydrophobicContact CB-CE2 4.09Å; R648-F650 HydrophobicContact CG-CD2 4.46Å; R648-F650 HydrophobicContact CG-CE2 3.94Å; R648-F650 HydrophobicContact CG-CZ 4.11Å; F650-W675 HydrophobicContact CZ-CZ2 4.45Å
651	Y	83.3	Confident	66.6	Low	39 Å²	39	55.6 Å²	55.6	15%	0.153	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130	170.2	177.1	-101.1	0	0	0	110.2	E564 P632 I633 M668	E564-Y651 WeakPolarHBondContact OE1-CE2 3.35Å; E564-Y651 VanDerWaalsContact OE1-CZ 3.29Å; E564-Y651 PolarHBondContact OE1-OH 3.46Å; E564-Y651 PolarHBondContact OE2-OH 3.33Å; P632-Y651 HydrophobicContact CG-CD2 4.18Å; P632-Y651 HydrophobicContact CG-CE2 3.75Å; P632-Y651 CarbonylContact O-C 3.56Å; P632-Y651 WeakPolarHBondContact O-CA 3.26Å; I633-Y651 HydrophobicContact CG1-CD2 3.96Å; Y651-M668 WeakPolarHBondContact CB-SD 3.15Å; Y651-M668 HydrophobicContact CD1-CE 4.47Å; Y651-M668 HydrophobicContact CD2-CE 4.05Å; Y651-M668 HydrophobicContact CG-CE 3.68Å; Y651-M668 HydrophobicContact CG-SD 4.26Å
652	L	78.7	Confident	65.9	Low	5 Å²	5	56.6 Å²	56.6	3%	0.026	32%	0.315	C	S	.	.			trans	-109.6	7.5	-173.4	-56.3	-174.4	0	0	0	111.2	V561 Y574 V576 I586 P632 L634 I655	V561-L652 HydrophobicContact CB-CD1 4.39Å; V561-L652 HydrophobicContact CG1-CD1 4.21Å; V561-L652 HydrophobicContact CG2-CD1 4.14Å; Y574-L652 HydrophobicContact CD2-CB 4.3Å; Y574-L652 HydrophobicContact CE2-CB 4.42Å; V576-L652 HydrophobicContact CG2-CD1 3.94Å; I586-L652 HydrophobicContact CD1-CD1 4.4Å; I586-L652 HydrophobicContact CD1-CD2 3.73Å; P632-L652 HydrophobicContact CB-CB 4.34Å; P632-L652 PolarHBondContact O-N 2.93Å; L634-L652 HydrophobicContact CB-CD1 4.28Å; L652-I655 HydrophobicContact CB-CD1 3.78Å; L652-I655 HydrophobicContact CD2-CD1 3.78Å; L652-I655 HydrophobicContact CG-CD1 4.34Å; L652-I655 WeakPolarHBondContact O-CD1 3.31Å; L652-I655 VanDerWaalsContact O-CG1 3.32Å; L652-I655 WeakPolarHBondContact O-CG1 3.27Å
653	G	70.9	Confident	65.4	Low	13 Å²	13	60 Å²	60	13%	0.134	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	135.1	174.4	0	0	0	0	0	111.6
654	G	61.5	Low	65	Low	27 Å²	27	61.9 Å²	61.9	28%	0.278	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	11.2	177.3	0	0	0	0	0	116.1
655	I	55.5	Low	64	Low	46 Å²	46	58.6 Å²	58.6	24%	0.236	34%	0.338	C	S	.	.	S	Bend	trans	-76.5	-35.2	178.9	-63	175.8	0	0	0	112.1	Y574 I586 L605 L652	Y574-I655 HydrophobicContact CE1-CB 3.92Å; Y574-I655 HydrophobicContact CE1-CG2 4.2Å; I586-I655 HydrophobicContact CD1-CD1 4.36Å; L605-I655 HydrophobicContact CB-CG2 4.11Å; L605-I655 HydrophobicContact CD1-CG2 3.88Å; L605-I655 HydrophobicContact CG-CG2 4.43Å; L652-I655 HydrophobicContact CB-CD1 3.78Å; L652-I655 HydrophobicContact CD2-CD1 3.78Å; L652-I655 HydrophobicContact CG-CD1 4.34Å; L652-I655 WeakPolarHBondContact O-CD1 3.31Å; L652-I655 VanDerWaalsContact O-CG1 3.32Å; L652-I655 WeakPolarHBondContact O-CG1 3.27Å
656	M	49	Very low	62.7	Low	69 Å²	69	65.7 Å²	65.7	34%	0.34	38%	0.375	S	S	.	.	S	Bend	trans	-80.2	-33.2	179	-75.9	-70	-137.5	0	0	114.2	Y574 T588 L605 G658	Y574-M656 HydrophobicContact CE1-CG 3.72Å; Y574-M656 WeakPolarHBondContact OH-CG 3.3Å; Y574-M656 PolarHBondContact OH-N 2.84Å; T588-M656 VanDerWaalsContact CB-CE 3.44Å; T588-M656 HydrophobicContact CG2-CE 3.25Å; T588-M656 HydrophobicContact CG2-SD 3.65Å; L605-M656 HydrophobicContact CD1-SD 4.01Å; L605-M656 HydrophobicContact CD2-SD 3.92Å; M656-G658 PolarHBondContact O-N 3.19Å
657	L	42.3	Very low	61.4	Low	94 Å²	94	65.4 Å²	65.4	49%	0.492	37%	0.372	S	S	.	.			trans	-92.7	104.9	-171	-78.2	139	0	0	0	110.9	S659	L657-S659 WeakPolarHBondContact CD2-OG 3.4Å; L657-S659 PolarHBondContact O-N 3.41Å
658	G	43.5	Very low	60.2	Low	93 Å²	93	66.1 Å²	66.1	96%	0.959	38%	0.376	S	S	*	.	S	Bend	trans	-58.4	-9.2	160.1	0	0	0	0	0	113.4	M656	M656-G658 PolarHBondContact O-N 3.19Å
659	S	37.1	Very low	59	Low	70 Å²	70	69.2 Å²	69.2	49%	0.49	39%	0.391	S	S	.	.	S	Bend	trans	-97.2	116.4	171.9	64.5	0	0	0	0	110.7	L657	L657-S659 WeakPolarHBondContact CD2-OG 3.4Å; L657-S659 PolarHBondContact O-N 3.41Å
660	N	40.7	Very low	57.6	Low	141 Å²	141	70.1 Å²	70.1	75%	0.754	40%	0.397	S	S	*	.			trans	60.8	89.6	176.2	-61.8	-21	0	0	0	113.8	T662	N660-T662 PolarHBondContact O-N 3.1Å
661	R	42.8	Very low	56.4	Low	239 Å²	239	70.6 Å²	70.6	90%	0.902	41%	0.405	S	S	*	.			trans	-52.9	97.1	154	-72.5	-176.7	175.3	-170.6	-2.2	107.3	A663	R661-A663 PolarHBondContact O-N 2.94Å; R661-A663 VanDerWaalsContact O-N 3.1Å
662	T	49.7	Very low	55.3	Low	70 Å²	70	68.8 Å²	68.8	43%	0.429	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-57.7	120.2	163.7	47	0	0	0	0	104.9	N660 T664	N660-T662 PolarHBondContact O-N 3.1Å; T662-T664 PolarHBondContact O-N 3.47Å; T662-T664 VanDerWaalsContact O-N 3.16Å
663	A	52.2	Low	54.6	Low	82 Å²	82	70.3 Å²	70.3	68%	0.678	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-57.1	127.8	178.8	0	0	0	0	0	107.1	R661	R661-A663 PolarHBondContact O-N 2.94Å; R661-A663 VanDerWaalsContact O-N 3.1Å
664	T	56	Low	54.8	Low	66 Å²	66	74.9 Å²	74.9	41%	0.405	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-47.6	130.6	174.5	48.3	0	0	0	0	108.7	T662 L666 K669	T662-T664 PolarHBondContact O-N 3.47Å; T662-T664 VanDerWaalsContact O-N 3.16Å; T664-L666 PolarHBondContact O-N 2.77Å; T664-K669 WeakPolarHBondContact OG1-CE 3.27Å
665	P	57.6	Low	55.8	Low	35 Å²	35	74.9 Å²	74.9	23%	0.227	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-58.5	139.5	-171.9	21.8	-31.8	0	0	0	109.5	W667 M668	P665-W667 HydrophobicContact CB-CG 4.47Å; P665-W667 HydrophobicContact CG-CZ2 4.16Å; P665-W667 PolarHBondContact O-N 3.1Å; P665-M668 HydrophobicContact CG-CB 4.49Å; P665-M668 HydrophobicContact CG-CE 3.7Å; P665-M668 WeakPolarHBondContact O-CB 3.34Å; P665-M668 PolarHBondContact O-N 3.37Å
666	L	60.8	Low	57.2	Low	149 Å²	149	74.4 Å²	74.4	78%	0.78	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-52.9	-35.6	-170	-79.7	128.3	0	0	0	113	T664 M668 K669	T664-L666 PolarHBondContact O-N 2.77Å; L666-M668 PolarHBondContact O-N 3.46Å; L666-K669 WeakPolarHBondContact O-CB 3.42Å; L666-K669 PolarHBondContact O-N 3.05Å; L666-K669 VanDerWaalsContact O-N 3.12Å
667	W	61.5	Low	59	Low	36 Å²	36	76.4 Å²	76.4	14%	0.136	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-60.5	-31.6	178.5	65.5	-104.5	0	0	0	112.8	P665 K669 S670 L672 I839 W840	P665-W667 HydrophobicContact CB-CG 4.47Å; P665-W667 HydrophobicContact CG-CZ2 4.16Å; P665-W667 PolarHBondContact O-N 3.1Å; W667-K669 VanDerWaalsContact C-N 3.28Å; W667-K669 PolarHBondContact O-N 3.16Å; W667-S670 VanDerWaalsContact O-CB 3.23Å; W667-S670 WeakPolarHBondContact O-CB 3.29Å; W667-S670 PolarHBondContact O-N 3.16Å; W667-S670 VanDerWaalsContact O-N 3.12Å; W667-L672 HydrophobicContact CE3-CB 4.24Å; W667-L672 HydrophobicContact CE3-CD1 3.34Å; W667-L672 HydrophobicContact CE3-CG 4.4Å; W667-L672 HydrophobicContact CH2-CD1 4.38Å; W667-L672 HydrophobicContact CZ3-CB 4.06Å; W667-L672 HydrophobicContact CZ3-CD1 3.26Å; W667-L672 HydrophobicContact CZ3-CG 4.28Å; W667-I839 HydrophobicContact CB-CG2 3.5Å; W667-I839 VanDerWaalsContact CB-CG2 3.5Å; W667-I839 HydrophobicContact CD2-CG2 3.98Å; W667-I839 HydrophobicContact CG-CG2 3.48Å; W667-I839 VanDerWaalsContact CG-CG2 3.48Å; W667-W840 HydrophobicContact CH2-CB 3.77Å; W667-W840 HydrophobicContact CH2-CD2 4.32Å; W667-W840 AromaticContact CH2-CE3 3.61Å; W667-W840 HydrophobicContact CH2-CE3 3.61Å; W667-W840 HydrophobicContact CH2-CG 4.45Å; W667-W840 HydrophobicContact CZ2-CB 3.4Å; W667-W840 HydrophobicContact CZ2-CE3 4.35Å; W667-W840 HydrophobicContact CZ2-CG 4.48Å; W667-W840 AromaticContact CZ3-CE3 3.82Å; W667-W840 HydrophobicContact CZ3-CE3 3.82Å; W667-W840 HydrophobicContact CZ3-CZ3 4.42Å
668	M	62.7	Low	61.3	Low	17 Å²	17	71.9 Å²	71.9	8%	0.084	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-73.2	-26.9	-179.4	-144.2	173.4	-67.3	0	0	112.1	Y651 P665 L666 S670 S673	Y651-M668 WeakPolarHBondContact CB-SD 3.15Å; Y651-M668 HydrophobicContact CD1-CE 4.47Å; Y651-M668 HydrophobicContact CD2-CE 4.05Å; Y651-M668 HydrophobicContact CG-CE 3.68Å; Y651-M668 HydrophobicContact CG-SD 4.26Å; P665-M668 HydrophobicContact CG-CB 4.49Å; P665-M668 HydrophobicContact CG-CE 3.7Å; P665-M668 WeakPolarHBondContact O-CB 3.34Å; P665-M668 PolarHBondContact O-N 3.37Å; L666-M668 PolarHBondContact O-N 3.46Å; M668-S670 PolarHBondContact O-N 3.01Å; M668-S673 WeakPolarHBondContact O-CB 3.32Å; M668-S673 PolarHBondContact O-N 2.67Å; M668-S673 PolarHBondContact O-OG 3.27Å
669	K	62.1	Low	63.5	Low	130 Å²	130	69.6 Å²	69.6	57%	0.565	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-70.9	-7.9	173.3	-58.4	-179.9	-178.3	175.1	0	112.4	T664 L666 W667	T664-K669 WeakPolarHBondContact OG1-CE 3.27Å; L666-K669 WeakPolarHBondContact O-CB 3.42Å; L666-K669 PolarHBondContact O-N 3.05Å; L666-K669 VanDerWaalsContact O-N 3.12Å; W667-K669 VanDerWaalsContact C-N 3.28Å; W667-K669 PolarHBondContact O-N 3.16Å
670	S	57.3	Low	66	Low	20 Å²	20	67.7 Å²	67.7	14%	0.14	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-155.4	177.2	-163	0	0	0	0	111.3	W667 M668 L672 S673	W667-S670 VanDerWaalsContact O-CB 3.23Å; W667-S670 WeakPolarHBondContact O-CB 3.29Å; W667-S670 PolarHBondContact O-N 3.16Å; W667-S670 VanDerWaalsContact O-N 3.12Å; M668-S670 PolarHBondContact O-N 3.01Å; S670-L672 PolarHBondContact O-N 3.36Å; S670-S673 PolarHBondContact O-N 3.46Å; S670-S673 PolarHBondContact O-OG 3.06Å
671	S	58.3	Low	68.3	Low	41 Å²	41	61.5 Å²	61.5	29%	0.287	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-48.7	-28.7	-173.5	-170.6	0	0	0	0	115.5	S673 I674 Q676	S671-S673 VanDerWaalsContact C-N 3.29Å; S671-S673 PolarHBondContact O-N 2.58Å; S671-I674 PolarHBondContact O-N 3.48Å; S671-I674 VanDerWaalsContact O-N 3.1Å; S671-Q676 PolarHBondContact O-NE2 3.19Å; S671-Q676 PolarHBondContact OG-NE2 2.9Å; S671-Q676 VanDerWaalsContact OG-NE2 3.1Å
672	L	60.5	Low	70.2	Confident	1 Å²	1	55 Å²	55	1%	0.005	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-71.5	-17.7	176.2	-72.4	170.2	0	0	0	114.5	W647 W667 S670 I674 F731 W840	W647-L672 HydrophobicContact CH2-CD2 3.54Å; W647-L672 HydrophobicContact CZ3-CD2 3.75Å; W667-L672 HydrophobicContact CE3-CB 4.24Å; W667-L672 HydrophobicContact CE3-CD1 3.34Å; W667-L672 HydrophobicContact CE3-CG 4.4Å; W667-L672 HydrophobicContact CH2-CD1 4.38Å; W667-L672 HydrophobicContact CZ3-CB 4.06Å; W667-L672 HydrophobicContact CZ3-CD1 3.26Å; W667-L672 HydrophobicContact CZ3-CG 4.28Å; S670-L672 PolarHBondContact O-N 3.36Å; L672-I674 PolarHBondContact O-N 3.22Å; L672-F731 HydrophobicContact CD1-CE1 3.65Å; L672-F731 HydrophobicContact CD1-CE2 3.71Å; L672-F731 HydrophobicContact CD1-CZ 3.1Å; L672-F731 HydrophobicContact CD2-CD1 4.17Å; L672-F731 HydrophobicContact CD2-CD2 3.92Å; L672-F731 HydrophobicContact CD2-CE1 3.94Å; L672-F731 HydrophobicContact CD2-CE2 3.72Å; L672-F731 HydrophobicContact CD2-CG 4.16Å; L672-F731 HydrophobicContact CD2-CZ 3.72Å; L672-F731 HydrophobicContact CG-CD2 4.02Å; L672-F731 HydrophobicContact CG-CE1 4Å; L672-F731 HydrophobicContact CG-CE2 3.33Å; L672-F731 HydrophobicContact CG-CZ 3.31Å; L672-W840 HydrophobicContact CD1-CE3 3.88Å; L672-W840 HydrophobicContact CD1-CZ3 3.52Å; L672-W840 HydrophobicContact CD2-CZ3 4.05Å; L672-W840 HydrophobicContact CG-CZ3 4.45Å
673	S	64.2	Low	71.1	Confident	37 Å²	37	54.9 Å²	54.9	26%	0.259	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-75.7	-2.4	168.7	57	0	0	0	0	113.3	R648 M668 S670 S671	R648-S673 PolarHBondContact NE-O 3.06Å; R648-S673 VanDerWaalsContact NE-O 3.17Å; R648-S673 PolarHBondContact NH1-O 3.06Å; R648-S673 PolarHBondContact NH2-O 2.99Å; M668-S673 WeakPolarHBondContact O-CB 3.32Å; M668-S673 PolarHBondContact O-N 2.67Å; M668-S673 PolarHBondContact O-OG 3.27Å; S670-S673 PolarHBondContact O-N 3.46Å; S670-S673 PolarHBondContact O-OG 3.06Å; S671-S673 VanDerWaalsContact C-N 3.29Å; S671-S673 PolarHBondContact O-N 2.58Å
674	I	75.6	Confident	71.7	Confident	109 Å²	109	54.3 Å²	54.3	56%	0.559	30%	0.296	S	S	*	.	S	Bend	trans	-114.5	144.3	-177.8	-49.5	176.4	0	0	0	108.2	S671 L672 Q676	S671-I674 PolarHBondContact O-N 3.48Å; S671-I674 VanDerWaalsContact O-N 3.1Å; L672-I674 PolarHBondContact O-N 3.22Å; I674-Q676 PolarHBondContact O-N 2.84Å
675	W	82.4	Confident	71.6	Confident	27 Å²	27	61.1 Å²	61.1	10%	0.102	32%	0.32	C	S	.	.			trans	-62.5	130.8	171.5	-70.6	104.6	0	0	0	110	L610 G611 V636 T638 E646 R648 F650	L610-W675 HydrophobicContact CB-CZ2 4.18Å; L610-W675 HydrophobicContact CD2-CH2 4.02Å; L610-W675 HydrophobicContact CD2-CZ2 3.76Å; G611-W675 PolarHBondContact O-NE1 3.16Å; V636-W675 HydrophobicContact CB-CH2 4.32Å; V636-W675 HydrophobicContact CG1-CH2 4.04Å; T638-W675 HydrophobicContact CG2-CH2 3.57Å; T638-W675 HydrophobicContact CG2-CZ2 4.33Å; T638-W675 HydrophobicContact CG2-CZ3 3.92Å; T638-W675 WeakPolarHBondContact OG1-CZ3 3.38Å; E646-W675 HydrophobicContact CB-CE3 3.97Å; R648-W675 HydrophobicContact CB-CD2 3.87Å; R648-W675 HydrophobicContact CB-CE3 3.59Å; R648-W675 HydrophobicContact CB-CH2 4.09Å; R648-W675 HydrophobicContact CB-CZ2 4.35Å; R648-W675 HydrophobicContact CB-CZ3 3.71Å; F650-W675 HydrophobicContact CZ-CZ2 4.45Å
676	Q	84.8	Confident	71.2	Confident	36 Å²	36	67.7 Å²	67.7	17%	0.168	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151.4	177.6	-68.5	179.4	43	0	0	110	E646 W647 S671 I674	E646-Q676 CarbonylContact C-O 3.59Å; E646-Q676 WeakPolarHBondContact CA-O 3.38Å; W647-Q676 HydrophobicContact CZ2-CB 4.19Å; W647-Q676 PolarHBondContact N-O 2.82Å; W647-Q676 PolarHBondContact O-N 2.64Å; S671-Q676 PolarHBondContact O-NE2 3.19Å; S671-Q676 PolarHBondContact OG-NE2 2.9Å; S671-Q676 VanDerWaalsContact OG-NE2 3.1Å; I674-Q676 PolarHBondContact O-N 2.84Å
677	H	87.4	Confident	70.3	Confident	111 Å²	111	62.9 Å²	62.9	51%	0.514	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	138	175.5	-174.3	78.4	0	0	0	111	L645 W647	L645-H677 PolarHBondContact O-ND1 3Å; W647-H677 PolarHBondContact NE1-O 3.32Å
678	L	89.9	Confident	69.4	Low	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	106.4	175.3	-175.1	66.5	0	0	0	109	V637 L645 W647 L697 T710 W733	V637-L678 HydrophobicContact CG1-CD2 3.87Å; V637-L678 HydrophobicContact CG2-CD2 4.05Å; L645-L678 HydrophobicContact CB-CB 3.82Å; L645-L678 HydrophobicContact CB-CD2 4.1Å; L645-L678 HydrophobicContact CB-CG 4.45Å; L645-L678 HydrophobicContact CD1-CD2 4.08Å; L645-L678 PolarHBondContact O-N 3.09Å; W647-L678 HydrophobicContact CB-CB 4.47Å; W647-L678 HydrophobicContact CG-CB 4.41Å; W647-L678 HydrophobicContact CG-CD1 4.2Å; L678-L697 HydrophobicContact CD2-CD1 4.37Å; L678-L697 HydrophobicContact CD2-CD2 3.99Å; L678-T710 HydrophobicContact CD1-CG2 3.72Å; L678-T710 HydrophobicContact CD2-CG2 4.15Å; L678-T710 HydrophobicContact CG-CG2 4.37Å; L678-W733 HydrophobicContact CD1-CD2 4.07Å; L678-W733 HydrophobicContact CD1-CH2 4.1Å; L678-W733 HydrophobicContact CD1-CZ2 3.37Å
679	P	91	Very high	68.6	Low	44 Å²	44	66.3 Å²	66.3	29%	0.286	35%	0.35	S	S	.	.			trans	-73.6	133.3	-176.2	29.4	-33.1	0	0	0	111.6	W733	P679-W733 HydrophobicContact CG-CB 3.56Å; P679-W733 HydrophobicContact CG-CG 3.81Å
680	L	89.5	Confident	67.5	Low	31 Å²	31	64.4 Å²	64.4	16%	0.162	35%	0.345	C	S	.	.			trans	-106	164	170.8	-64.7	177.8	0	0	0	110.9	L645 V695 L697 D712	L645-L680 HydrophobicContact CD1-CD1 3.84Å; L645-L680 HydrophobicContact CD1-CD2 4.22Å; L645-L680 HydrophobicContact CD1-CG 4.28Å; L645-L680 HydrophobicContact CG-CD1 4.3Å; L680-V695 HydrophobicContact CB-CB 4.31Å; L680-V695 HydrophobicContact CB-CG1 4Å; L680-V695 VanDerWaalsContact CD1-O 3.23Å; L680-V695 WeakPolarHBondContact CD1-O 3.32Å; L680-L697 HydrophobicContact CD2-CB 4.29Å; L680-L697 HydrophobicContact CD2-CD1 4.45Å; L680-D712 HydrophobicContact CD2-CB 4.07Å
681	S	88.3	Confident	66.7	Low	10 Å²	10	66 Å²	66	7%	0.07	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-60.3	149.2	174	-63.9	0	0	0	0	111.7	V695 D712 V716 R718	S681-V695 WeakPolarHBondContact O-CB 3.3Å; S681-V695 WeakPolarHBondContact O-CG2 3.47Å; S681-D712 WeakPolarHBondContact CB-OD2 3.41Å; S681-D712 PolarHBondContact N-OD2 3.38Å; S681-D712 PolarHBondContact OG-OD2 3.19Å; S681-V716 WeakPolarHBondContact OG-CB 3.36Å; S681-V716 WeakPolarHBondContact OG-CG2 3.35Å; S681-R718 VanDerWaalsContact CA-NH2 3.28Å; S681-R718 PolarHBondContact OG-NH2 2.71Å
682	P	81.8	Confident	66.2	Low	104 Å²	104	66.2 Å²	66.2	68%	0.675	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-63.4	144.7	168.8	27.8	-33.6	0	0	0	109.8	N714	P682-N714 PolarHBondContact O-ND2 2.89Å
683	P	68.9	Low	65.7	Low	66 Å²	66	68.1 Å²	68.1	43%	0.429	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-63.8	144.2	175	25	-32.1	0	0	0	111.5	K685 S693 V695	P683-K685 PolarHBondContact O-N 2.97Å; P683-S693 WeakPolarHBondContact CB-O 3.35Å; P683-S693 WeakPolarHBondContact CG-O 3.34Å; P683-V695 HydrophobicContact CB-CG2 4.43Å
684	L	64.3	Low	66	Low	70 Å²	70	67.9 Å²	67.9	37%	0.366	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-74.4	121	-179.8	-64.1	117	0	0	0	109.6	H686 N687 N714	L684-H686 PolarHBondContact O-N 2.85Å; L684-H686 VanDerWaalsContact O-N 3.08Å; L684-N687 PolarHBondContact O-N 2.89Å; L684-N687 VanDerWaalsContact O-N 3.12Å; L684-N714 VanDerWaalsContact CD1-OD1 3.27Å; L684-N714 WeakPolarHBondContact CD1-OD1 3.26Å
685	K	54.3	Low	66.3	Low	209 Å²	209	63 Å²	63	91%	0.909	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.1	178.2	-66.7	-175.1	177.8	-178	0	113.9	P683 N687	P683-K685 PolarHBondContact O-N 2.97Å; K685-N687 VanDerWaalsContact C-N 3.29Å; K685-N687 PolarHBondContact O-N 3.14Å
686	H	49.3	Very low	66.6	Low	173 Å²	173	64.7 Å²	64.7	80%	0.801	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-3.7	-179.5	-82.4	-72.4	0	0	0	114.6	L684	L684-H686 PolarHBondContact O-N 2.85Å; L684-H686 VanDerWaalsContact O-N 3.08Å
687	N	42.2	Very low	66.9	Low	49 Å²	49	63.1 Å²	63.1	26%	0.262	34%	0.336	S	S	.	.			trans	-104.1	99.7	178.6	-108.9	-6.5	0	0	0	109.3	L684 K685 S689 T692	L684-N687 PolarHBondContact O-N 2.89Å; L684-N687 VanDerWaalsContact O-N 3.12Å; K685-N687 VanDerWaalsContact C-N 3.29Å; K685-N687 PolarHBondContact O-N 3.14Å; N687-S689 PolarHBondContact O-N 3.34Å; N687-T692 VanDerWaalsContact CB-OG1 3.22Å; N687-T692 WeakPolarHBondContact CB-OG1 3.12Å; N687-T692 VanDerWaalsContact CG-OG1 3.29Å; N687-T692 WeakPolarHBondContact ND2-CB 3.4Å; N687-T692 PolarHBondContact ND2-OG1 2.84Å; N687-T692 VanDerWaalsContact ND2-OG1 3.09Å
688	T	43.5	Very low	67.2	Low	109 Å²	109	59.8 Å²	59.8	67%	0.669	32%	0.324	S	S	*	.			trans	-66.9	-8.8	172.1	46.2	0	0	0	0	113	I168 L690	I168-T688 VanDerWaalsContact O-O 3.13Å; T688-L690 PolarHBondContact O-N 3.08Å
689	S	45.2	Very low	67.5	Low	16 Å²	16	60.3 Å²	60.3	11%	0.112	33%	0.326	C	S	.	.			trans	-73.3	105.6	172.6	166.3	0	0	0	0	110.8	G169 N687 D691 T692 S693	G169-S689 PolarHBondContact O-OG 3.33Å; N687-S689 PolarHBondContact O-N 3.34Å; S689-D691 PolarHBondContact O-N 3.45Å; S689-T692 WeakPolarHBondContact CB-OG1 3.4Å; S689-T692 CarbonylContact O-C 3.49Å; S689-T692 WeakPolarHBondContact O-CA 3.14Å; S689-T692 PolarHBondContact O-N 2.74Å; S689-T692 PolarHBondContact O-OG1 3.24Å; S689-S693 PolarHBondContact O-N 3.32Å
690	L	38.4	Very low	67.7	Low	89 Å²	89	58.3 Å²	58.3	47%	0.466	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-7.2	-175.7	-135.2	133.9	0	0	0	112.9	I168 K170 T688 S693	I168-L690 HydrophobicContact CG2-CB 4.32Å; I168-L690 HydrophobicContact CG2-CD1 4.48Å; I168-L690 PolarHBondContact O-N 3.12Å; K170-L690 HydrophobicContact CD-CB 3.78Å; K170-L690 WeakPolarHBondContact CE-O 3.18Å; K170-L690 HydrophobicContact CG-CB 4.1Å; K170-L690 PolarHBondContact NZ-O 3.12Å; T688-L690 PolarHBondContact O-N 3.08Å; L690-S693 PolarHBondContact O-OG 3.24Å
691	D	42	Very low	68	Low	55 Å²	55	57.1 Å²	57.1	29%	0.294	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-21.6	174.6	-153.3	29.5	0	0	0	110.7	K170 S689 R696	K170-D691 HydrophobicContact CG-CB 4.22Å; S689-D691 PolarHBondContact O-N 3.45Å; D691-R696 PolarHBondContact O-NH1 2.93Å; D691-R696 IonicContact OD1-CZ 3.53Å; D691-R696 IonicContact OD1-NH1 3.83Å; D691-R696 IonicContact OD1-NH2 3.87Å; D691-R696 PolarHBondContact OD1-NH2 3.27Å; D691-R696 IonicContact OD2-NH2 3.99Å
692	T	46.8	Very low	68.2	Low	45 Å²	45	57.4 Å²	57.4	28%	0.276	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-8.7	162.8	66.5	0	0	0	0	113.3	N687 S689 V694	N687-T692 VanDerWaalsContact CB-OG1 3.22Å; N687-T692 WeakPolarHBondContact CB-OG1 3.12Å; N687-T692 VanDerWaalsContact CG-OG1 3.29Å; N687-T692 WeakPolarHBondContact ND2-CB 3.4Å; N687-T692 PolarHBondContact ND2-OG1 2.84Å; N687-T692 VanDerWaalsContact ND2-OG1 3.09Å; S689-T692 WeakPolarHBondContact CB-OG1 3.4Å; S689-T692 CarbonylContact O-C 3.49Å; S689-T692 WeakPolarHBondContact O-CA 3.14Å; S689-T692 PolarHBondContact O-N 2.74Å; S689-T692 PolarHBondContact O-OG1 3.24Å; T692-V694 PolarHBondContact O-N 2.87Å
693	S	50.5	Low	68.7	Low	40 Å²	40	52.5 Å²	52.5	28%	0.28	28%	0.276	S	S	.	.	S	Bend	trans	-72.9	-9.3	172.1	81.7	0	0	0	0	112.8	P683 S689 L690	P683-S693 WeakPolarHBondContact CB-O 3.35Å; P683-S693 WeakPolarHBondContact CG-O 3.34Å; S689-S693 PolarHBondContact O-N 3.32Å; L690-S693 PolarHBondContact O-OG 3.24Å
694	V	69.9	Low	69.4	Low	33 Å²	33	50.9 Å²	50.9	20%	0.2	26%	0.263	C	S	.	.	S	Bend	trans	-114.3	108.9	172.2	-166.4	0	0	0	0	108.7	V642 T692 R696	V642-V694 HydrophobicContact CB-CG1 4.21Å; V642-V694 HydrophobicContact CG1-CB 4.31Å; V642-V694 HydrophobicContact CG1-CG1 3.56Å; T692-V694 PolarHBondContact O-N 2.87Å; V694-R696 PolarHBondContact O-NH1 3.2Å
695	V	82.5	Confident	70.1	Confident	7 Å²	7	49.1 Å²	49.1	4%	0.042	26%	0.256	C	S	.	.			trans	-66	135.6	172.5	179.3	0	0	0	0	107.9	L680 S681 P683 D712 N714	L680-V695 HydrophobicContact CB-CB 4.31Å; L680-V695 HydrophobicContact CB-CG1 4Å; L680-V695 VanDerWaalsContact CD1-O 3.23Å; L680-V695 WeakPolarHBondContact CD1-O 3.32Å; S681-V695 WeakPolarHBondContact O-CB 3.3Å; S681-V695 WeakPolarHBondContact O-CG2 3.47Å; P683-V695 HydrophobicContact CB-CG2 4.43Å; V695-D712 HydrophobicContact CG1-CB 3.75Å; V695-N714 VanDerWaalsContact CG2-ND2 3.27Å; V695-N714 WeakPolarHBondContact CG2-ND2 3.31Å
696	R	87.4	Confident	71.5	Confident	62 Å²	62	39.1 Å²	39.1	23%	0.234	21%	0.212	C	C	.	.			trans	-119.5	149.1	-178.6	-68.8	-178.7	177.6	88.3	-12.1	110.2	D691 V694 D712 S713	D691-R696 PolarHBondContact O-NH1 2.93Å; D691-R696 IonicContact OD1-CZ 3.53Å; D691-R696 IonicContact OD1-NH1 3.83Å; D691-R696 IonicContact OD1-NH2 3.87Å; D691-R696 PolarHBondContact OD1-NH2 3.27Å; D691-R696 IonicContact OD2-NH2 3.99Å; V694-R696 PolarHBondContact O-NH1 3.2Å; R696-D712 CarbonylContact O-C 3.54Å; R696-D712 VanDerWaalsContact O-CA 3.3Å; R696-D712 WeakPolarHBondContact O-CA 3.39Å; R696-D712 WeakPolarHBondContact O-CB 3.42Å; R696-S713 PolarHBondContact N-OG 2.64Å; R696-S713 PolarHBondContact O-N 3.16Å
697	L	92.8	Very high	73.3	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	128.2	168.6	-174.6	68.7	0	0	0	108.9	Q417 F420 V624 V637 L645 L678 L680 W699 F700 T710	Q417-L697 PolarHBondContact NE2-O 3.38Å; F420-L697 HydrophobicContact CE1-CG 4.43Å; F420-L697 WeakPolarHBondContact CE1-O 3.48Å; F420-L697 HydrophobicContact CZ-CD2 4.5Å; F420-L697 HydrophobicContact CZ-CG 4.21Å; V624-L697 HydrophobicContact CG1-CD2 3.76Å; V637-L697 HydrophobicContact CG1-CD2 4.12Å; V637-L697 HydrophobicContact CG2-CD2 4.36Å; L645-L697 HydrophobicContact CD1-CB 3.62Å; L645-L697 HydrophobicContact CD1-CD2 4.1Å; L645-L697 HydrophobicContact CD1-CG 4.44Å; L678-L697 HydrophobicContact CD2-CD1 4.37Å; L678-L697 HydrophobicContact CD2-CD2 3.99Å; L680-L697 HydrophobicContact CD2-CB 4.29Å; L680-L697 HydrophobicContact CD2-CD1 4.45Å; L697-W699 WeakPolarHBondContact CD1-O 3.43Å; L697-F700 HydrophobicContact CD2-CB 4.21Å; L697-T710 HydrophobicContact CD1-CG2 4.02Å
698	T	92.2	Very high	75.7	Confident	40 Å²	40	28.6 Å²	28.6	25%	0.245	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-19.5	-177.7	52.2	0	0	0	0	112.9	F420 Y711 D712	F420-T698 WeakPolarHBondContact CE2-O 3.38Å; T698-Y711 PolarHBondContact N-O 2.93Å; T698-Y711 WeakPolarHBondContact OG1-CD1 3.49Å; T698-Y711 PolarHBondContact OG1-O 3.3Å; T698-Y711 VanDerWaalsContact OG1-O 3.08Å; T698-D712 PolarHBondContact OG1-O 3.08Å
699	W	96.3	Very high	78.2	Confident	12 Å²	12	23.4 Å²	23.4	5%	0.045	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	145	170.8	178.1	103.6	0	0	0	110.8	L697 G701 F709 Y711 V755 V758	L697-W699 WeakPolarHBondContact CD1-O 3.43Å; W699-G701 VanDerWaalsContact CH2-CA 3.48Å; W699-F709 HydrophobicContact CH2-CB 4.21Å; W699-F709 HydrophobicContact CZ3-CB 3.66Å; W699-Y711 HydrophobicContact CB-CD1 4.44Å; W699-Y711 PolarHBondContact N-O 3.15Å; W699-Y711 VanDerWaalsContact N-O 3.11Å; W699-Y711 PolarHBondContact O-N 3.19Å; W699-V755 HydrophobicContact CB-CB 4.03Å; W699-V755 HydrophobicContact CB-CG1 4.28Å; W699-V755 HydrophobicContact CD2-CB 4.28Å; W699-V755 HydrophobicContact CD2-CG1 3.54Å; W699-V755 HydrophobicContact CE3-CG1 4.01Å; W699-V755 HydrophobicContact CG-CB 3.88Å; W699-V755 HydrophobicContact CG-CG1 3.66Å; W699-V755 HydrophobicContact CZ2-CG1 4.38Å; W699-V758 HydrophobicContact CH2-CB 4.26Å; W699-V758 HydrophobicContact CH2-CG2 3.56Å; W699-V758 HydrophobicContact CZ2-CG2 4.33Å; W699-V758 HydrophobicContact CZ3-CG2 3.83Å
700	F	96.6	Very high	80.6	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.009	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	131.9	177.9	179.2	-116	0	0	0	109.5	S422 V624 A626 A635 V637 L697 L708 F709 T710 W733	S422-F700 WeakPolarHBondContact CB-O 3.41Å; S422-F700 PolarHBondContact OG-N 2.9Å; S422-F700 VanDerWaalsContact OG-N 3.07Å; S422-F700 PolarHBondContact OG-O 2.8Å; V624-F700 HydrophobicContact CG1-CB 3.65Å; V624-F700 HydrophobicContact CG1-CD1 3.83Å; V624-F700 HydrophobicContact CG1-CG 3.98Å; V624-F700 HydrophobicContact CG2-CB 4.15Å; V624-F700 HydrophobicContact CG2-CD1 4.46Å; A626-F700 HydrophobicContact CB-CD1 3.62Å; A626-F700 HydrophobicContact CB-CE1 3.74Å; A635-F700 HydrophobicContact CB-CE1 3.65Å; A635-F700 HydrophobicContact CB-CZ 3.59Å; V637-F700 HydrophobicContact CG2-CD1 3.99Å; V637-F700 HydrophobicContact CG2-CD2 4.17Å; V637-F700 HydrophobicContact CG2-CE1 3.77Å; V637-F700 HydrophobicContact CG2-CE2 3.95Å; V637-F700 HydrophobicContact CG2-CG 4.16Å; V637-F700 HydrophobicContact CG2-CZ 3.72Å; L697-F700 HydrophobicContact CD2-CB 4.21Å; F700-L708 HydrophobicContact CE1-CD1 4.41Å; F700-L708 HydrophobicContact CE2-CD1 3.79Å; F700-L708 HydrophobicContact CE2-CD2 3.97Å; F700-L708 HydrophobicContact CE2-CG 3.95Å; F700-L708 HydrophobicContact CZ-CD1 3.74Å; F700-L708 HydrophobicContact CZ-CD2 3.95Å; F700-L708 HydrophobicContact CZ-CG 4.2Å; F700-F709 WeakPolarHBondContact CD2-O 3.42Å; F700-T710 HydrophobicContact CD2-CG2 3.67Å; F700-T710 HydrophobicContact CE2-CG2 4.08Å; F700-W733 HydrophobicContact CE2-CH2 4.33Å
701	G	94.8	Very high	83.4	Confident	6 Å²	6	19 Å²	19	6%	0.062	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.7	170.2	-176.6	0	0	0	0	0	114.5	W699 F709	W699-G701 VanDerWaalsContact CH2-CA 3.48Å; G701-F709 PolarHBondContact N-O 3.15Å; G701-F709 VanDerWaalsContact N-O 3.13Å; G701-F709 PolarHBondContact O-N 2.67Å
702	F	93.6	Very high	85.8	Confident	16 Å²	16	16.4 Å²	16.4	7%	0.07	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	153.2	174.3	-69.9	-93.5	0	0	0	111.6	A626 S627 H628 I633 A635 G706 G707 L708 W840	A626-F702 HydrophobicContact CB-CD2 4.04Å; A626-F702 HydrophobicContact CB-CE2 4.15Å; S627-F702 WeakPolarHBondContact O-CD2 3.33Å; H628-F702 HydrophobicContact CB-CE1 4.45Å; H628-F702 HydrophobicContact CB-CZ 4.46Å; H628-F702 AromaticContact CD2-CD1 3.9Å; H628-F702 AromaticContact CD2-CE1 4Å; I633-F702 HydrophobicContact CG2-CZ 4.17Å; A635-F702 HydrophobicContact CB-CE2 3.75Å; A635-F702 HydrophobicContact CB-CZ 3.83Å; F702-G706 WeakPolarHBondContact CD1-O 3.36Å; F702-G707 CarbonylContact C-O 3.57Å; F702-G707 WeakPolarHBondContact CA-O 3.46Å; F702-L708 HydrophobicContact CD1-CB 4.24Å; F702-L708 HydrophobicContact CD1-CD1 3.94Å; F702-L708 HydrophobicContact CD2-CD1 3.86Å; F702-L708 HydrophobicContact CE1-CB 4.1Å; F702-L708 HydrophobicContact CE1-CD1 3.79Å; F702-L708 HydrophobicContact CE1-CG 4.45Å; F702-L708 HydrophobicContact CE2-CD1 3.7Å; F702-L708 HydrophobicContact CG-CD1 4.01Å; F702-L708 HydrophobicContact CZ-CD1 3.68Å; F702-W840 HydrophobicContact CE1-CZ2 4.1Å
703	S	90.9	Very high	87.8	Confident	1 Å²	1	16.4 Å²	16.4	1%	0.007	9%	0.093	C	C	.	.			trans	-74.7	175.6	163.9	70.3	0	0	0	0	111.4	T705 G706 G707 V758 E760	S703-T705 PolarHBondContact O-N 3.42Å; S703-T705 PolarHBondContact OG-N 3.31Å; S703-T705 PolarHBondContact OG-OG1 3.27Å; S703-G706 PolarHBondContact O-N 3.49Å; S703-G706 PolarHBondContact OG-N 3.48Å; S703-G707 PolarHBondContact N-O 3.46Å; S703-G707 PolarHBondContact OG-N 2.82Å; S703-V758 WeakPolarHBondContact CA-O 3.27Å; S703-V758 VanDerWaalsContact CB-O 3.27Å; S703-V758 WeakPolarHBondContact CB-O 3.38Å; S703-E760 WeakPolarHBondContact CB-OE2 3.42Å; S703-E760 PolarHBondContact OG-OE2 3.47Å
704	D	83.9	Confident	89.6	Confident	31 Å²	31	15.2 Å²	15.2	17%	0.166	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-33.6	171.9	35	-21.5	0	0	0	112.6	R438 L759 E760 S761	R438-D704 IonicContact CZ-OD1 2.62Å; R438-D704 VanDerWaalsContact NH1-CB 3.33Å; R438-D704 VanDerWaalsContact NH2-CB 3.31Å; R438-D704 IonicContact NH2-OD1 3.48Å; R438-D704 PolarHBondContact NH2-OD1 3.07Å; R438-D704 IonicContact NH2-OD2 3.33Å; D704-L759 VanDerWaalsContact OD1-CA 3.29Å; D704-L759 WeakPolarHBondContact OD1-CA 3.46Å; D704-E760 PolarHBondContact OD1-N 3.43Å; D704-S761 WeakPolarHBondContact OD2-CB 3.21Å; D704-S761 PolarHBondContact OD2-N 2.81Å; D704-S761 PolarHBondContact OD2-OG 3.09Å
705	T	78.6	Confident	90.6	Very high	33 Å²	33	13.8 Å²	13.8	20%	0.202	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.6	-177.4	50	0	0	0	0	112.7	S703 E760	S703-T705 PolarHBondContact O-N 3.42Å; S703-T705 PolarHBondContact OG-N 3.31Å; S703-T705 PolarHBondContact OG-OG1 3.27Å; T705-E760 HydrophobicContact CG2-CB 4.48Å; T705-E760 WeakPolarHBondContact OG1-CB 3.15Å; T705-E760 PolarHBondContact OG1-OE2 3.1Å
706	G	83.9	Confident	91.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.079	C	C	.	.	S	Bend	trans	95.1	6.8	174.5	0	0	0	0	0	116.2	H628 F702 S703 W840	H628-G706 WeakPolarHBondContact NE2-CA 3.46Å; F702-G706 WeakPolarHBondContact CD1-O 3.36Å; S703-G706 PolarHBondContact O-N 3.49Å; S703-G706 PolarHBondContact OG-N 3.48Å; G706-W840 PolarHBondContact O-NE1 2.72Å
707	G	88.4	Confident	91.6	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.068	C	C	.	.			trans	-68	140.9	170.5	0	0	0	0	0	111	F702 S703 F709 E760	F702-G707 CarbonylContact C-O 3.57Å; F702-G707 WeakPolarHBondContact CA-O 3.46Å; S703-G707 PolarHBondContact N-O 3.46Å; S703-G707 PolarHBondContact OG-N 2.82Å; G707-F709 VanDerWaalsContact O-CD2 3.3Å; G707-F709 WeakPolarHBondContact O-CD2 3.44Å; G707-E760 PolarHBondContact N-OE2 2.75Å
708	L	92.3	Very high	91.7	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	133	180	-172.4	67.4	0	0	0	111.1	A635 W647 F700 F702 L720 W733 W840	A635-L708 HydrophobicContact CB-CD1 4.07Å; A635-L708 HydrophobicContact CB-CD2 4.26Å; W647-L708 HydrophobicContact CE3-CD2 4.24Å; W647-L708 HydrophobicContact CZ3-CD2 4.26Å; F700-L708 HydrophobicContact CE1-CD1 4.41Å; F700-L708 HydrophobicContact CE2-CD1 3.79Å; F700-L708 HydrophobicContact CE2-CD2 3.97Å; F700-L708 HydrophobicContact CE2-CG 3.95Å; F700-L708 HydrophobicContact CZ-CD1 3.74Å; F700-L708 HydrophobicContact CZ-CD2 3.95Å; F700-L708 HydrophobicContact CZ-CG 4.2Å; F702-L708 HydrophobicContact CD1-CB 4.24Å; F702-L708 HydrophobicContact CD1-CD1 3.94Å; F702-L708 HydrophobicContact CD2-CD1 3.86Å; F702-L708 HydrophobicContact CE1-CB 4.1Å; F702-L708 HydrophobicContact CE1-CD1 3.79Å; F702-L708 HydrophobicContact CE1-CG 4.45Å; F702-L708 HydrophobicContact CE2-CD1 3.7Å; F702-L708 HydrophobicContact CG-CD1 4.01Å; F702-L708 HydrophobicContact CZ-CD1 3.68Å; L708-L720 HydrophobicContact CB-CB 4.14Å; L708-L720 HydrophobicContact CB-CD2 4.31Å; L708-L720 HydrophobicContact CD2-CD2 4.03Å; L708-L720 PolarHBondContact O-N 3.16Å; L708-W733 HydrophobicContact CD2-CH2 3.9Å; L708-W733 HydrophobicContact CD2-CZ2 4.21Å; L708-W733 HydrophobicContact CG-CH2 3.9Å; L708-W840 HydrophobicContact CB-CZ2 4.06Å
709	F	95.2	Very high	91.7	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	151.4	-172.9	-70.1	-97.2	0	0	0	112.9	W699 F700 G701 G707 V717 R718 R719 I736 V758 E760 F810	W699-F709 HydrophobicContact CH2-CB 4.21Å; W699-F709 HydrophobicContact CZ3-CB 3.66Å; F700-F709 WeakPolarHBondContact CD2-O 3.42Å; G701-F709 PolarHBondContact N-O 3.15Å; G701-F709 VanDerWaalsContact N-O 3.13Å; G701-F709 PolarHBondContact O-N 2.67Å; G707-F709 VanDerWaalsContact O-CD2 3.3Å; G707-F709 WeakPolarHBondContact O-CD2 3.44Å; F709-V717 HydrophobicContact CD1-CG1 4.09Å; F709-R718 VanDerWaalsContact CA-O 3.23Å; F709-R718 WeakPolarHBondContact CA-O 3.43Å; F709-R718 WeakPolarHBondContact CD1-O 3.47Å; F709-R719 HydrophobicContact CD1-CB 3.93Å; F709-R719 HydrophobicContact CD1-CG 4.28Å; F709-R719 HydrophobicContact CE1-CB 3.5Å; F709-R719 VanDerWaalsContact CE1-CB 3.5Å; F709-R719 HydrophobicContact CE1-CG 3.62Å; F709-R719 HydrophobicContact CE2-CG 4.18Å; F709-R719 HydrophobicContact CZ-CB 4.02Å; F709-R719 HydrophobicContact CZ-CG 3.57Å; F709-I736 HydrophobicContact CD1-CD1 3.99Å; F709-I736 HydrophobicContact CE1-CD1 3.5Å; F709-I736 VanDerWaalsContact CE1-CD1 3.5Å; F709-I736 HydrophobicContact CE1-CG1 4.32Å; F709-V758 HydrophobicContact CB-CG2 4.17Å; F709-V758 HydrophobicContact CD1-CG1 4.02Å; F709-V758 HydrophobicContact CD1-CG2 4.5Å; F709-V758 HydrophobicContact CD2-CB 4.33Å; F709-V758 HydrophobicContact CD2-CG1 3.77Å; F709-V758 HydrophobicContact CE1-CG1 3.94Å; F709-V758 HydrophobicContact CE2-CG1 3.73Å; F709-V758 HydrophobicContact CG-CB 4.4Å; F709-V758 HydrophobicContact CG-CG1 3.93Å; F709-V758 HydrophobicContact CG-CG2 4.19Å; F709-V758 HydrophobicContact CZ-CG1 3.79Å; F709-E760 HydrophobicContact CE2-CG 4.05Å; F709-E760 WeakPolarHBondContact CE2-OE1 3.35Å; F709-E760 HydrophobicContact CZ-CG 3.87Å; F709-E760 WeakPolarHBondContact CZ-OE1 3.4Å; F709-F810 HydrophobicContact CE1-CE2 4.18Å; F709-F810 AromaticContact CE1-CZ 3.85Å; F709-F810 HydrophobicContact CE1-CZ 3.85Å; F709-F810 HydrophobicContact CZ-CE2 4.35Å; F709-F810 HydrophobicContact CZ-CZ 4.29Å
710	T	96.5	Very high	91.5	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.006	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	152.9	170.9	57.9	0	0	0	0	110.2	L678 L697 F700 V717 R718 W733	L678-T710 HydrophobicContact CD1-CG2 3.72Å; L678-T710 HydrophobicContact CD2-CG2 4.15Å; L678-T710 HydrophobicContact CG-CG2 4.37Å; L697-T710 HydrophobicContact CD1-CG2 4.02Å; F700-T710 HydrophobicContact CD2-CG2 3.67Å; F700-T710 HydrophobicContact CE2-CG2 4.08Å; T710-V717 CarbonylContact O-C 3.58Å; T710-V717 VanDerWaalsContact O-CA 3.31Å; T710-V717 WeakPolarHBondContact O-CA 3.49Å; T710-R718 PolarHBondContact N-O 3.3Å; T710-R718 PolarHBondContact O-N 3.46Å; T710-W733 HydrophobicContact CG2-CE3 4.31Å; T710-W733 HydrophobicContact CG2-CH2 3.59Å; T710-W733 HydrophobicContact CG2-CZ2 4.23Å; T710-W733 HydrophobicContact CG2-CZ3 3.66Å
711	Y	96	Very high	91	Very high	10 Å²	10	12.5 Å²	12.5	4%	0.039	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	134.5	170.2	178.4	-109.2	0	0	0	109.2	T698 W699 G715 V716 V717 T739 Y753 V755	T698-Y711 PolarHBondContact N-O 2.93Å; T698-Y711 WeakPolarHBondContact OG1-CD1 3.49Å; T698-Y711 PolarHBondContact OG1-O 3.3Å; T698-Y711 VanDerWaalsContact OG1-O 3.08Å; W699-Y711 HydrophobicContact CB-CD1 4.44Å; W699-Y711 PolarHBondContact N-O 3.15Å; W699-Y711 VanDerWaalsContact N-O 3.11Å; W699-Y711 PolarHBondContact O-N 3.19Å; Y711-G715 VanDerWaalsContact CE2-C 3.43Å; Y711-G715 VanDerWaalsContact CE2-CA 3.42Å; Y711-G715 WeakPolarHBondContact CE2-O 3.43Å; Y711-V716 WeakPolarHBondContact CA-O 3.5Å; Y711-V717 HydrophobicContact CD2-CB 4.49Å; Y711-V717 HydrophobicContact CD2-CG2 3.58Å; Y711-V717 HydrophobicContact CE2-CG2 4.09Å; Y711-T739 HydrophobicContact CE2-CG2 3.73Å; Y711-T739 PolarHBondContact OH-OG1 2.81Å; Y711-Y753 WeakPolarHBondContact CE1-O 3.04Å; Y711-Y753 PolarHBondContact OH-O 2.94Å; Y711-V755 HydrophobicContact CD1-CB 4.11Å; Y711-V755 HydrophobicContact CD1-CG2 3.38Å; Y711-V755 HydrophobicContact CD2-CG2 3.94Å; Y711-V755 HydrophobicContact CE1-CG2 3.55Å; Y711-V755 HydrophobicContact CE2-CG2 4.05Å; Y711-V755 HydrophobicContact CG-CB 4.45Å; Y711-V755 HydrophobicContact CG-CG2 3.57Å
712	D	93.1	Very high	90.2	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	170.9	-176	69.1	25.6	0	0	0	113.1	L680 S681 V695 R696 T698 N714 G715 V716 R718	L680-D712 HydrophobicContact CD2-CB 4.07Å; S681-D712 WeakPolarHBondContact CB-OD2 3.41Å; S681-D712 PolarHBondContact N-OD2 3.38Å; S681-D712 PolarHBondContact OG-OD2 3.19Å; V695-D712 HydrophobicContact CG1-CB 3.75Å; R696-D712 CarbonylContact O-C 3.54Å; R696-D712 VanDerWaalsContact O-CA 3.3Å; R696-D712 WeakPolarHBondContact O-CA 3.39Å; R696-D712 WeakPolarHBondContact O-CB 3.42Å; T698-D712 PolarHBondContact OG1-O 3.08Å; D712-N714 PolarHBondContact O-N 2.81Å; D712-N714 VanDerWaalsContact O-N 3.1Å; D712-N714 WeakPolarHBondContact OD1-CA 3.28Å; D712-N714 WeakPolarHBondContact OD1-CB 3.17Å; D712-N714 PolarHBondContact OD1-N 3.12Å; D712-G715 PolarHBondContact O-N 3.4Å; D712-G715 PolarHBondContact OD1-N 3.41Å; D712-V716 PolarHBondContact N-O 2.99Å; D712-V716 PolarHBondContact OD1-N 2.95Å; D712-R718 IonicContact OD2-CZ 3.88Å; D712-R718 IonicContact OD2-NH1 2.62Å; D712-R718 PolarHBondContact OD2-NH1 2.71Å; D712-R718 IonicContact OD2-NH2 3.33Å
713	S	88.8	Confident	88.9	Confident	45 Å²	45	14.4 Å²	14.4	32%	0.315	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-11.3	179.6	61.9	0	0	0	0	114.3	R696	R696-S713 PolarHBondContact N-OG 2.64Å; R696-S713 PolarHBondContact O-N 3.16Å
714	N	88.9	Confident	87.6	Confident	16 Å²	16	24 Å²	24	9%	0.086	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-2.1	174.4	-80.3	0.2	0	0	0	112.9	P682 L684 V695 D712 R740	P682-N714 PolarHBondContact O-ND2 2.89Å; L684-N714 VanDerWaalsContact CD1-OD1 3.27Å; L684-N714 WeakPolarHBondContact CD1-OD1 3.26Å; V695-N714 VanDerWaalsContact CG2-ND2 3.27Å; V695-N714 WeakPolarHBondContact CG2-ND2 3.31Å; D712-N714 PolarHBondContact O-N 2.81Å; D712-N714 VanDerWaalsContact O-N 3.1Å; D712-N714 WeakPolarHBondContact OD1-CA 3.28Å; D712-N714 WeakPolarHBondContact OD1-CB 3.17Å; D712-N714 PolarHBondContact OD1-N 3.12Å; N714-R740 WeakPolarHBondContact O-CG 3.2Å; N714-R740 PolarHBondContact O-NE 3.21Å
715	G	90.7	Very high	86.5	Confident	2 Å²	2	25.6 Å²	25.6	2%	0.021	14%	0.135	C	C	.	.			trans	85.4	14.2	178.3	0	0	0	0	0	114.1	Y711 D712 T739	Y711-G715 VanDerWaalsContact CE2-C 3.43Å; Y711-G715 VanDerWaalsContact CE2-CA 3.42Å; Y711-G715 WeakPolarHBondContact CE2-O 3.43Å; D712-G715 PolarHBondContact O-N 3.4Å; D712-G715 PolarHBondContact OD1-N 3.41Å; G715-T739 VanDerWaalsContact CA-OG1 3.28Å; G715-T739 WeakPolarHBondContact CA-OG1 3.23Å; G715-T739 PolarHBondContact O-N 3.32Å; G715-T739 PolarHBondContact O-OG1 2.74Å; G715-T739 VanDerWaalsContact O-OG1 3.07Å
716	V	94	Very high	85.6	Confident	20 Å²	20	32.7 Å²	32.7	12%	0.121	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.8	179.2	-178.3	0	0	0	0	110	S681 Y711 D712 R718 P735 C737	S681-V716 WeakPolarHBondContact OG-CB 3.36Å; S681-V716 WeakPolarHBondContact OG-CG2 3.35Å; Y711-V716 WeakPolarHBondContact CA-O 3.5Å; D712-V716 PolarHBondContact N-O 2.99Å; D712-V716 PolarHBondContact OD1-N 2.95Å; V716-R718 HydrophobicContact CG1-CG 4.13Å; V716-P735 HydrophobicContact CG1-CB 3.8Å; V716-C737 WeakPolarHBondContact CA-O 3.29Å
717	V	95.8	Very high	84.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131	170.2	-172.5	0	0	0	0	108.6	F709 T710 Y711 P735 I736 C737 T739 L786	F709-V717 HydrophobicContact CD1-CG1 4.09Å; T710-V717 CarbonylContact O-C 3.58Å; T710-V717 VanDerWaalsContact O-CA 3.31Å; T710-V717 WeakPolarHBondContact O-CA 3.49Å; Y711-V717 HydrophobicContact CD2-CB 4.49Å; Y711-V717 HydrophobicContact CD2-CG2 3.58Å; Y711-V717 HydrophobicContact CE2-CG2 4.09Å; V717-P735 WeakPolarHBondContact O-CA 3.44Å; V717-I736 HydrophobicContact CB-CD1 4.39Å; V717-I736 HydrophobicContact CB-CG1 4.16Å; V717-I736 HydrophobicContact CG1-CD1 3.79Å; V717-I736 HydrophobicContact CG1-CG1 3.91Å; V717-I736 WeakPolarHBondContact O-CG1 3.25Å; V717-I736 PolarHBondContact O-N 3.44Å; V717-C737 HydrophobicContact CB-CB 3.95Å; V717-C737 HydrophobicContact CG2-CB 3.93Å; V717-C737 PolarHBondContact N-O 3.43Å; V717-C737 PolarHBondContact O-N 3.06Å; V717-T739 HydrophobicContact CG2-CG2 4.28Å; V717-L786 HydrophobicContact CG2-CD1 4.13Å; V717-L786 HydrophobicContact CG2-CD2 3.75Å; V717-L786 HydrophobicContact CG2-CG 4.46Å
718	R	94.9	Very high	83.2	Confident	23 Å²	23	49.3 Å²	49.3	9%	0.087	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	144.4	173.8	-56.3	176.9	172.9	72	5.2	111.1	S681 F709 T710 D712 V716 W733 V734 P735	S681-R718 VanDerWaalsContact CA-NH2 3.28Å; S681-R718 PolarHBondContact OG-NH2 2.71Å; F709-R718 VanDerWaalsContact CA-O 3.23Å; F709-R718 WeakPolarHBondContact CA-O 3.43Å; F709-R718 WeakPolarHBondContact CD1-O 3.47Å; T710-R718 PolarHBondContact N-O 3.3Å; T710-R718 PolarHBondContact O-N 3.46Å; D712-R718 IonicContact OD2-CZ 3.88Å; D712-R718 IonicContact OD2-NH1 2.62Å; D712-R718 PolarHBondContact OD2-NH1 2.71Å; D712-R718 IonicContact OD2-NH2 3.33Å; V716-R718 HydrophobicContact CG1-CG 4.13Å; R718-W733 HydrophobicContact CB-CE3 3.97Å; R718-V734 CarbonylContact C-O 3.54Å; R718-V734 WeakPolarHBondContact CA-O 3.23Å; R718-P735 HydrophobicContact CG-CB 4.35Å
719	R	93.2	Very high	82	Confident	8 Å²	8	49.4 Å²	49.4	3%	0.03	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	138.1	171.9	-174	179.2	-176.2	-102	3.8	109.3	F709 I721 V734 I736 E760 I833 D836	F709-R719 HydrophobicContact CD1-CB 3.93Å; F709-R719 HydrophobicContact CD1-CG 4.28Å; F709-R719 HydrophobicContact CE1-CB 3.5Å; F709-R719 VanDerWaalsContact CE1-CB 3.5Å; F709-R719 HydrophobicContact CE1-CG 3.62Å; F709-R719 HydrophobicContact CE2-CG 4.18Å; F709-R719 HydrophobicContact CZ-CB 4.02Å; F709-R719 HydrophobicContact CZ-CG 3.57Å; R719-I721 HydrophobicContact CG-CG2 4.41Å; R719-V734 PolarHBondContact N-O 3.49Å; R719-V734 PolarHBondContact O-N 2.74Å; R719-I736 HydrophobicContact CB-CG1 4.34Å; R719-I736 HydrophobicContact CB-CG2 3.88Å; R719-E760 IonicContact CZ-OE1 3.85Å; R719-E760 IonicContact NE-OE1 2.98Å; R719-E760 PolarHBondContact NE-OE1 2.89Å; R719-E760 IonicContact NH2-OE1 3.71Å; R719-E760 PolarHBondContact NH2-OE1 3.39Å; R719-I833 PolarHBondContact NH1-O 2.99Å; R719-D836 PolarHBondContact NH1-O 2.68Å; R719-D836 IonicContact NH1-OD2 3.58Å; R719-D836 PolarHBondContact NH2-O 2.74Å
720	L	91	Very high	81.1	Confident	12 Å²	12	55.6 Å²	55.6	6%	0.063	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	122.7	167.5	-173.2	66.5	0	0	0	109.7	W647 L708 F731 W733 W840	W647-L720 HydrophobicContact CH2-CD1 3.85Å; W647-L720 HydrophobicContact CH2-CD2 3.4Å; W647-L720 HydrophobicContact CH2-CG 4.27Å; W647-L720 HydrophobicContact CZ2-CD1 3.8Å; W647-L720 HydrophobicContact CZ2-CD2 4.19Å; W647-L720 HydrophobicContact CZ3-CD2 3.7Å; L708-L720 HydrophobicContact CB-CB 4.14Å; L708-L720 HydrophobicContact CB-CD2 4.31Å; L708-L720 HydrophobicContact CD2-CD2 4.03Å; L708-L720 PolarHBondContact O-N 3.16Å; L720-F731 HydrophobicContact CD1-CB 3.85Å; L720-F731 HydrophobicContact CD1-CD1 4.27Å; L720-F731 HydrophobicContact CD1-CG 4.49Å; L720-F731 HydrophobicContact CD2-CD1 4.09Å; L720-F731 HydrophobicContact CG-CD1 4.14Å; L720-W733 HydrophobicContact CB-CD2 4.36Å; L720-W733 HydrophobicContact CB-CE3 4.06Å; L720-W733 HydrophobicContact CB-CH2 3.93Å; L720-W733 HydrophobicContact CB-CZ2 4.21Å; L720-W733 HydrophobicContact CB-CZ3 3.83Å; L720-W733 HydrophobicContact CD1-CD2 3.96Å; L720-W733 HydrophobicContact CD1-CE3 4.5Å; L720-W733 HydrophobicContact CD1-CG 4.28Å; L720-W733 HydrophobicContact CD1-CZ2 4.03Å; L720-W840 HydrophobicContact CD2-CH2 3.61Å; L720-W840 HydrophobicContact CD2-CZ2 4.28Å
721	I	86.9	Confident	80.4	Confident	36 Å²	36	56.5 Å²	56.5	19%	0.185	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	163.9	173.5	63.4	160.8	0	0	0	110.1	R719 F731 H732 V734 D836	R719-I721 HydrophobicContact CG-CG2 4.41Å; I721-F731 WeakPolarHBondContact O-CA 3.33Å; I721-H732 HydrophobicContact CD1-CB 4.45Å; I721-H732 HydrophobicContact CG1-CB 4.03Å; I721-H732 WeakPolarHBondContact CG1-O 3.24Å; I721-H732 PolarHBondContact N-O 2.85Å; I721-H732 PolarHBondContact O-N 3.43Å; I721-V734 HydrophobicContact CD1-CB 4.45Å; I721-V734 HydrophobicContact CD1-CG2 3.37Å; I721-V734 HydrophobicContact CG1-CG2 3.72Å; I721-D836 WeakPolarHBondContact CA-OD2 3.43Å; I721-D836 WeakPolarHBondContact CB-OD2 3.24Å
722	H	76.6	Confident	80	Confident	33 Å²	33	60.6 Å²	60.6	15%	0.153	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	157.2	176.7	63.4	82.3	0	0	0	113.7	E730 F731 D836 W837 I839	H722-E730 CarbonylContact C-O 3.52Å; H722-E730 VanDerWaalsContact CA-O 3.27Å; H722-E730 WeakPolarHBondContact CA-O 3.46Å; H722-F731 HydrophobicContact CB-CD1 3.79Å; H722-F731 HydrophobicContact CB-CE1 3.67Å; H722-F731 HydrophobicContact CB-CZ 4.35Å; H722-D836 IonicContact CD2-OD1 3.56Å; H722-D836 IonicContact CD2-OD2 2.74Å; H722-D836 IonicContact CE1-OD1 3.41Å; H722-D836 PolarHBondContact CE1-OD1 3.19Å; H722-D836 PolarHBondContact N-OD2 3.36Å; H722-D836 IonicContact ND1-OD1 3.07Å; H722-D836 IonicContact NE2-OD1 3.8Å; H722-W837 PolarHBondContact CE1-O 3.14Å; H722-W837 PolarHBondContact NE2-O 3Å; H722-I839 HydrophobicContact CB-CD1 3.97Å; H722-I839 HydrophobicContact CB-CG1 4.47Å; H722-I839 WeakPolarHBondContact CE1-CG1 3.26Å; H722-I839 WeakPolarHBondContact NE2-CG1 3.28Å
723	G	67.3	Low	79.9	Confident	30 Å²	30	62.1 Å²	62.1	31%	0.309	29%	0.293	S	S	.	.			trans	-64.5	156.6	170.6	0	0	0	0	0	112.3	S725 E730	G723-S725 PolarHBondContact O-N 2.99Å; G723-E730 PolarHBondContact N-O 2.95Å
724	R	63	Low	80.1	Confident	203 Å²	203	61.9 Å²	61.9	77%	0.766	29%	0.289	S	S	*	.	S	Bend	trans	-72.4	-6.8	176.8	-66.4	-175.2	177.4	-175	-2.4	114.2	Q726	R724-Q726 PolarHBondContact O-N 3.04Å
725	S	60.8	Low	80.3	Confident	63 Å²	63	63.6 Å²	63.6	44%	0.441	30%	0.301	S	S	.	.			trans	-71.4	110.9	178.9	-179.2	0	0	0	0	110.4	G723 R727 H728	G723-S725 PolarHBondContact O-N 2.99Å; S725-R727 VanDerWaalsContact C-N 3.3Å; S725-R727 PolarHBondContact O-N 3.45Å; S725-H728 CarbonylContact O-C 3.5Å
726	Q	60.3	Low	80.3	Confident	183 Å²	183	63.5 Å²	63.5	86%	0.855	30%	0.3	S	S	*	.	S	Bend	trans	-68.2	-28.1	178.9	-66.3	-167.4	6	0	0	113.3	R724	R724-Q726 PolarHBondContact O-N 3.04Å
727	R	60.2	Low	80.2	Confident	214 Å²	214	62.7 Å²	62.7	81%	0.808	30%	0.296	S	S	*	.	S	Bend	trans	-79.5	-40.3	-176.5	-69.4	-171.6	-178.7	177.8	1.9	112.5	S725	S725-R727 VanDerWaalsContact C-N 3.3Å; S725-R727 PolarHBondContact O-N 3.45Å
728	H	61.7	Low	80	Confident	134 Å²	134	65 Å²	65	62%	0.62	31%	0.308	S	S	*	.	S	Bend	trans	-135.5	81.9	-179.8	-64.8	-70.9	0	0	0	109	S725 E730	S725-H728 CarbonylContact O-C 3.5Å; H728-E730 PolarHBondContact O-N 3.21Å
729	P	66.7	Low	79.8	Confident	3 Å²	3	64 Å²	64	2%	0.019	30%	0.304	C	S	.	.			trans	-70.4	120.6	175	28.3	-33.1	0	0	0	109.7	F731 I839	P729-F731 HydrophobicContact CB-CE2 3.81Å; P729-F731 HydrophobicContact CB-CZ 3.71Å; P729-F731 HydrophobicContact CG-CE2 3.81Å; P729-F731 HydrophobicContact CG-CZ 3.83Å; P729-F731 WeakPolarHBondContact O-CD2 3.5Å; P729-F731 WeakPolarHBondContact O-CE2 3.29Å; P729-I839 HydrophobicContact CB-CD1 3.11Å; P729-I839 HydrophobicContact CG-CD1 3.6Å
730	E	75.7	Confident	79.5	Confident	131 Å²	131	65.8 Å²	65.8	61%	0.612	31%	0.311	S	S	*	.			trans	-91.2	131.3	169.1	-66.5	178	174.5	0	0	108.9	H722 G723 H728 H732	H722-E730 CarbonylContact C-O 3.52Å; H722-E730 VanDerWaalsContact CA-O 3.27Å; H722-E730 WeakPolarHBondContact CA-O 3.46Å; G723-E730 PolarHBondContact N-O 2.95Å; H728-E730 PolarHBondContact O-N 3.21Å; E730-H732 IonicContact OE2-CE1 2.95Å
731	F	83.3	Confident	79.2	Confident	19 Å²	19	68.1 Å²	68.1	8%	0.083	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.3	-175.2	-64.9	-86.4	0	0	0	111	W647 L672 L720 I721 H722 P729 I839	W647-F731 HydrophobicContact CH2-CB 4.39Å; W647-F731 HydrophobicContact CH2-CG 4.4Å; W647-F731 HydrophobicContact CZ2-CB 4.29Å; L672-F731 HydrophobicContact CD1-CE1 3.65Å; L672-F731 HydrophobicContact CD1-CE2 3.71Å; L672-F731 HydrophobicContact CD1-CZ 3.1Å; L672-F731 HydrophobicContact CD2-CD1 4.17Å; L672-F731 HydrophobicContact CD2-CD2 3.92Å; L672-F731 HydrophobicContact CD2-CE1 3.94Å; L672-F731 HydrophobicContact CD2-CE2 3.72Å; L672-F731 HydrophobicContact CD2-CG 4.16Å; L672-F731 HydrophobicContact CD2-CZ 3.72Å; L672-F731 HydrophobicContact CG-CD2 4.02Å; L672-F731 HydrophobicContact CG-CE1 4Å; L672-F731 HydrophobicContact CG-CE2 3.33Å; L672-F731 HydrophobicContact CG-CZ 3.31Å; L720-F731 HydrophobicContact CD1-CB 3.85Å; L720-F731 HydrophobicContact CD1-CD1 4.27Å; L720-F731 HydrophobicContact CD1-CG 4.49Å; L720-F731 HydrophobicContact CD2-CD1 4.09Å; L720-F731 HydrophobicContact CG-CD1 4.14Å; I721-F731 WeakPolarHBondContact O-CA 3.33Å; H722-F731 HydrophobicContact CB-CD1 3.79Å; H722-F731 HydrophobicContact CB-CE1 3.67Å; H722-F731 HydrophobicContact CB-CZ 4.35Å; P729-F731 HydrophobicContact CB-CE2 3.81Å; P729-F731 HydrophobicContact CB-CZ 3.71Å; P729-F731 HydrophobicContact CG-CE2 3.81Å; P729-F731 HydrophobicContact CG-CZ 3.83Å; P729-F731 WeakPolarHBondContact O-CD2 3.5Å; P729-F731 WeakPolarHBondContact O-CE2 3.29Å; F731-I839 HydrophobicContact CE1-CD1 4Å; F731-I839 HydrophobicContact CZ-CD1 3.72Å
732	H	87.1	Confident	79.2	Confident	97 Å²	97	70.4 Å²	70.4	45%	0.449	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136.7	-178.4	-56.8	89.9	0	0	0	109.7	I721 E730	I721-H732 HydrophobicContact CD1-CB 4.45Å; I721-H732 HydrophobicContact CG1-CB 4.03Å; I721-H732 WeakPolarHBondContact CG1-O 3.24Å; I721-H732 PolarHBondContact N-O 2.85Å; I721-H732 PolarHBondContact O-N 3.43Å; E730-H732 IonicContact OE2-CE1 2.95Å
733	W	92	Very high	79.7	Confident	32 Å²	32	69.1 Å²	69.1	12%	0.121	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	115.9	173.9	-72.7	97.6	0	0	0	109.5	W647 L678 P679 F700 L708 T710 R718 L720	W647-W733 AromaticContact CD1-NE1 3.89Å; W647-W733 HydrophobicContact CD2-CZ2 4.12Å; W647-W733 AromaticContact CE2-NE1 3.5Å; W647-W733 HydrophobicContact CE3-CZ2 4.5Å; W647-W733 HydrophobicContact CG-CZ2 4.45Å; W647-W733 AromaticContact CZ2-NE1 3.86Å; W647-W733 AromaticContact NE1-NE1 3.2Å; L678-W733 HydrophobicContact CD1-CD2 4.07Å; L678-W733 HydrophobicContact CD1-CH2 4.1Å; L678-W733 HydrophobicContact CD1-CZ2 3.37Å; P679-W733 HydrophobicContact CG-CB 3.56Å; P679-W733 HydrophobicContact CG-CG 3.81Å; F700-W733 HydrophobicContact CE2-CH2 4.33Å; L708-W733 HydrophobicContact CD2-CH2 3.9Å; L708-W733 HydrophobicContact CD2-CZ2 4.21Å; L708-W733 HydrophobicContact CG-CH2 3.9Å; T710-W733 HydrophobicContact CG2-CE3 4.31Å; T710-W733 HydrophobicContact CG2-CH2 3.59Å; T710-W733 HydrophobicContact CG2-CZ2 4.23Å; T710-W733 HydrophobicContact CG2-CZ3 3.66Å; R718-W733 HydrophobicContact CB-CE3 3.97Å; L720-W733 HydrophobicContact CB-CD2 4.36Å; L720-W733 HydrophobicContact CB-CE3 4.06Å; L720-W733 HydrophobicContact CB-CH2 3.93Å; L720-W733 HydrophobicContact CB-CZ2 4.21Å; L720-W733 HydrophobicContact CB-CZ3 3.83Å; L720-W733 HydrophobicContact CD1-CD2 3.96Å; L720-W733 HydrophobicContact CD1-CE3 4.5Å; L720-W733 HydrophobicContact CD1-CG 4.28Å; L720-W733 HydrophobicContact CD1-CZ2 4.03Å
734	V	91.5	Very high	80.4	Confident	40 Å²	40	75.3 Å²	75.3	24%	0.242	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	127.7	-179.4	173.4	0	0	0	0	109.9	R718 R719 I721 I736 I833	R718-V734 CarbonylContact C-O 3.54Å; R718-V734 WeakPolarHBondContact CA-O 3.23Å; R719-V734 PolarHBondContact N-O 3.49Å; R719-V734 PolarHBondContact O-N 2.74Å; I721-V734 HydrophobicContact CD1-CB 4.45Å; I721-V734 HydrophobicContact CD1-CG2 3.37Å; I721-V734 HydrophobicContact CG1-CG2 3.72Å; V734-I736 HydrophobicContact CG1-CG2 4.4Å; V734-I736 PolarHBondContact O-N 3.33Å; V734-I833 HydrophobicContact CG1-CD1 4.4Å
735	P	93.4	Very high	81	Confident	53 Å²	53	73.4 Å²	73.4	34%	0.344	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	127.7	172.3	30.2	-33.9	0	0	0	110.1	V716 V717 R718 P813	V716-P735 HydrophobicContact CG1-CB 3.8Å; V717-P735 WeakPolarHBondContact O-CA 3.44Å; R718-P735 HydrophobicContact CG-CB 4.35Å; P735-P813 HydrophobicContact CB-CG 3.92Å; P735-P813 HydrophobicContact CG-CG 4.25Å
736	I	91.5	Very high	81.4	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	-14.9	-173.5	55.7	132.5	0	0	0	114.1	F709 V717 R719 V734 F783 F810 R811 L812	F709-I736 HydrophobicContact CD1-CD1 3.99Å; F709-I736 HydrophobicContact CE1-CD1 3.5Å; F709-I736 VanDerWaalsContact CE1-CD1 3.5Å; F709-I736 HydrophobicContact CE1-CG1 4.32Å; V717-I736 HydrophobicContact CB-CD1 4.39Å; V717-I736 HydrophobicContact CB-CG1 4.16Å; V717-I736 HydrophobicContact CG1-CD1 3.79Å; V717-I736 HydrophobicContact CG1-CG1 3.91Å; V717-I736 WeakPolarHBondContact O-CG1 3.25Å; V717-I736 PolarHBondContact O-N 3.44Å; R719-I736 HydrophobicContact CB-CG1 4.34Å; R719-I736 HydrophobicContact CB-CG2 3.88Å; V734-I736 HydrophobicContact CG1-CG2 4.4Å; V734-I736 PolarHBondContact O-N 3.33Å; I736-F783 HydrophobicContact CB-CZ 4.37Å; I736-F783 HydrophobicContact CG2-CE2 4.5Å; I736-F810 HydrophobicContact CD1-CD1 3.51Å; I736-F810 HydrophobicContact CD1-CD2 3.78Å; I736-F810 HydrophobicContact CD1-CE1 3.32Å; I736-F810 HydrophobicContact CD1-CE2 3.61Å; I736-F810 HydrophobicContact CD1-CG 3.69Å; I736-F810 HydrophobicContact CD1-CZ 3.32Å; I736-R811 CarbonylContact C-O 3.54Å; I736-R811 CarbonylContact O-C 3.49Å; I736-R811 PolarHBondContact O-N 3.12Å; I736-L812 HydrophobicContact CB-CD2 4.15Å; I736-L812 HydrophobicContact CG2-CD2 4.08Å
737	C	91.1	Very high	82.2	Confident	3 Å²	3	67 Å²	67	2%	0.02	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	136.8	175.9	-173.5	0	0	0	0	109.9	V716 V717 F810 R811	V716-C737 WeakPolarHBondContact CA-O 3.29Å; V717-C737 HydrophobicContact CB-CB 3.95Å; V717-C737 HydrophobicContact CG2-CB 3.93Å; V717-C737 PolarHBondContact N-O 3.43Å; V717-C737 PolarHBondContact O-N 3.06Å; C737-F810 HydrophobicContact CB-CD1 4.21Å; C737-R811 WeakPolarHBondContact CA-O 3.38Å
738	D	91.4	Very high	83	Confident	49 Å²	49	61.6 Å²	61.6	26%	0.262	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	102.6	165.5	174.7	-0.6	0	0	0	108.5	R740 S741 P813	D738-R740 PolarHBondContact O-N 3.4Å; D738-R740 WeakPolarHBondContact OD1-CB 3.32Å; D738-R740 PolarHBondContact OD1-N 2.95Å; D738-S741 WeakPolarHBondContact O-CB 3.49Å; D738-S741 PolarHBondContact O-N 2.87Å; D738-S741 PolarHBondContact O-OG 3.31Å; D738-S741 PolarHBondContact OD1-N 2.68Å; D738-P813 HydrophobicContact CB-CB 4.32Å
739	T	91.3	Very high	83.4	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.006	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-20.4	-177.6	64.6	0	0	0	0	112.6	Y711 G715 V717 L742 L786	Y711-T739 HydrophobicContact CE2-CG2 3.73Å; Y711-T739 PolarHBondContact OH-OG1 2.81Å; G715-T739 VanDerWaalsContact CA-OG1 3.28Å; G715-T739 WeakPolarHBondContact CA-OG1 3.23Å; G715-T739 PolarHBondContact O-N 3.32Å; G715-T739 PolarHBondContact O-OG1 2.74Å; G715-T739 VanDerWaalsContact O-OG1 3.07Å; V717-T739 HydrophobicContact CG2-CG2 4.28Å; T739-L742 WeakPolarHBondContact O-CB 3.32Å; T739-L742 PolarHBondContact O-N 3.09Å; T739-L786 HydrophobicContact CG2-CD2 3.53Å
740	R	87.4	Confident	83.6	Confident	46 Å²	46	60.5 Å²	60.5	17%	0.174	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-24.9	179.3	-62	-137.8	-57.4	-140.8	3.9	112.8	N714 D738 L742 L743 R748	N714-R740 WeakPolarHBondContact O-CG 3.2Å; N714-R740 PolarHBondContact O-NE 3.21Å; D738-R740 PolarHBondContact O-N 3.4Å; D738-R740 WeakPolarHBondContact OD1-CB 3.32Å; D738-R740 PolarHBondContact OD1-N 2.95Å; R740-L742 PolarHBondContact O-N 3.05Å; R740-L743 HydrophobicContact CG-CD1 4.41Å; R740-L743 PolarHBondContact O-N 2.98Å; R740-L743 VanDerWaalsContact O-N 3.13Å; R740-R748 PolarHBondContact O-NE 2.9Å; R740-R748 VanDerWaalsContact O-NE 3.16Å
741	S	84.7	Confident	84.1	Confident	60 Å²	60	54.3 Å²	54.3	42%	0.42	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.4	169.8	75.5	0	0	0	0	112.2	D738 L743 R748	D738-S741 WeakPolarHBondContact O-CB 3.49Å; D738-S741 PolarHBondContact O-N 2.87Å; D738-S741 PolarHBondContact O-OG 3.31Å; D738-S741 PolarHBondContact OD1-N 2.68Å; S741-L743 VanDerWaalsContact C-N 3.34Å; S741-R748 PolarHBondContact O-NH2 2.93Å; S741-R748 VanDerWaalsContact O-NH2 3.15Å
742	L	86.4	Confident	84.4	Confident	85 Å²	85	54.9 Å²	54.9	45%	0.445	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-16.5	179.7	-53.3	173.7	0	0	0	113.7	T739 R740 Y753 I808	T739-L742 WeakPolarHBondContact O-CB 3.32Å; T739-L742 PolarHBondContact O-N 3.09Å; R740-L742 PolarHBondContact O-N 3.05Å; L742-Y753 HydrophobicContact CB-CE2 4.46Å; L742-I808 HydrophobicContact CD1-CB 4.48Å; L742-I808 HydrophobicContact CD1-CD1 4.4Å; L742-I808 HydrophobicContact CD1-CG2 3.26Å
743	L	86.3	Confident	84.7	Confident	6 Å²	6	52 Å²	52	3%	0.031	26%	0.258	C	S	.	.	S	Bend	trans	-82.7	142	177.7	-61.5	175.1	0	0	0	110.3	R740 S741 Q745 R748 D751 Y753 Y790	R740-L743 HydrophobicContact CG-CD1 4.41Å; R740-L743 PolarHBondContact O-N 2.98Å; R740-L743 VanDerWaalsContact O-N 3.13Å; S741-L743 VanDerWaalsContact C-N 3.34Å; L743-Q745 PolarHBondContact O-N 3.25Å; L743-R748 HydrophobicContact CB-CG 3.86Å; L743-R748 PolarHBondContact O-NE 2.76Å; L743-D751 HydrophobicContact CD1-CB 4.37Å; L743-D751 WeakPolarHBondContact CD1-O 3.44Å; L743-D751 HydrophobicContact CD2-CB 4.25Å; L743-Y753 HydrophobicContact CD2-CD2 4.17Å; L743-Y753 HydrophobicContact CD2-CE2 3.53Å; L743-Y753 HydrophobicContact CG-CD2 4.48Å; L743-Y753 HydrophobicContact CG-CE2 4.04Å; L743-Y790 HydrophobicContact CD2-CD2 4.08Å; L743-Y790 HydrophobicContact CD2-CE2 3.51Å
744	K	82	Confident	84.8	Confident	160 Å²	160	51.1 Å²	51.1	70%	0.696	26%	0.255	S	S	*	.			trans	-54.4	139.6	169.9	-68.2	-172.6	179.1	-173.6	0	109.7	S746 N747 R748	K744-S746 VanDerWaalsContact C-N 3.26Å; K744-S746 PolarHBondContact O-N 3.22Å; K744-N747 HydrophobicContact CB-CB 4.42Å; K744-N747 WeakPolarHBondContact O-CA 3.3Å; K744-N747 PolarHBondContact O-N 3.46Å; K744-R748 PolarHBondContact O-N 2.73Å
745	Q	76.1	Confident	85	Confident	162 Å²	162	49.4 Å²	49.4	76%	0.757	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-55.4	-40.4	-174.2	-171.1	168.3	-9.6	0	0	112.9	L743 N747 R748	L743-Q745 PolarHBondContact O-N 3.25Å; Q745-N747 PolarHBondContact O-N 3.44Å; Q745-R748 PolarHBondContact O-N 3.05Å
746	S	69.9	Low	85	Confident	81 Å²	81	47.2 Å²	47.2	57%	0.566	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-59.5	-26.4	174.8	58.8	0	0	0	0	114.2	K744	K744-S746 VanDerWaalsContact C-N 3.26Å; K744-S746 PolarHBondContact O-N 3.22Å
747	N	77.3	Confident	85.1	Confident	31 Å²	31	47.3 Å²	47.3	17%	0.166	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-104.2	-8.8	-170.4	-68.8	18.3	0	0	0	113.1	K744 Q745 R749 T750 D751	K744-N747 HydrophobicContact CB-CB 4.42Å; K744-N747 WeakPolarHBondContact O-CA 3.3Å; K744-N747 PolarHBondContact O-N 3.46Å; Q745-N747 PolarHBondContact O-N 3.44Å; N747-R749 PolarHBondContact O-N 2.72Å; N747-T750 PolarHBondContact O-N 2.72Å; N747-T750 PolarHBondContact O-OG1 2.97Å; N747-D751 HydrophobicContact CB-CB 4.25Å; N747-D751 VanDerWaalsContact CB-OD2 3.27Å; N747-D751 WeakPolarHBondContact CB-OD2 3.5Å; N747-D751 PolarHBondContact ND2-OD2 2.6Å; N747-D751 PolarHBondContact O-N 2.9Å
748	R	77.1	Confident	85.2	Confident	101 Å²	101	47.2 Å²	47.2	38%	0.381	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.2	-174.6	-77.3	176.3	-176.5	-178.4	-2.6	114.7	R740 S741 L743 K744 Q745	R740-R748 PolarHBondContact O-NE 2.9Å; R740-R748 VanDerWaalsContact O-NE 3.16Å; S741-R748 PolarHBondContact O-NH2 2.93Å; S741-R748 VanDerWaalsContact O-NH2 3.15Å; L743-R748 HydrophobicContact CB-CG 3.86Å; L743-R748 PolarHBondContact O-NE 2.76Å; K744-R748 PolarHBondContact O-N 2.73Å; Q745-R748 PolarHBondContact O-N 3.05Å
749	R	70	Confident	85.1	Confident	94 Å²	94	46 Å²	46	36%	0.355	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-26.6	175.7	-64.3	-171.1	71.8	-160.8	-10.3	113.4	D128 E130 N747	D128-R749 VanDerWaalsContact CA-NH1 3.3Å; D128-R749 PolarHBondContact O-NH1 3.01Å; D128-R749 IonicContact OD1-CZ 3.99Å; D128-R749 IonicContact OD1-NE 3.81Å; D128-R749 IonicContact OD1-NH1 3.94Å; D128-R749 PolarHBondContact OD1-NH1 3.36Å; E130-R749 PolarHBondContact O-NH1 3.12Å; E130-R749 PolarHBondContact O-NH2 3.28Å; N747-R749 PolarHBondContact O-N 2.72Å
750	T	71.1	Confident	84.6	Confident	20 Å²	20	47.1 Å²	47.1	12%	0.123	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-36.3	-171.1	53.1	0	0	0	0	113.1	R91 E130 N747 A793 S794	R91-T750 PolarHBondContact NH2-OG1 3.21Å; E130-T750 WeakPolarHBondContact OE1-CG2 3.36Å; N747-T750 PolarHBondContact O-N 2.72Å; N747-T750 PolarHBondContact O-OG1 2.97Å; T750-A793 CarbonylContact O-C 3.46Å; T750-A793 WeakPolarHBondContact O-CA 3.42Å; T750-S794 PolarHBondContact O-N 2.85Å
751	D	85.4	Confident	83.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.234	C	C	.	.			trans	-96.7	148.2	-176.7	-62.1	-11.3	0	0	0	110.9	R91 L743 N747 Y790 C791 K792 A793	R91-D751 IonicContact CZ-OD1 3.16Å; R91-D751 VanDerWaalsContact NH2-CG 3.31Å; R91-D751 IonicContact NH2-OD1 2.68Å; R91-D751 PolarHBondContact NH2-OD1 3.24Å; R91-D751 IonicContact NH2-OD2 3.22Å; R91-D751 PolarHBondContact NH2-OD2 3.21Å; L743-D751 HydrophobicContact CD1-CB 4.37Å; L743-D751 WeakPolarHBondContact CD1-O 3.44Å; L743-D751 HydrophobicContact CD2-CB 4.25Å; N747-D751 HydrophobicContact CB-CB 4.25Å; N747-D751 VanDerWaalsContact CB-OD2 3.27Å; N747-D751 WeakPolarHBondContact CB-OD2 3.5Å; N747-D751 PolarHBondContact ND2-OD2 2.6Å; N747-D751 PolarHBondContact O-N 2.9Å; D751-Y790 HydrophobicContact CB-CE2 3.8Å; D751-Y790 PolarHBondContact OD2-OH 2.95Å; D751-C791 WeakPolarHBondContact CA-O 3.5Å; D751-K792 WeakPolarHBondContact OD1-CA 3.38Å; D751-A793 PolarHBondContact OD1-N 3.37Å
752	N	89.2	Confident	82.3	Confident	32 Å²	32	46.1 Å²	46.1	17%	0.171	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	171.7	176.6	-65.5	-73.1	0	0	0	110.8	C791	N752-C791 PolarHBondContact N-O 3.21Å; N752-C791 WeakPolarHBondContact O-CA 3.16Å; N752-C791 WeakPolarHBondContact O-CB 3.36Å; N752-C791 PolarHBondContact O-N 3.26Å
753	Y	93.1	Very high	80.7	Confident	37 Å²	37	48.4 Å²	48.4	15%	0.145	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.5	169.4	-75.2	-81.8	0	0	0	110.5	Y711 L742 L743 A788 I789 Y790 I808	Y711-Y753 WeakPolarHBondContact CE1-O 3.04Å; Y711-Y753 PolarHBondContact OH-O 2.94Å; L742-Y753 HydrophobicContact CB-CE2 4.46Å; L743-Y753 HydrophobicContact CD2-CD2 4.17Å; L743-Y753 HydrophobicContact CD2-CE2 3.53Å; L743-Y753 HydrophobicContact CG-CD2 4.48Å; L743-Y753 HydrophobicContact CG-CE2 4.04Å; Y753-A788 HydrophobicContact CD1-CB 4.13Å; Y753-A788 HydrophobicContact CG-CB 4.49Å; Y753-I789 WeakPolarHBondContact CA-O 3.43Å; Y753-Y790 HydrophobicContact CD1-CD2 4.41Å; Y753-Y790 AromaticContact CE1-CD2 3.96Å; Y753-Y790 HydrophobicContact CE1-CD2 3.96Å; Y753-Y790 HydrophobicContact CE1-CG 4.2Å; Y753-Y790 HydrophobicContact CE2-CD2 4.44Å; Y753-Y790 AromaticContact CZ-CD2 3.98Å; Y753-I808 HydrophobicContact CD1-CD1 3.59Å; Y753-I808 HydrophobicContact CD2-CD1 4.28Å; Y753-I808 HydrophobicContact CE1-CD1 3.6Å; Y753-I808 HydrophobicContact CE1-CG1 4.47Å; Y753-I808 HydrophobicContact CE2-CD1 4.29Å; Y753-I808 HydrophobicContact CG-CD1 3.93Å
754	F	94.3	Very high	78.9	Confident	12 Å²	12	49.6 Å²	49.6	5%	0.053	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.4	173.6	178.4	-98.4	0	0	0	109.7	G423 T425 V756 A788 I789 C791 W796 P797	G423-F754 VanDerWaalsContact C-CZ 3.44Å; G423-F754 WeakPolarHBondContact O-CZ 3.49Å; T425-F754 HydrophobicContact CG2-CE2 4.42Å; T425-F754 HydrophobicContact CG2-CZ 4.25Å; F754-V756 HydrophobicContact CD1-CG1 3.91Å; F754-V756 HydrophobicContact CE1-CG1 3.91Å; F754-A788 CarbonylContact O-C 3.56Å; F754-A788 WeakPolarHBondContact O-CA 2.95Å; F754-A788 WeakPolarHBondContact O-CB 3.37Å; F754-I789 HydrophobicContact CB-CB 4.43Å; F754-I789 HydrophobicContact CD1-CD1 4.17Å; F754-I789 PolarHBondContact N-O 2.57Å; F754-I789 PolarHBondContact O-N 3.13Å; F754-C791 VanDerWaalsContact CB-SG 3.55Å; F754-W796 AromaticContact CD2-CE3 3.62Å; F754-W796 HydrophobicContact CD2-CE3 3.62Å; F754-W796 AromaticContact CD2-CZ3 3.95Å; F754-W796 HydrophobicContact CD2-CZ3 3.95Å; F754-W796 AromaticContact CE2-CE3 3.49Å; F754-W796 HydrophobicContact CE2-CE3 3.49Å; F754-W796 VanDerWaalsContact CE2-CE3 3.49Å; F754-W796 AromaticContact CE2-CZ3 3.69Å; F754-W796 HydrophobicContact CE2-CZ3 3.69Å; F754-P797 HydrophobicContact CB-CG 4.46Å; F754-P797 HydrophobicContact CD1-CG 3.72Å; F754-P797 HydrophobicContact CE1-CG 4.02Å; F754-P797 HydrophobicContact CG-CG 4.05Å
755	V	95.8	Very high	77.3	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.024	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	133.6	-173.8	176.6	0	0	0	0	110.9	W699 Y711 L786 A788	W699-V755 HydrophobicContact CB-CB 4.03Å; W699-V755 HydrophobicContact CB-CG1 4.28Å; W699-V755 HydrophobicContact CD2-CB 4.28Å; W699-V755 HydrophobicContact CD2-CG1 3.54Å; W699-V755 HydrophobicContact CE3-CG1 4.01Å; W699-V755 HydrophobicContact CG-CB 3.88Å; W699-V755 HydrophobicContact CG-CG1 3.66Å; W699-V755 HydrophobicContact CZ2-CG1 4.38Å; Y711-V755 HydrophobicContact CD1-CB 4.11Å; Y711-V755 HydrophobicContact CD1-CG2 3.38Å; Y711-V755 HydrophobicContact CD2-CG2 3.94Å; Y711-V755 HydrophobicContact CE1-CG2 3.55Å; Y711-V755 HydrophobicContact CE2-CG2 4.05Å; Y711-V755 HydrophobicContact CG-CB 4.45Å; Y711-V755 HydrophobicContact CG-CG2 3.57Å; V755-L786 HydrophobicContact CB-CD1 4.32Å; V755-L786 HydrophobicContact CG1-CD1 3.51Å; V755-L786 HydrophobicContact CG1-CG 4.42Å; V755-L786 HydrophobicContact CG2-CD1 3.82Å; V755-L786 HydrophobicContact CG2-CD2 3.82Å; V755-L786 HydrophobicContact CG2-CG 4.15Å; V755-A788 HydrophobicContact CG2-CB 4.3Å
756	V	94.3	Very high	75.9	Confident	7 Å²	7	41.1 Å²	41.1	4%	0.042	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	-23.4	177.4	-63.7	0	0	0	0	112.8	W436 F754 Q787 I789 V805	W436-V756 HydrophobicContact CB-CG1 4.11Å; W436-V756 HydrophobicContact CD2-CG1 4.02Å; W436-V756 HydrophobicContact CG-CB 4.07Å; W436-V756 HydrophobicContact CG-CG1 3.64Å; F754-V756 HydrophobicContact CD1-CG1 3.91Å; F754-V756 HydrophobicContact CE1-CG1 3.91Å; V756-Q787 HydrophobicContact CG2-CB 3.81Å; V756-Q787 VanDerWaalsContact CG2-O 3.26Å; V756-Q787 WeakPolarHBondContact CG2-O 3.28Å; V756-Q787 PolarHBondContact N-O 3.27Å; V756-I789 HydrophobicContact CG1-CD1 3.95Å; V756-I789 HydrophobicContact CG1-CG1 4.37Å; V756-V805 HydrophobicContact CG2-CG1 3.95Å; V756-V805 HydrophobicContact CG2-CG2 4.44Å
757	G	93.6	Very high	74.6	Confident	3 Å²	3	42.7 Å²	42.7	3%	0.031	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.7	172.4	179.7	0	0	0	0	0	113.4	Q787	G757-Q787 PolarHBondContact N-O 3.46Å; G757-Q787 WeakPolarHBondContact O-CA 3.35Å; G757-Q787 WeakPolarHBondContact O-CB 3.33Å; G757-Q787 PolarHBondContact O-N 3.45Å
758	V	93.3	Very high	72.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	114.6	-177.6	170.1	0	0	0	0	110.3	R438 W699 S703 F709 L786 F810	R438-V758 PolarHBondContact NH2-O 3.26Å; W699-V758 HydrophobicContact CH2-CB 4.26Å; W699-V758 HydrophobicContact CH2-CG2 3.56Å; W699-V758 HydrophobicContact CZ2-CG2 4.33Å; W699-V758 HydrophobicContact CZ3-CG2 3.83Å; S703-V758 WeakPolarHBondContact CA-O 3.27Å; S703-V758 VanDerWaalsContact CB-O 3.27Å; S703-V758 WeakPolarHBondContact CB-O 3.38Å; F709-V758 HydrophobicContact CB-CG2 4.17Å; F709-V758 HydrophobicContact CD1-CG1 4.02Å; F709-V758 HydrophobicContact CD1-CG2 4.5Å; F709-V758 HydrophobicContact CD2-CB 4.33Å; F709-V758 HydrophobicContact CD2-CG1 3.77Å; F709-V758 HydrophobicContact CE1-CG1 3.94Å; F709-V758 HydrophobicContact CE2-CG1 3.73Å; F709-V758 HydrophobicContact CG-CB 4.4Å; F709-V758 HydrophobicContact CG-CG1 3.93Å; F709-V758 HydrophobicContact CG-CG2 4.19Å; F709-V758 HydrophobicContact CZ-CG1 3.79Å; V758-L786 HydrophobicContact CG2-CD1 3.73Å; V758-F810 HydrophobicContact CG1-CE1 4.41Å; V758-F810 HydrophobicContact CG1-CE2 4.38Å; V758-F810 HydrophobicContact CG1-CZ 3.55Å
759	L	88.6	Confident	71.2	Confident	24 Å²	24	43.9 Å²	43.9	13%	0.126	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.7	178.3	-70	160.7	0	0	0	111.4	R438 D704 G784 Q785 Q787	R438-L759 VanDerWaalsContact NH2-CD2 3.32Å; D704-L759 VanDerWaalsContact OD1-CA 3.29Å; D704-L759 WeakPolarHBondContact OD1-CA 3.46Å; L759-G784 CarbonylContact O-C 3.57Å; L759-G784 WeakPolarHBondContact O-CA 3.43Å; L759-Q785 HydrophobicContact CB-CG 3.77Å; L759-Q785 HydrophobicContact CD1-CG 4.09Å; L759-Q785 PolarHBondContact N-O 3.27Å; L759-Q785 PolarHBondContact O-N 3.43Å; L759-Q787 VanDerWaalsContact CD1-CD 3.43Å; L759-Q787 HydrophobicContact CD1-CG 3.73Å; L759-Q787 HydrophobicContact CG-CG 4.16Å
760	E	81	Confident	69.9	Low	24 Å²	24	42.8 Å²	42.8	11%	0.112	23%	0.231	C	C	.	.			trans	-100.9	-17.8	173.8	-78.3	-173.9	135.6	0	0	112.5	S703 D704 T705 G707 F709 R719 Y762	S703-E760 WeakPolarHBondContact CB-OE2 3.42Å; S703-E760 PolarHBondContact OG-OE2 3.47Å; D704-E760 PolarHBondContact OD1-N 3.43Å; T705-E760 HydrophobicContact CG2-CB 4.48Å; T705-E760 WeakPolarHBondContact OG1-CB 3.15Å; T705-E760 PolarHBondContact OG1-OE2 3.1Å; G707-E760 PolarHBondContact N-OE2 2.75Å; F709-E760 HydrophobicContact CE2-CG 4.05Å; F709-E760 WeakPolarHBondContact CE2-OE1 3.35Å; F709-E760 HydrophobicContact CZ-CG 3.87Å; F709-E760 WeakPolarHBondContact CZ-OE1 3.4Å; R719-E760 IonicContact CZ-OE1 3.85Å; R719-E760 IonicContact NE-OE1 2.98Å; R719-E760 PolarHBondContact NE-OE1 2.89Å; R719-E760 IonicContact NH2-OE1 3.71Å; R719-E760 PolarHBondContact NH2-OE1 3.39Å; E760-Y762 PolarHBondContact O-N 2.91Å
761	S	67.4	Low	68.4	Low	40 Å²	40	50.9 Å²	50.9	28%	0.28	27%	0.267	S	S	.	.			trans	-59.3	124.9	-176.8	-67	0	0	0	0	113.2	D704 S764	D704-S761 WeakPolarHBondContact OD2-CB 3.21Å; D704-S761 PolarHBondContact OD2-N 2.81Å; D704-S761 PolarHBondContact OD2-OG 3.09Å; S761-S764 WeakPolarHBondContact CB-OG 3.41Å; S761-S764 PolarHBondContact O-OG 3.35Å
762	Y	56.2	Low	66	Low	46 Å²	46	56.4 Å²	56.4	18%	0.18	30%	0.297	C	S	.	.	H	α-helix	trans	-68.7	-38.3	-174.4	-136.8	-76.1	0	0	0	113.2	E760 S764 V765 E766 V781 G782 K865	E760-Y762 PolarHBondContact O-N 2.91Å; Y762-S764 VanDerWaalsContact C-N 3.32Å; Y762-S764 PolarHBondContact O-N 3.48Å; Y762-V765 PolarHBondContact O-N 2.99Å; Y762-V765 VanDerWaalsContact O-N 3.15Å; Y762-E766 PolarHBondContact O-N 3.41Å; Y762-V781 WeakPolarHBondContact OH-CG1 3.27Å; Y762-G782 WeakPolarHBondContact CE1-O 3.38Å; Y762-G782 VanDerWaalsContact CE2-O 3.26Å; Y762-G782 WeakPolarHBondContact CE2-O 3.27Å; Y762-K865 PolarHBondContact OH-NZ 2.71Å; Y762-K865 VanDerWaalsContact OH-NZ 3.16Å
763	E	53	Low	63.4	Low	133 Å²	133	62.2 Å²	62.2	62%	0.621	32%	0.321	S	S	*	.	H	α-helix	trans	-64.2	-35.4	-177.4	-74.5	-174.4	169.2	0	0	112.6	V765 E766 N767	E763-V765 PolarHBondContact O-N 3.02Å; E763-E766 PolarHBondContact O-N 3.35Å; E763-N767 WeakPolarHBondContact O-CB 3.25Å; E763-N767 VanDerWaalsContact O-CG 3.28Å; E763-N767 PolarHBondContact O-N 2.92Å; E763-N767 PolarHBondContact O-ND2 2.91Å
764	S	48.9	Very low	60.8	Low	31 Å²	31	67.9 Å²	67.9	22%	0.217	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-33.3	175.8	14	0	0	0	0	112.4	S761 Y762 L768	S761-S764 WeakPolarHBondContact CB-OG 3.41Å; S761-S764 PolarHBondContact O-OG 3.35Å; Y762-S764 VanDerWaalsContact C-N 3.32Å; Y762-S764 PolarHBondContact O-N 3.48Å; S764-L768 VanDerWaalsContact O-CD1 3.3Å; S764-L768 WeakPolarHBondContact O-CD1 3.39Å; S764-L768 PolarHBondContact O-N 3.45Å
765	V	48.2	Very low	58.2	Low	36 Å²	36	74.4 Å²	74.4	22%	0.218	39%	0.389	C	S	.	.	H	α-helix	trans	-75.4	-40.4	179.9	-171.7	0	0	0	0	111.1	Y762 E763 S769	Y762-V765 PolarHBondContact O-N 2.99Å; Y762-V765 VanDerWaalsContact O-N 3.15Å; E763-V765 PolarHBondContact O-N 3.02Å; V765-S769 PolarHBondContact O-N 3.44Å
766	E	47	Very low	55.3	Low	108 Å²	108	79.3 Å²	79.3	51%	0.505	41%	0.414	S	S	.	.	H	α-helix	trans	-68.2	-40.3	176.2	-76.2	-172.8	-175.6	0	0	111.8	Y762 E763 L768 S769 K865	Y762-E766 PolarHBondContact O-N 3.41Å; E763-E766 PolarHBondContact O-N 3.35Å; E766-L768 PolarHBondContact O-N 3.13Å; E766-S769 PolarHBondContact O-N 3.3Å; E766-S769 VanDerWaalsContact O-N 3.14Å; E766-S769 PolarHBondContact O-OG 3.47Å; E766-K865 IonicContact OE1-NZ 2.81Å
767	N	42.6	Very low	52.9	Low	114 Å²	114	84.9 Å²	84.9	61%	0.61	44%	0.438	S	S	*	.	H	α-helix	trans	-65.3	-40.1	-177.4	-73.5	-21.4	0	0	0	112.8	E763 S769 S770	E763-N767 WeakPolarHBondContact O-CB 3.25Å; E763-N767 VanDerWaalsContact O-CG 3.28Å; E763-N767 PolarHBondContact O-N 2.92Å; E763-N767 PolarHBondContact O-ND2 2.91Å; N767-S769 VanDerWaalsContact C-N 3.31Å; N767-S769 PolarHBondContact O-N 3.36Å; N767-S770 WeakPolarHBondContact O-CB 3.3Å; N767-S770 PolarHBondContact O-N 3.35Å; N767-S770 PolarHBondContact O-OG 3Å
768	L	41.6	Very low	50.6	Low	115 Å²	115	90.4 Å²	90.4	60%	0.602	48%	0.476	S	S	*	.	H	α-helix	trans	-70.2	-25.3	174.2	-90.4	112.5	0	0	0	113.3	S764 E766 S770	S764-L768 VanDerWaalsContact O-CD1 3.3Å; S764-L768 WeakPolarHBondContact O-CD1 3.39Å; S764-L768 PolarHBondContact O-N 3.45Å; E766-L768 PolarHBondContact O-N 3.13Å; L768-S770 PolarHBondContact O-N 2.87Å
769	S	40.1	Very low	48.4	Very low	41 Å²	41	93.4 Å²	93.4	29%	0.287	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-3.9	178.1	76.2	0	0	0	0	114.2	V765 E766 N767 E771 N772 K773	V765-S769 PolarHBondContact O-N 3.44Å; E766-S769 PolarHBondContact O-N 3.3Å; E766-S769 VanDerWaalsContact O-N 3.14Å; E766-S769 PolarHBondContact O-OG 3.47Å; N767-S769 VanDerWaalsContact C-N 3.31Å; N767-S769 PolarHBondContact O-N 3.36Å; S769-E771 VanDerWaalsContact C-N 3.32Å; S769-E771 PolarHBondContact O-N 3.46Å; S769-N772 CarbonylContact O-C 3.6Å; S769-N772 PolarHBondContact O-N 3.28Å; S769-K773 PolarHBondContact O-N 3.07Å
770	S	42.8	Very low	46.6	Very low	72 Å²	72	96.1 Å²	96.1	50%	0.503	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-28.9	-177	-66.3	0	0	0	0	113.9	N767 L768	N767-S770 WeakPolarHBondContact O-CB 3.3Å; N767-S770 PolarHBondContact O-N 3.35Å; N767-S770 PolarHBondContact O-OG 3Å; L768-S770 PolarHBondContact O-N 2.87Å
771	E	39.3	Very low	45.2	Very low	189 Å²	189	95.6 Å²	95.6	88%	0.883	51%	0.508	S	S	*	.	S	Bend	trans	-79.2	-25.9	176.3	-68.3	-150	147.9	0	0	113.1	S769	S769-E771 VanDerWaalsContact C-N 3.32Å; S769-E771 PolarHBondContact O-N 3.46Å
772	N	35.8	Very low	44.7	Very low	116 Å²	116	94.4 Å²	94.4	62%	0.62	50%	0.502	S	S	*	.			trans	-119.3	38.1	-174.8	-84.4	-7.4	0	0	0	113.8	S769 N774	S769-N772 CarbonylContact O-C 3.6Å; S769-N772 PolarHBondContact O-N 3.28Å; N772-N774 PolarHBondContact O-N 3.42Å
773	K	34	Very low	45.5	Very low	155 Å²	155	92.6 Å²	92.6	67%	0.674	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-16.8	176.9	-93.7	-176.5	177	173.5	0	115.1	S769	S769-K773 PolarHBondContact O-N 3.07Å
774	N	39.9	Very low	46.9	Very low	156 Å²	156	86.3 Å²	86.3	83%	0.834	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-27	-172.4	-72.1	-9.5	0	0	0	114.4	N772	N772-N774 PolarHBondContact O-N 3.42Å
775	D	38.7	Very low	48.8	Very low	148 Å²	148	85.5 Å²	85.5	79%	0.791	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-20.9	-172.7	-71	-22.4	0	0	0	114.4	K777	D775-K777 PolarHBondContact O-N 3.1Å
776	L	35.5	Very low	51	Low	108 Å²	108	83.8 Å²	83.8	57%	0.565	45%	0.448	S	S	*	.	S	Bend	trans	-83.9	106.9	173.9	-159.2	62.8	0	0	0	108.6	S778 V780	L776-S778 PolarHBondContact O-N 3.42Å; L776-V780 HydrophobicContact CD1-CG2 4.26Å
777	K	42.7	Very low	53.2	Low	124 Å²	124	80.6 Å²	80.6	54%	0.539	43%	0.433	S	S	.	.			trans	-37.4	121.6	168	-69.5	-179.8	-178.3	178.6	0	106.8	D775 N779 V780	D775-K777 PolarHBondContact O-N 3.1Å; K777-N779 HydrophobicContact CB-CB 4.41Å; K777-N779 PolarHBondContact O-N 3.08Å; K777-V780 PolarHBondContact O-N 3.39Å
778	S	45.8	Very low	55.7	Low	119 Å²	119	75.1 Å²	75.1	83%	0.832	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	9.7	179.9	66.9	0	0	0	0	114.9	L776	L776-S778 PolarHBondContact O-N 3.42Å
779	N	47.9	Very low	58.2	Low	63 Å²	63	70 Å²	70	34%	0.337	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-12.3	-169.4	-60.3	-26.3	0	0	0	112.8	K777 V781 N827 R872	K777-N779 HydrophobicContact CB-CB 4.41Å; K777-N779 PolarHBondContact O-N 3.08Å; N779-V781 PolarHBondContact O-N 2.81Å; N779-N827 PolarHBondContact O-ND2 3.28Å; N779-N827 PolarHBondContact O-OD1 2.95Å; N779-R872 VanDerWaalsContact CG-NH1 3.31Å; N779-R872 PolarHBondContact OD1-NH1 3.19Å
780	V	50.8	Low	60.7	Low	81 Å²	81	71.8 Å²	71.8	49%	0.491	38%	0.378	S	S	.	.			trans	-80.5	109.1	-179.6	-175.1	0	0	0	0	109	L776 K777 G782	L776-V780 HydrophobicContact CD1-CG2 4.26Å; K777-V780 PolarHBondContact O-N 3.39Å; V780-G782 PolarHBondContact O-N 2.88Å
781	V	51.7	Low	62.9	Low	12 Å²	12	68.6 Å²	68.6	7%	0.073	36%	0.356	C	S	.	.			trans	-73	92.1	176.3	175.6	0	0	0	0	107.7	Y762 N779 F783 N827 Q830	Y762-V781 WeakPolarHBondContact OH-CG1 3.27Å; N779-V781 PolarHBondContact O-N 2.81Å; V781-F783 PolarHBondContact O-N 2.85Å; V781-N827 WeakPolarHBondContact CB-OD1 3.43Å; V781-N827 HydrophobicContact CG2-CB 4.03Å; V781-N827 WeakPolarHBondContact CG2-OD1 3.26Å; V781-N827 PolarHBondContact N-OD1 2.84Å; V781-Q830 HydrophobicContact CG1-CB 4.38Å; V781-Q830 PolarHBondContact O-OE1 3.16Å
782	G	56.9	Low	64.9	Low	15 Å²	15	66.2 Å²	66.2	16%	0.155	34%	0.342	C	S	.	.			trans	-66.1	106.3	168.4	0	0	0	0	0	110	Y762 V780	Y762-G782 WeakPolarHBondContact CE1-O 3.38Å; Y762-G782 VanDerWaalsContact CE2-O 3.26Å; Y762-G782 WeakPolarHBondContact CE2-O 3.27Å; V780-G782 PolarHBondContact O-N 2.88Å
783	F	71.5	Confident	66.7	Low	8 Å²	8	61.3 Å²	61.3	4%	0.035	32%	0.318	C	S	.	.			trans	-102.1	9.4	175.8	74	-78.8	0	0	0	113.3	I736 V781 F810 L812 Q830 I833	I736-F783 HydrophobicContact CB-CZ 4.37Å; I736-F783 HydrophobicContact CG2-CE2 4.5Å; V781-F783 PolarHBondContact O-N 2.85Å; F783-F810 HydrophobicContact CD1-CB 4.19Å; F783-F810 AromaticContact CD2-CD2 3.89Å; F783-F810 HydrophobicContact CD2-CD2 3.89Å; F783-F810 HydrophobicContact CE1-CB 3.41Å; F783-F810 VanDerWaalsContact CE1-CB 3.41Å; F783-F810 HydrophobicContact CE1-CD2 4.33Å; F783-F810 HydrophobicContact CE1-CG 4.4Å; F783-F810 HydrophobicContact CE2-CB 4.03Å; F783-F810 AromaticContact CE2-CD2 3.55Å; F783-F810 HydrophobicContact CE2-CD2 3.55Å; F783-F810 HydrophobicContact CE2-CE2 4.35Å; F783-F810 HydrophobicContact CE2-CG 4.21Å; F783-F810 HydrophobicContact CG-CD2 4.45Å; F783-F810 HydrophobicContact CZ-CB 3.35Å; F783-F810 AromaticContact CZ-CD2 3.81Å; F783-F810 HydrophobicContact CZ-CD2 3.81Å; F783-F810 HydrophobicContact CZ-CG 4Å; F783-L812 HydrophobicContact CZ-CD2 3.94Å; F783-Q830 HydrophobicContact CD1-CB 3.53Å; F783-Q830 HydrophobicContact CD1-CG 3.45Å; F783-Q830 VanDerWaalsContact CD1-CG 3.45Å; F783-Q830 HydrophobicContact CE1-CB 3.89Å; F783-Q830 VanDerWaalsContact CE1-CD 3.47Å; F783-Q830 HydrophobicContact CE1-CG 3.3Å; F783-Q830 HydrophobicContact CG-CB 4.13Å; F783-Q830 HydrophobicContact CG-CG 4.45Å; F783-Q830 HydrophobicContact CZ-CG 4.17Å; F783-I833 HydrophobicContact CD2-CG2 4.41Å; F783-I833 HydrophobicContact CE2-CG2 4.14Å
784	G	82.8	Confident	68.8	Low	1 Å²	1	54.8 Å²	54.8	1%	0.01	29%	0.292	C	S	.	.			trans	149.3	173.2	178.6	0	0	0	0	0	111.9	L759 F810	L759-G784 CarbonylContact O-C 3.57Å; L759-G784 WeakPolarHBondContact O-CA 3.43Å; G784-F810 PolarHBondContact O-N 3.22Å; G784-F810 VanDerWaalsContact O-N 3.1Å
785	Q	90.2	Very high	70.7	Confident	14 Å²	14	51.9 Å²	51.9	7%	0.065	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	140.4	-178.7	58.8	-168.8	-9.5	0	0	110.7	L759 N807 I808	L759-Q785 HydrophobicContact CB-CG 3.77Å; L759-Q785 HydrophobicContact CD1-CG 4.09Å; L759-Q785 PolarHBondContact N-O 3.27Å; L759-Q785 PolarHBondContact O-N 3.43Å; Q785-N807 HydrophobicContact CG-CB 4.48Å; Q785-I808 CarbonylContact C-O 3.58Å; Q785-I808 WeakPolarHBondContact CA-O 3.49Å; Q785-I808 WeakPolarHBondContact CB-O 3.24Å
786	L	93.5	Very high	73	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	129.6	169.9	-179.8	73.8	0	0	0	108.9	V717 T739 V755 V758 A788 I808 F810	V717-L786 HydrophobicContact CG2-CD1 4.13Å; V717-L786 HydrophobicContact CG2-CD2 3.75Å; V717-L786 HydrophobicContact CG2-CG 4.46Å; T739-L786 HydrophobicContact CG2-CD2 3.53Å; V755-L786 HydrophobicContact CB-CD1 4.32Å; V755-L786 HydrophobicContact CG1-CD1 3.51Å; V755-L786 HydrophobicContact CG1-CG 4.42Å; V755-L786 HydrophobicContact CG2-CD1 3.82Å; V755-L786 HydrophobicContact CG2-CD2 3.82Å; V755-L786 HydrophobicContact CG2-CG 4.15Å; V758-L786 HydrophobicContact CG2-CD1 3.73Å; L786-A788 HydrophobicContact CD2-CB 4.13Å; L786-A788 HydrophobicContact CG-CB 4.24Å; L786-I808 HydrophobicContact CB-CB 4.22Å; L786-I808 HydrophobicContact CD2-CD1 4.31Å; L786-I808 PolarHBondContact N-O 3.14Å; L786-I808 PolarHBondContact O-N 2.62Å; L786-F810 HydrophobicContact CB-CE1 4.04Å
787	Q	94	Very high	75.6	Confident	41 Å²	41	44 Å²	44	19%	0.192	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115	168.8	-57.4	-168.6	-69.8	0	0	108.4	V756 G757 L759 V805 S806	V756-Q787 HydrophobicContact CG2-CB 3.81Å; V756-Q787 VanDerWaalsContact CG2-O 3.26Å; V756-Q787 WeakPolarHBondContact CG2-O 3.28Å; V756-Q787 PolarHBondContact N-O 3.27Å; G757-Q787 PolarHBondContact N-O 3.46Å; G757-Q787 WeakPolarHBondContact O-CA 3.35Å; G757-Q787 WeakPolarHBondContact O-CB 3.33Å; G757-Q787 PolarHBondContact O-N 3.45Å; L759-Q787 VanDerWaalsContact CD1-CD 3.43Å; L759-Q787 HydrophobicContact CD1-CG 3.73Å; L759-Q787 HydrophobicContact CG-CG 4.16Å; Q787-V805 HydrophobicContact CB-CG1 3.96Å; Q787-S806 WeakPolarHBondContact CA-O 3.31Å
788	A	94.6	Very high	77.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	150.9	-177.6	0	0	0	0	0	112	Y753 F754 V755 L786 S806 I808	Y753-A788 HydrophobicContact CD1-CB 4.13Å; Y753-A788 HydrophobicContact CG-CB 4.49Å; F754-A788 CarbonylContact O-C 3.56Å; F754-A788 WeakPolarHBondContact O-CA 2.95Å; F754-A788 WeakPolarHBondContact O-CB 3.37Å; V755-A788 HydrophobicContact CG2-CB 4.3Å; L786-A788 HydrophobicContact CD2-CB 4.13Å; L786-A788 HydrophobicContact CG-CB 4.24Å; A788-S806 PolarHBondContact N-O 2.74Å; A788-S806 WeakPolarHBondContact O-CA 3.38Å; A788-S806 WeakPolarHBondContact O-CB 3.31Å; A788-S806 PolarHBondContact O-N 2.76Å; A788-S806 PolarHBondContact O-OG 3.49Å; A788-I808 HydrophobicContact CB-CD1 4.04Å
789	I	94.5	Very high	79.3	Confident	6 Å²	6	39.6 Å²	39.6	3%	0.031	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.9	174.1	-62.3	163.2	0	0	0	108.2	W436 Y753 F754 V756 C791 P797 P803 V805	W436-I789 HydrophobicContact CD2-CD1 4.39Å; W436-I789 HydrophobicContact CE3-CD1 4.14Å; W436-I789 HydrophobicContact CH2-CD1 4.03Å; W436-I789 HydrophobicContact CZ2-CD1 4.29Å; W436-I789 HydrophobicContact CZ3-CD1 3.95Å; Y753-I789 WeakPolarHBondContact CA-O 3.43Å; F754-I789 HydrophobicContact CB-CB 4.43Å; F754-I789 HydrophobicContact CD1-CD1 4.17Å; F754-I789 PolarHBondContact N-O 2.57Å; F754-I789 PolarHBondContact O-N 3.13Å; V756-I789 HydrophobicContact CG1-CD1 3.95Å; V756-I789 HydrophobicContact CG1-CG1 4.37Å; I789-C791 PolarHBondContact O-N 3.03Å; I789-P797 HydrophobicContact CB-CB 4.4Å; I789-P797 HydrophobicContact CD1-CB 4.19Å; I789-P797 HydrophobicContact CD1-CG 4.06Å; I789-P797 HydrophobicContact CG2-CB 3.77Å; I789-P803 HydrophobicContact CD1-CB 3.63Å; I789-P803 HydrophobicContact CD1-CG 4.24Å; I789-P803 HydrophobicContact CG1-CB 4.03Å; I789-P803 HydrophobicContact CG2-CB 3.77Å; I789-V805 HydrophobicContact CG1-CG2 4.11Å
790	Y	91.7	Very high	80.8	Confident	80 Å²	80	42.4 Å²	42.4	31%	0.314	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	112.4	174.4	176	-129.8	0	0	0	110.4	L743 D751 Y753 K792	L743-Y790 HydrophobicContact CD2-CD2 4.08Å; L743-Y790 HydrophobicContact CD2-CE2 3.51Å; D751-Y790 HydrophobicContact CB-CE2 3.8Å; D751-Y790 PolarHBondContact OD2-OH 2.95Å; Y753-Y790 HydrophobicContact CD1-CD2 4.41Å; Y753-Y790 AromaticContact CE1-CD2 3.96Å; Y753-Y790 HydrophobicContact CE1-CD2 3.96Å; Y753-Y790 HydrophobicContact CE1-CG 4.2Å; Y753-Y790 HydrophobicContact CE2-CD2 4.44Å; Y753-Y790 AromaticContact CZ-CD2 3.98Å; Y790-K792 HydrophobicContact CD1-CG 3.96Å; Y790-K792 HydrophobicContact CE1-CD 4.02Å; Y790-K792 HydrophobicContact CE1-CG 3.41Å; Y790-K792 VanDerWaalsContact CE1-CG 3.41Å
791	C	88.4	Confident	82.4	Confident	4 Å²	4	44.1 Å²	44.1	3%	0.027	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	104.9	-179.6	-62.6	0	0	0	0	109.6	D751 N752 F754 I789 S794 W796 P797	D751-C791 WeakPolarHBondContact CA-O 3.5Å; N752-C791 PolarHBondContact N-O 3.21Å; N752-C791 WeakPolarHBondContact O-CA 3.16Å; N752-C791 WeakPolarHBondContact O-CB 3.36Å; N752-C791 PolarHBondContact O-N 3.26Å; F754-C791 VanDerWaalsContact CB-SG 3.55Å; I789-C791 PolarHBondContact O-N 3.03Å; C791-S794 VanDerWaalsContact CB-O 3.26Å; C791-S794 WeakPolarHBondContact CB-O 3.26Å; C791-W796 VanDerWaalsContact SG-C 3.53Å; C791-P797 VanDerWaalsContact SG-N 3.44Å
792	K	82.9	Confident	84	Confident	139 Å²	139	49.1 Å²	49.1	60%	0.604	23%	0.229	S	C	*	.	S	Bend	trans	-77.1	126.1	174.9	-68.5	178.7	179.4	175.7	0	110	T93 D751 Y790 S794	T93-K792 WeakPolarHBondContact CG2-O 3.25Å; D751-K792 WeakPolarHBondContact OD1-CA 3.38Å; Y790-K792 HydrophobicContact CD1-CG 3.96Å; Y790-K792 HydrophobicContact CE1-CD 4.02Å; Y790-K792 HydrophobicContact CE1-CG 3.41Å; Y790-K792 VanDerWaalsContact CE1-CG 3.41Å; K792-S794 PolarHBondContact O-N 2.89Å
793	A	73.7	Confident	85.6	Confident	14 Å²	14	49.1 Å²	49.1	12%	0.116	23%	0.226	C	C	.	.	S	Bend	trans	56.4	4.2	-178.2	0	0	0	0	0	115.7	R91 T93 T750 D751	R91-A793 HydrophobicContact CG-CB 3.97Å; T93-A793 HydrophobicContact CG2-CB 3.71Å; T93-A793 WeakPolarHBondContact CG2-O 3.5Å; T750-A793 CarbonylContact O-C 3.46Å; T750-A793 WeakPolarHBondContact O-CA 3.42Å; D751-A793 PolarHBondContact OD1-N 3.37Å
794	S	77.1	Confident	86.5	Confident	18 Å²	18	54.7 Å²	54.7	13%	0.126	26%	0.26	C	S	.	.	S	Bend	trans	-124.4	160.9	-173.9	-154.3	0	0	0	0	111.8	T93 T750 C791 K792 W796	T93-S794 PolarHBondContact OG1-OG 3.35Å; T750-S794 PolarHBondContact O-N 2.85Å; C791-S794 VanDerWaalsContact CB-O 3.26Å; C791-S794 WeakPolarHBondContact CB-O 3.26Å; K792-S794 PolarHBondContact O-N 2.89Å; S794-W796 VanDerWaalsContact CB-O 3.23Å; S794-W796 WeakPolarHBondContact CB-O 3.42Å; S794-W796 PolarHBondContact OG-N 2.82Å; S794-W796 VanDerWaalsContact OG-N 3.14Å; S794-W796 PolarHBondContact OG-O 3.37Å; S794-W796 VanDerWaalsContact OG-O 3.06Å
795	K	79.6	Confident	86.9	Confident	95 Å²	95	56.8 Å²	56.8	41%	0.413	27%	0.273	S	S	.	.	S	Bend	trans	-84.1	-22.5	161.9	-67.2	178	-178.8	168.6	0	111.9	N134	N134-K795 PolarHBondContact ND2-NZ 3.03Å
796	W	87.3	Confident	86.9	Confident	76 Å²	76	58 Å²	58	29%	0.288	28%	0.283	S	S	.	.	S	Bend	trans	-128.6	143.9	-167.6	-45.4	111.8	0	0	0	111.2	T425 P426 F754 C791 S794	T425-W796 HydrophobicContact CG2-CB 3.98Å; T425-W796 HydrophobicContact CG2-CE3 4.49Å; P426-W796 VanDerWaalsContact CD-CD2 3.43Å; P426-W796 VanDerWaalsContact CD-CE2 3.42Å; P426-W796 HydrophobicContact CG-CD2 3.94Å; P426-W796 HydrophobicContact CG-CG 4.34Å; P426-W796 HydrophobicContact CG-CH2 4.25Å; P426-W796 HydrophobicContact CG-CZ2 3.52Å; F754-W796 AromaticContact CD2-CE3 3.62Å; F754-W796 HydrophobicContact CD2-CE3 3.62Å; F754-W796 AromaticContact CD2-CZ3 3.95Å; F754-W796 HydrophobicContact CD2-CZ3 3.95Å; F754-W796 AromaticContact CE2-CE3 3.49Å; F754-W796 HydrophobicContact CE2-CE3 3.49Å; F754-W796 VanDerWaalsContact CE2-CE3 3.49Å; F754-W796 AromaticContact CE2-CZ3 3.69Å; F754-W796 HydrophobicContact CE2-CZ3 3.69Å; C791-W796 VanDerWaalsContact SG-C 3.53Å; S794-W796 VanDerWaalsContact CB-O 3.23Å; S794-W796 WeakPolarHBondContact CB-O 3.42Å; S794-W796 PolarHBondContact OG-N 2.82Å; S794-W796 VanDerWaalsContact OG-N 3.14Å; S794-W796 PolarHBondContact OG-O 3.37Å; S794-W796 VanDerWaalsContact OG-O 3.06Å
797	P	89.2	Confident	86.8	Confident	15 Å²	15	60.8 Å²	60.8	10%	0.097	30%	0.298	C	S	.	.			trans	-74	147.2	176	31.4	-35.3	0	0	0	111.1	T425 F433 F754 I789 C791 P803	T425-P797 HydrophobicContact CG2-CG 4.36Å; F433-P797 HydrophobicContact CD2-CG 4.08Å; F433-P797 HydrophobicContact CE2-CB 4.4Å; F433-P797 HydrophobicContact CE2-CG 3.89Å; F754-P797 HydrophobicContact CB-CG 4.46Å; F754-P797 HydrophobicContact CD1-CG 3.72Å; F754-P797 HydrophobicContact CE1-CG 4.02Å; F754-P797 HydrophobicContact CG-CG 4.05Å; I789-P797 HydrophobicContact CB-CB 4.4Å; I789-P797 HydrophobicContact CD1-CB 4.19Å; I789-P797 HydrophobicContact CD1-CG 4.06Å; I789-P797 HydrophobicContact CG2-CB 3.77Å; C791-P797 VanDerWaalsContact SG-N 3.44Å; P797-P803 HydrophobicContact CB-CB 4.38Å; P797-P803 HydrophobicContact CB-CG 3.97Å
798	R	81.5	Confident	86.6	Confident	136 Å²	136	59.2 Å²	59.2	51%	0.513	29%	0.291	S	S	.	.			trans	-72.9	147.3	167.2	-68.9	-165.1	-179.8	-174.6	3.9	109.9	T93 P803	T93-R798 VanDerWaalsContact C-NH2 3.34Å; T93-R798 PolarHBondContact O-NE 3.12Å; T93-R798 PolarHBondContact O-NH2 3.34Å; R798-P803 WeakPolarHBondContact O-CG 3.36Å
799	V	85.2	Confident	86.2	Confident	13 Å²	13	63.3 Å²	63.3	8%	0.079	32%	0.317	C	S	.	.	S	Bend	trans	-69.3	-38.6	174.1	179.1	0	0	0	0	111.3	E431 F433 T443 F445 P801	E431-V799 HydrophobicContact CB-CB 4.1Å; E431-V799 HydrophobicContact CB-CG1 4.41Å; E431-V799 HydrophobicContact CB-CG2 3.95Å; E431-V799 HydrophobicContact CG-CB 3.71Å; E431-V799 HydrophobicContact CG-CG1 4.4Å; E431-V799 HydrophobicContact CG-CG2 3.87Å; E431-V799 WeakPolarHBondContact O-CG2 3.06Å; F433-V799 HydrophobicContact CD2-CG2 4.45Å; F433-V799 HydrophobicContact CE1-CG1 4.31Å; F433-V799 HydrophobicContact CE1-CG2 4.19Å; F433-V799 HydrophobicContact CE2-CG2 4.04Å; F433-V799 HydrophobicContact CZ-CB 4.18Å; F433-V799 HydrophobicContact CZ-CG1 4.3Å; F433-V799 HydrophobicContact CZ-CG2 3.9Å; T443-V799 HydrophobicContact CG2-CG1 4.09Å; F445-V799 HydrophobicContact CE1-CG1 4.35Å; V799-P801 CarbonylContact O-C 3.53Å
800	F	79	Confident	85.9	Confident	122 Å²	122	63.5 Å²	63.5	54%	0.535	32%	0.318	S	S	.	.	S	Bend	trans	-119.4	135.8	179.3	-64.6	-69.2	0	0	0	113.1	E431 F445	E431-F800 HydrophobicContact CG-CD2 4.36Å; F445-F800 AromaticContact CE1-CE2 3.72Å; F445-F800 HydrophobicContact CE1-CE2 3.72Å; F445-F800 HydrophobicContact CE1-CZ 4.04Å; F445-F800 HydrophobicContact CZ-CE2 4.33Å; F445-F800 HydrophobicContact CZ-CZ 4.19Å
801	P	84.8	Confident	85.7	Confident	118 Å²	118	65.3 Å²	65.3	77%	0.766	32%	0.324	S	S	*	.	S	Bend	cis	-64.9	160.8	-11	31.2	-36.2	0	0	0	111.5	V799 P803	V799-P801 CarbonylContact O-C 3.53Å; P801-P803 WeakPolarHBondContact O-CD 3.43Å; P801-P803 VanDerWaalsContact O-N 3.16Å
802	R	85.8	Confident	85.7	Confident	117 Å²	117	65.6 Å²	65.6	44%	0.442	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-49.4	122.7	-178.8	-171.6	177.2	-170	-86.9	10	110	E469	E469-R802 IonicContact OE1-CZ 3.81Å; E469-R802 IonicContact OE1-NE 3.24Å; E469-R802 PolarHBondContact OE1-NE 2.88Å; E469-R802 IonicContact OE1-NH2 3.65Å; E469-R802 PolarHBondContact OE1-NH2 3.07Å; E469-R802 IonicContact OE2-NE 3.92Å; E469-R802 PolarHBondContact OE2-NE 3.47Å
803	P	90	Very high	85.6	Confident	14 Å²	14	62 Å²	62	9%	0.091	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-59.6	142.7	-176.9	-29	35.9	0	0	0	113.7	F433 W436 I789 P797 R798 P801	F433-P803 HydrophobicContact CE2-CG 4.16Å; F433-P803 HydrophobicContact CZ-CG 4.01Å; W436-P803 HydrophobicContact CH2-CB 4.15Å; W436-P803 HydrophobicContact CH2-CG 4.32Å; W436-P803 HydrophobicContact CZ3-CB 4.32Å; W436-P803 HydrophobicContact CZ3-CG 4.06Å; I789-P803 HydrophobicContact CD1-CB 3.63Å; I789-P803 HydrophobicContact CD1-CG 4.24Å; I789-P803 HydrophobicContact CG1-CB 4.03Å; I789-P803 HydrophobicContact CG2-CB 3.77Å; P797-P803 HydrophobicContact CB-CB 4.38Å; P797-P803 HydrophobicContact CB-CG 3.97Å; R798-P803 WeakPolarHBondContact O-CG 3.36Å; P801-P803 WeakPolarHBondContact O-CD 3.43Å; P801-P803 VanDerWaalsContact O-N 3.16Å
804	V	91.3	Very high	85.7	Confident	125 Å²	125	64.1 Å²	64.1	76%	0.758	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-87.3	119.7	171.8	-177.4	0	0	0	0	108.7
805	V	91.4	Very high	85.1	Confident	46 Å²	46	69.3 Å²	69.3	28%	0.279	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	126.3	174.6	-177.7	0	0	0	0	108.9	W436 V756 Q787 I789	W436-V805 HydrophobicContact CH2-CG2 4.43Å; W436-V805 HydrophobicContact CZ2-CG2 3.6Å; V756-V805 HydrophobicContact CG2-CG1 3.95Å; V756-V805 HydrophobicContact CG2-CG2 4.44Å; Q787-V805 HydrophobicContact CB-CG1 3.96Å; I789-V805 HydrophobicContact CG1-CG2 4.11Å
806	S	90.4	Very high	84.4	Confident	38 Å²	38	68.9 Å²	68.9	27%	0.266	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	140	173.5	66.2	0	0	0	0	110.6	Q787 A788	Q787-S806 WeakPolarHBondContact CA-O 3.31Å; A788-S806 PolarHBondContact N-O 2.74Å; A788-S806 WeakPolarHBondContact O-CA 3.38Å; A788-S806 WeakPolarHBondContact O-CB 3.31Å; A788-S806 PolarHBondContact O-N 2.76Å; A788-S806 PolarHBondContact O-OG 3.49Å
807	N	89.5	Confident	83.4	Confident	59 Å²	59	67 Å²	67	32%	0.316	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	108.5	173.7	-68.3	-27.3	0	0	0	108.7	Q785	Q785-N807 HydrophobicContact CG-CB 4.48Å
808	I	90	Very high	82.7	Confident	9 Å²	9	73.7 Å²	73.7	5%	0.046	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	112.7	-176.8	-61.3	170.7	0	0	0	108.1	L742 Y753 Q785 L786 A788	L742-I808 HydrophobicContact CD1-CB 4.48Å; L742-I808 HydrophobicContact CD1-CD1 4.4Å; L742-I808 HydrophobicContact CD1-CG2 3.26Å; Y753-I808 HydrophobicContact CD1-CD1 3.59Å; Y753-I808 HydrophobicContact CD2-CD1 4.28Å; Y753-I808 HydrophobicContact CE1-CD1 3.6Å; Y753-I808 HydrophobicContact CE1-CG1 4.47Å; Y753-I808 HydrophobicContact CE2-CD1 4.29Å; Y753-I808 HydrophobicContact CG-CD1 3.93Å; Q785-I808 CarbonylContact C-O 3.58Å; Q785-I808 WeakPolarHBondContact CA-O 3.49Å; Q785-I808 WeakPolarHBondContact CB-O 3.24Å; L786-I808 HydrophobicContact CB-CB 4.22Å; L786-I808 HydrophobicContact CD2-CD1 4.31Å; L786-I808 PolarHBondContact N-O 3.14Å; L786-I808 PolarHBondContact O-N 2.62Å; A788-I808 HydrophobicContact CB-CD1 4.04Å
809	P	87.6	Confident	82.8	Confident	85 Å²	85	70.8 Å²	70.8	55%	0.552	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.5	143.1	177.6	27.6	-34	0	0	0	110.4	R811	P809-R811 PolarHBondContact O-N 3.21Å
810	F	87.9	Confident	82.6	Confident	11 Å²	11	74.8 Å²	74.8	5%	0.048	42%	0.422	C	S	.	.			trans	-64.6	137.1	174.7	-64.4	-30.7	0	0	0	111.5	F709 I736 C737 V758 F783 G784 L786	F709-F810 HydrophobicContact CE1-CE2 4.18Å; F709-F810 AromaticContact CE1-CZ 3.85Å; F709-F810 HydrophobicContact CE1-CZ 3.85Å; F709-F810 HydrophobicContact CZ-CE2 4.35Å; F709-F810 HydrophobicContact CZ-CZ 4.29Å; I736-F810 HydrophobicContact CD1-CD1 3.51Å; I736-F810 HydrophobicContact CD1-CD2 3.78Å; I736-F810 HydrophobicContact CD1-CE1 3.32Å; I736-F810 HydrophobicContact CD1-CE2 3.61Å; I736-F810 HydrophobicContact CD1-CG 3.69Å; I736-F810 HydrophobicContact CD1-CZ 3.32Å; C737-F810 HydrophobicContact CB-CD1 4.21Å; V758-F810 HydrophobicContact CG1-CE1 4.41Å; V758-F810 HydrophobicContact CG1-CE2 4.38Å; V758-F810 HydrophobicContact CG1-CZ 3.55Å; F783-F810 HydrophobicContact CD1-CB 4.19Å; F783-F810 AromaticContact CD2-CD2 3.89Å; F783-F810 HydrophobicContact CD2-CD2 3.89Å; F783-F810 HydrophobicContact CE1-CB 3.41Å; F783-F810 VanDerWaalsContact CE1-CB 3.41Å; F783-F810 HydrophobicContact CE1-CD2 4.33Å; F783-F810 HydrophobicContact CE1-CG 4.4Å; F783-F810 HydrophobicContact CE2-CB 4.03Å; F783-F810 AromaticContact CE2-CD2 3.55Å; F783-F810 HydrophobicContact CE2-CD2 3.55Å; F783-F810 HydrophobicContact CE2-CE2 4.35Å; F783-F810 HydrophobicContact CE2-CG 4.21Å; F783-F810 HydrophobicContact CG-CD2 4.45Å; F783-F810 HydrophobicContact CZ-CB 3.35Å; F783-F810 AromaticContact CZ-CD2 3.81Å; F783-F810 HydrophobicContact CZ-CD2 3.81Å; F783-F810 HydrophobicContact CZ-CG 4Å; G784-F810 PolarHBondContact O-N 3.22Å; G784-F810 VanDerWaalsContact O-N 3.1Å; L786-F810 HydrophobicContact CB-CE1 4.04Å
811	R	86.7	Confident	82.9	Confident	118 Å²	118	73 Å²	73	45%	0.445	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-142.7	114.9	178.1	-166.1	174.6	-170.1	156.6	1.8	108.7	I736 C737 P809 M817 E826	I736-R811 CarbonylContact C-O 3.54Å; I736-R811 CarbonylContact O-C 3.49Å; I736-R811 PolarHBondContact O-N 3.12Å; C737-R811 WeakPolarHBondContact CA-O 3.38Å; P809-R811 PolarHBondContact O-N 3.21Å; R811-M817 HydrophobicContact CG-CE 4.01Å; R811-E826 WeakPolarHBondContact CA-OE1 3.39Å; R811-E826 VanDerWaalsContact CG-OE1 3.27Å; R811-E826 WeakPolarHBondContact CG-OE1 3.42Å; R811-E826 IonicContact NE-OE2 3.94Å
812	L	87.7	Confident	83	Confident	9 Å²	9	67.7 Å²	67.7	5%	0.047	38%	0.382	C	S	.	.			trans	-66.2	128.9	-174	-58.2	179.8	0	0	0	108.8	I736 F783 L814 M817 E826 L829 Q830 I833	I736-L812 HydrophobicContact CB-CD2 4.15Å; I736-L812 HydrophobicContact CG2-CD2 4.08Å; F783-L812 HydrophobicContact CZ-CD2 3.94Å; L812-L814 HydrophobicContact CB-CD1 4.39Å; L812-L814 HydrophobicContact CB-CD2 4.24Å; L812-L814 HydrophobicContact CB-CG 3.93Å; L812-L814 PolarHBondContact O-N 3.17Å; L812-M817 WeakPolarHBondContact O-CE 3.37Å; L812-E826 HydrophobicContact CB-CG 4.08Å; L812-E826 HydrophobicContact CD1-CG 4.09Å; L812-E826 HydrophobicContact CG-CG 4.14Å; L812-E826 PolarHBondContact N-OE1 2.68Å; L812-L829 HydrophobicContact CD1-CB 3.57Å; L812-L829 HydrophobicContact CD1-CD1 4.3Å; L812-Q830 HydrophobicContact CD1-CG 3.86Å; L812-Q830 HydrophobicContact CG-CG 4.04Å; L812-I833 HydrophobicContact CD1-CD1 4.19Å; L812-I833 HydrophobicContact CD2-CD1 3.87Å
813	P	82	Confident	82.9	Confident	63 Å²	63	64.1 Å²	64.1	41%	0.409	37%	0.371	S	S	.	.			trans	-76.8	69.8	179.1	31	-33.7	0	0	0	110.9	P735 D738	P735-P813 HydrophobicContact CB-CG 3.92Å; P735-P813 HydrophobicContact CG-CG 4.25Å; D738-P813 HydrophobicContact CB-CB 4.32Å
814	L	76	Confident	82.7	Confident	59 Å²	59	64.5 Å²	64.5	31%	0.309	37%	0.372	S	S	.	.			trans	-83.1	155.1	178.5	-55.9	174.7	0	0	0	111.6	L812 M817 E826 L829	L812-L814 HydrophobicContact CB-CD1 4.39Å; L812-L814 HydrophobicContact CB-CD2 4.24Å; L812-L814 HydrophobicContact CB-CG 3.93Å; L812-L814 PolarHBondContact O-N 3.17Å; L814-M817 HydrophobicContact CB-CE 4.42Å; L814-M817 HydrophobicContact CB-SD 3.79Å; L814-M817 HydrophobicContact CD1-SD 4.31Å; L814-M817 HydrophobicContact CG-SD 4.38Å; L814-E826 HydrophobicContact CD1-CB 3.77Å; L814-E826 HydrophobicContact CD1-CG 4.02Å; L814-L829 HydrophobicContact CD1-CD1 4.08Å; L814-L829 HydrophobicContact CD2-CD1 3.88Å
815	C	63.2	Low	82.6	Confident	127 Å²	127	62.4 Å²	62.4	86%	0.858	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	131.7	170.6	-62.9	0	0	0	0	110.1
816	A	65.1	Low	82.4	Confident	87 Å²	87	60.7 Å²	60.7	72%	0.719	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	48.1	174.6	0	0	0	0	0	116.6	N818 S822	A816-N818 PolarHBondContact O-N 3.48Å; A816-S822 WeakPolarHBondContact O-CB 3.35Å; A816-S822 PolarHBondContact O-OG 3.47Å
817	M	67.6	Low	82.2	Confident	37 Å²	37	59.3 Å²	59.3	18%	0.182	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	120.5	161.4	-55.7	-59.5	-116.5	0	0	108.6	R811 L812 L814 E826	R811-M817 HydrophobicContact CG-CE 4.01Å; L812-M817 WeakPolarHBondContact O-CE 3.37Å; L814-M817 HydrophobicContact CB-CE 4.42Å; L814-M817 HydrophobicContact CB-SD 3.79Å; L814-M817 HydrophobicContact CD1-SD 4.31Å; L814-M817 HydrophobicContact CG-SD 4.38Å; M817-E826 HydrophobicContact CE-CG 4.12Å; M817-E826 WeakPolarHBondContact CE-OE2 3.44Å
818	N	73	Confident	82.1	Confident	154 Å²	154	58 Å²	58	82%	0.824	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	160.4	3.6	162.1	-79	-13.6	0	0	0	113.1	A816 S822	A816-N818 PolarHBondContact O-N 3.48Å; N818-S822 PolarHBondContact N-OG 3.49Å
819	T	83.6	Confident	82	Confident	76 Å²	76	60.6 Å²	60.6	47%	0.466	34%	0.338	S	S	.	.	S	Bend	trans	-110.9	154.2	178.4	67.3	0	0	0	0	111.2	Q821 S822 D823	T819-Q821 PolarHBondContact O-N 2.98Å; T819-S822 PolarHBondContact N-OG 3.03Å; T819-S822 PolarHBondContact O-N 2.95Å; T819-S822 VanDerWaalsContact O-N 3.15Å; T819-S822 PolarHBondContact O-OG 3.02Å; T819-S822 WeakPolarHBondContact OG1-CB 3.44Å; T819-S822 PolarHBondContact OG1-N 3.23Å; T819-S822 PolarHBondContact OG1-OG 3.26Å; T819-S822 VanDerWaalsContact OG1-OG 3.11Å; T819-D823 PolarHBondContact O-N 3.33Å
820	D	81.3	Confident	81.8	Confident	96 Å²	96	56.8 Å²	56.8	51%	0.513	31%	0.312	S	S	.	.	H	α-helix	trans	-60.1	-29.5	173.8	-72	-30	0	0	0	111.9	L824 L876	D820-L824 WeakPolarHBondContact O-CB 3.49Å; D820-L824 VanDerWaalsContact O-CG 3.25Å; D820-L824 WeakPolarHBondContact O-CG 3.44Å; D820-L824 PolarHBondContact O-N 3.16Å; D820-L824 VanDerWaalsContact O-N 3.15Å; D820-L876 HydrophobicContact CB-CD1 4.45Å
821	Q	86.7	Confident	81.5	Confident	84 Å²	84	56.3 Å²	56.3	39%	0.393	31%	0.31	S	S	.	.	H	α-helix	trans	-66.4	-50.3	174	178.6	176.8	-12.9	0	0	111.2	T819 D823 L824 E825 L876	T819-Q821 PolarHBondContact O-N 2.98Å; Q821-D823 VanDerWaalsContact C-N 3.3Å; Q821-D823 PolarHBondContact O-N 2.65Å; Q821-L824 PolarHBondContact O-N 2.8Å; Q821-L824 VanDerWaalsContact O-N 3.15Å; Q821-E825 HydrophobicContact CG-CG 4.34Å; Q821-E825 VanDerWaalsContact CG-OE1 3.32Å; Q821-E825 WeakPolarHBondContact CG-OE1 3.21Å; Q821-E825 PolarHBondContact NE2-OE1 2.89Å; Q821-E825 WeakPolarHBondContact O-CG 3.46Å; Q821-E825 PolarHBondContact O-N 2.92Å; Q821-L876 HydrophobicContact CB-CD1 4.45Å; Q821-L876 HydrophobicContact CB-CD2 4.39Å
822	S	85.1	Confident	81.3	Confident	8 Å²	8	53.2 Å²	53.2	6%	0.056	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-39.7	179	59.5	0	0	0	0	111.8	A816 N818 T819 L824 E825 E826	A816-S822 WeakPolarHBondContact O-CB 3.35Å; A816-S822 PolarHBondContact O-OG 3.47Å; N818-S822 PolarHBondContact N-OG 3.49Å; T819-S822 PolarHBondContact N-OG 3.03Å; T819-S822 PolarHBondContact O-N 2.95Å; T819-S822 VanDerWaalsContact O-N 3.15Å; T819-S822 PolarHBondContact O-OG 3.02Å; T819-S822 WeakPolarHBondContact OG1-CB 3.44Å; T819-S822 PolarHBondContact OG1-N 3.23Å; T819-S822 PolarHBondContact OG1-OG 3.26Å; T819-S822 VanDerWaalsContact OG1-OG 3.11Å; S822-L824 VanDerWaalsContact C-N 3.33Å; S822-L824 PolarHBondContact O-N 3.45Å; S822-E825 PolarHBondContact O-N 2.76Å; S822-E826 WeakPolarHBondContact O-CB 3.38Å; S822-E826 PolarHBondContact O-N 3.12Å
823	D	83.8	Confident	81.1	Confident	41 Å²	41	53.7 Å²	53.7	22%	0.219	31%	0.305	C	S	.	.	H	α-helix	trans	-62.8	-41.1	176.8	-73.9	-4.9	0	0	0	111	T819 Q821 N827	T819-D823 PolarHBondContact O-N 3.33Å; Q821-D823 VanDerWaalsContact C-N 3.3Å; Q821-D823 PolarHBondContact O-N 2.65Å; D823-N827 WeakPolarHBondContact O-CB 3.21Å; D823-N827 VanDerWaalsContact O-CG 3.28Å; D823-N827 PolarHBondContact O-N 3.09Å; D823-N827 PolarHBondContact O-ND2 3.12Å
824	L	87.2	Confident	80.8	Confident	22 Å²	22	52.2 Å²	52.2	12%	0.115	30%	0.296	C	S	.	.	H	α-helix	trans	-71.4	-39	177.5	-72.3	173.4	0	0	0	112.4	D820 Q821 S822 N827 Y828 V869 R872 L873	D820-L824 WeakPolarHBondContact O-CB 3.49Å; D820-L824 VanDerWaalsContact O-CG 3.25Å; D820-L824 WeakPolarHBondContact O-CG 3.44Å; D820-L824 PolarHBondContact O-N 3.16Å; D820-L824 VanDerWaalsContact O-N 3.15Å; Q821-L824 PolarHBondContact O-N 2.8Å; Q821-L824 VanDerWaalsContact O-N 3.15Å; S822-L824 VanDerWaalsContact C-N 3.33Å; S822-L824 PolarHBondContact O-N 3.45Å; L824-N827 PolarHBondContact O-N 2.87Å; L824-Y828 WeakPolarHBondContact O-CB 3.33Å; L824-Y828 PolarHBondContact O-N 2.92Å; L824-V869 HydrophobicContact CB-CG1 4.39Å; L824-V869 HydrophobicContact CD2-CG1 4.3Å; L824-V869 WeakPolarHBondContact O-CG1 3.31Å; L824-R872 HydrophobicContact CD1-CB 4.01Å; L824-R872 HydrophobicContact CD2-CB 4.09Å; L824-L873 HydrophobicContact CB-CD1 4.38Å; L824-L873 HydrophobicContact CB-CD2 3.43Å; L824-L873 VanDerWaalsContact CB-CD2 3.43Å; L824-L873 HydrophobicContact CB-CG 3.72Å; L824-L873 HydrophobicContact CD1-CD2 4.08Å; L824-L873 HydrophobicContact CD1-CG 4.31Å; L824-L873 HydrophobicContact CG-CD2 4.42Å
825	E	88.8	Confident	80.8	Confident	81 Å²	81	50.7 Å²	50.7	38%	0.379	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-43.4	174.6	-73.4	174.1	-178.9	0	0	111.2	Q821 S822 Y828 L829 L873	Q821-E825 HydrophobicContact CG-CG 4.34Å; Q821-E825 VanDerWaalsContact CG-OE1 3.32Å; Q821-E825 WeakPolarHBondContact CG-OE1 3.21Å; Q821-E825 PolarHBondContact NE2-OE1 2.89Å; Q821-E825 WeakPolarHBondContact O-CG 3.46Å; Q821-E825 PolarHBondContact O-N 2.92Å; S822-E825 PolarHBondContact O-N 2.76Å; E825-Y828 WeakPolarHBondContact O-CB 3.47Å; E825-Y828 PolarHBondContact O-N 3.38Å; E825-L829 WeakPolarHBondContact O-CG 3.41Å; E825-L829 PolarHBondContact O-N 2.67Å; E825-L873 HydrophobicContact CG-CD1 4.45Å; E825-L873 HydrophobicContact CG-CD2 4Å
826	E	86.5	Confident	81.3	Confident	10 Å²	10	45.9 Å²	45.9	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-57.6	-54.7	172.8	-171.1	-173.1	-177.2	0	0	110.6	R811 L812 L814 M817 S822 Y828 L829 Q830	R811-E826 WeakPolarHBondContact CA-OE1 3.39Å; R811-E826 VanDerWaalsContact CG-OE1 3.27Å; R811-E826 WeakPolarHBondContact CG-OE1 3.42Å; R811-E826 IonicContact NE-OE2 3.94Å; L812-E826 HydrophobicContact CB-CG 4.08Å; L812-E826 HydrophobicContact CD1-CG 4.09Å; L812-E826 HydrophobicContact CG-CG 4.14Å; L812-E826 PolarHBondContact N-OE1 2.68Å; L814-E826 HydrophobicContact CD1-CB 3.77Å; L814-E826 HydrophobicContact CD1-CG 4.02Å; M817-E826 HydrophobicContact CE-CG 4.12Å; M817-E826 WeakPolarHBondContact CE-OE2 3.44Å; S822-E826 WeakPolarHBondContact O-CB 3.38Å; S822-E826 PolarHBondContact O-N 3.12Å; E826-Y828 PolarHBondContact O-N 3.2Å; E826-Y828 VanDerWaalsContact O-N 3.16Å; E826-L829 PolarHBondContact O-N 3.06Å; E826-Q830 VanDerWaalsContact CD-NE2 3.32Å; E826-Q830 HydrophobicContact CG-CG 4.17Å; E826-Q830 VanDerWaalsContact O-CG 3.26Å; E826-Q830 WeakPolarHBondContact O-CG 3.36Å; E826-Q830 PolarHBondContact O-N 3.35Å; E826-Q830 PolarHBondContact OE1-NE2 3.13Å
827	N	85.7	Confident	81.6	Confident	10 Å²	10	45.5 Å²	45.5	5%	0.053	23%	0.233	C	C	.	.	H	α-helix	trans	-56.4	-35.2	179.4	-77.8	-54.7	0	0	0	112.5	N779 V781 D823 L824 C831 V869	N779-N827 PolarHBondContact O-ND2 3.28Å; N779-N827 PolarHBondContact O-OD1 2.95Å; V781-N827 WeakPolarHBondContact CB-OD1 3.43Å; V781-N827 HydrophobicContact CG2-CB 4.03Å; V781-N827 WeakPolarHBondContact CG2-OD1 3.26Å; V781-N827 PolarHBondContact N-OD1 2.84Å; D823-N827 WeakPolarHBondContact O-CB 3.21Å; D823-N827 VanDerWaalsContact O-CG 3.28Å; D823-N827 PolarHBondContact O-N 3.09Å; D823-N827 PolarHBondContact O-ND2 3.12Å; L824-N827 PolarHBondContact O-N 2.87Å; N827-C831 PolarHBondContact O-N 3.45Å; N827-C831 PolarHBondContact O-SG 2.89Å; N827-V869 HydrophobicContact CB-CG1 4.34Å; N827-V869 HydrophobicContact CB-CG2 4.17Å
828	Y	88.3	Confident	81.7	Confident	31 Å²	31	44.5 Å²	44.5	12%	0.122	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-48.5	174.4	170.6	-107.7	0	0	0	111.8	L824 E825 E826 Q830 C831 L832 R866 L870 M892	L824-Y828 WeakPolarHBondContact O-CB 3.33Å; L824-Y828 PolarHBondContact O-N 2.92Å; E825-Y828 WeakPolarHBondContact O-CB 3.47Å; E825-Y828 PolarHBondContact O-N 3.38Å; E826-Y828 PolarHBondContact O-N 3.2Å; E826-Y828 VanDerWaalsContact O-N 3.16Å; Y828-Q830 VanDerWaalsContact C-N 3.34Å; Y828-Q830 PolarHBondContact O-N 3.1Å; Y828-C831 WeakPolarHBondContact O-CB 3.34Å; Y828-C831 PolarHBondContact O-N 3.02Å; Y828-L832 HydrophobicContact CD1-CD1 4.31Å; Y828-L832 HydrophobicContact CE1-CD1 3.63Å; Y828-L832 HydrophobicContact CE1-CG 4.35Å; Y828-L832 HydrophobicContact CE2-CD1 4.35Å; Y828-L832 HydrophobicContact CE2-CD2 4.36Å; Y828-L832 HydrophobicContact CE2-CG 4.3Å; Y828-L832 PolarHBondContact O-N 3.33Å; Y828-L832 VanDerWaalsContact O-N 3.1Å; Y828-R866 HydrophobicContact CD2-CG 3.97Å; Y828-R866 HydrophobicContact CE2-CG 3.88Å; Y828-L870 HydrophobicContact CD2-CD1 4.3Å; Y828-L870 HydrophobicContact CD2-CD2 3.72Å; Y828-L870 HydrophobicContact CD2-CG 3.84Å; Y828-L870 HydrophobicContact CE2-CD1 3.85Å; Y828-L870 HydrophobicContact CE2-CD2 3.64Å; Y828-L870 HydrophobicContact CE2-CG 3.85Å; Y828-L870 HydrophobicContact CG-CD2 4.37Å; Y828-M892 HydrophobicContact CE1-SD 3.94Å
829	L	87.2	Confident	81.5	Confident	64 Å²	64	39.4 Å²	39.4	34%	0.335	20%	0.201	S	C	.	.	H	α-helix	trans	-62.6	-41.2	177.1	-67.4	176	0	0	0	111.8	L812 L814 E825 E826 C831 L832 I833	L812-L829 HydrophobicContact CD1-CB 3.57Å; L812-L829 HydrophobicContact CD1-CD1 4.3Å; L814-L829 HydrophobicContact CD1-CD1 4.08Å; L814-L829 HydrophobicContact CD2-CD1 3.88Å; E825-L829 WeakPolarHBondContact O-CG 3.41Å; E825-L829 PolarHBondContact O-N 2.67Å; E826-L829 PolarHBondContact O-N 3.06Å; L829-C831 VanDerWaalsContact C-N 3.31Å; L829-C831 PolarHBondContact O-N 3.16Å; L829-L832 HydrophobicContact CD2-CD1 4.48Å; L829-L832 WeakPolarHBondContact O-CB 3.34Å; L829-L832 PolarHBondContact O-N 3.22Å; L829-L832 VanDerWaalsContact O-N 3.13Å; L829-I833 WeakPolarHBondContact O-CG1 3.15Å; L829-I833 PolarHBondContact O-N 3.43Å
830	Q	85.2	Confident	81	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.019	18%	0.183	C	C	.	.	H	α-helix	trans	-59.3	-42	174.7	-67.4	-178.6	-6.4	0	0	111.7	V781 F783 L812 E826 Y828 L832 I833 S834	V781-Q830 HydrophobicContact CG1-CB 4.38Å; V781-Q830 PolarHBondContact O-OE1 3.16Å; F783-Q830 HydrophobicContact CD1-CB 3.53Å; F783-Q830 HydrophobicContact CD1-CG 3.45Å; F783-Q830 VanDerWaalsContact CD1-CG 3.45Å; F783-Q830 HydrophobicContact CE1-CB 3.89Å; F783-Q830 VanDerWaalsContact CE1-CD 3.47Å; F783-Q830 HydrophobicContact CE1-CG 3.3Å; F783-Q830 HydrophobicContact CG-CB 4.13Å; F783-Q830 HydrophobicContact CG-CG 4.45Å; F783-Q830 HydrophobicContact CZ-CG 4.17Å; L812-Q830 HydrophobicContact CD1-CG 3.86Å; L812-Q830 HydrophobicContact CG-CG 4.04Å; E826-Q830 VanDerWaalsContact CD-NE2 3.32Å; E826-Q830 HydrophobicContact CG-CG 4.17Å; E826-Q830 VanDerWaalsContact O-CG 3.26Å; E826-Q830 WeakPolarHBondContact O-CG 3.36Å; E826-Q830 PolarHBondContact O-N 3.35Å; E826-Q830 PolarHBondContact OE1-NE2 3.13Å; Y828-Q830 VanDerWaalsContact C-N 3.34Å; Y828-Q830 PolarHBondContact O-N 3.1Å; Q830-L832 PolarHBondContact O-N 2.93Å; Q830-I833 PolarHBondContact O-N 3.38Å; Q830-S834 WeakPolarHBondContact O-CB 3.06Å; Q830-S834 PolarHBondContact O-N 3.42Å; Q830-S834 PolarHBondContact O-OG 3.13Å
831	C	81.5	Confident	79.8	Confident	1 Å²	1	33 Å²	33	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-45.8	173.4	-68.3	0	0	0	0	111.3	N827 Y828 L829 I833 S834 E835 R866	N827-C831 PolarHBondContact O-N 3.45Å; N827-C831 PolarHBondContact O-SG 2.89Å; Y828-C831 WeakPolarHBondContact O-CB 3.34Å; Y828-C831 PolarHBondContact O-N 3.02Å; L829-C831 VanDerWaalsContact C-N 3.31Å; L829-C831 PolarHBondContact O-N 3.16Å; C831-I833 PolarHBondContact O-N 3.12Å; C831-S834 WeakPolarHBondContact CA-OG 3.5Å; C831-S834 PolarHBondContact O-N 3.31Å; C831-S834 PolarHBondContact O-OG 2.88Å; C831-E835 WeakPolarHBondContact O-CG 3.15Å; C831-E835 PolarHBondContact O-N 3.1Å; C831-R866 HydrophobicContact CB-CB 4.11Å
832	L	82.4	Confident	78.3	Confident	54 Å²	54	30 Å²	30	28%	0.283	16%	0.155	S	C	.	.	H	α-helix	trans	-61.6	-43.3	178.6	-67.3	-179.4	0	0	0	112.6	Y828 L829 Q830 S834 E835 D836	Y828-L832 HydrophobicContact CD1-CD1 4.31Å; Y828-L832 HydrophobicContact CE1-CD1 3.63Å; Y828-L832 HydrophobicContact CE1-CG 4.35Å; Y828-L832 HydrophobicContact CE2-CD1 4.35Å; Y828-L832 HydrophobicContact CE2-CD2 4.36Å; Y828-L832 HydrophobicContact CE2-CG 4.3Å; Y828-L832 PolarHBondContact O-N 3.33Å; Y828-L832 VanDerWaalsContact O-N 3.1Å; L829-L832 HydrophobicContact CD2-CD1 4.48Å; L829-L832 WeakPolarHBondContact O-CB 3.34Å; L829-L832 PolarHBondContact O-N 3.22Å; L829-L832 VanDerWaalsContact O-N 3.13Å; Q830-L832 PolarHBondContact O-N 2.93Å; L832-S834 VanDerWaalsContact C-N 3.34Å; L832-E835 PolarHBondContact O-N 3.18Å; L832-D836 PolarHBondContact O-N 2.88Å
833	I	82.9	Confident	76.6	Confident	19 Å²	19	32 Å²	32	10%	0.097	17%	0.165	C	C	.	.	H	α-helix	trans	-64.8	-41.4	178	-66.3	167.1	0	0	0	110.4	R719 V734 F783 L812 L829 Q830 C831 E835 D836	R719-I833 PolarHBondContact NH1-O 2.99Å; V734-I833 HydrophobicContact CG1-CD1 4.4Å; F783-I833 HydrophobicContact CD2-CG2 4.41Å; F783-I833 HydrophobicContact CE2-CG2 4.14Å; L812-I833 HydrophobicContact CD1-CD1 4.19Å; L812-I833 HydrophobicContact CD2-CD1 3.87Å; L829-I833 WeakPolarHBondContact O-CG1 3.15Å; L829-I833 PolarHBondContact O-N 3.43Å; Q830-I833 PolarHBondContact O-N 3.38Å; C831-I833 PolarHBondContact O-N 3.12Å; I833-E835 VanDerWaalsContact C-N 3.28Å; I833-E835 PolarHBondContact O-N 3.16Å; I833-D836 WeakPolarHBondContact O-CB 3.47Å; I833-D836 PolarHBondContact O-N 3.35Å; I833-D836 VanDerWaalsContact O-N 3.14Å
834	S	76	Confident	74.8	Confident	32 Å²	32	34 Å²	34	22%	0.224	18%	0.178	C	C	.	.	H	α-helix	trans	-68.6	-25.3	177.8	73.5	0	0	0	0	113.9	Q830 C831 L832 D836	Q830-S834 WeakPolarHBondContact O-CB 3.06Å; Q830-S834 PolarHBondContact O-N 3.42Å; Q830-S834 PolarHBondContact O-OG 3.13Å; C831-S834 WeakPolarHBondContact CA-OG 3.5Å; C831-S834 PolarHBondContact O-N 3.31Å; C831-S834 PolarHBondContact O-OG 2.88Å; L832-S834 VanDerWaalsContact C-N 3.34Å; S834-D836 VanDerWaalsContact C-N 3.29Å
835	E	75.2	Confident	72.9	Confident	26 Å²	26	34.4 Å²	34.4	12%	0.121	18%	0.182	C	C	.	.	H	α-helix	trans	-77.7	-15.5	174.2	-75.9	176.2	-160.3	0	0	112.1	C831 L832 I833 W837 S862 R866	C831-E835 WeakPolarHBondContact O-CG 3.15Å; C831-E835 PolarHBondContact O-N 3.1Å; L832-E835 PolarHBondContact O-N 3.18Å; I833-E835 VanDerWaalsContact C-N 3.28Å; I833-E835 PolarHBondContact O-N 3.16Å; E835-W837 PolarHBondContact O-N 2.68Å; E835-S862 WeakPolarHBondContact CG-OG 3.19Å; E835-R866 IonicContact OE1-CZ 2.8Å; E835-R866 IonicContact OE1-NE 3.59Å; E835-R866 PolarHBondContact OE1-NE 2.78Å; E835-R866 IonicContact OE1-NH2 3.5Å; E835-R866 PolarHBondContact OE1-NH2 2.85Å; E835-R866 IonicContact OE2-CZ 2.74Å; E835-R866 VanDerWaalsContact OE2-CZ 3.32Å; E835-R866 IonicContact OE2-NE 2.82Å; E835-R866 PolarHBondContact OE2-NE 2.7Å; E835-R866 IonicContact OE2-NH2 3.58Å; E835-R866 PolarHBondContact OE2-NH2 3.39Å
836	D	74.9	Confident	70.7	Confident	27 Å²	27	36.1 Å²	36.1	14%	0.144	19%	0.194	C	C	.	.			trans	-84.7	101.9	178.6	-165.6	40.7	0	0	0	110.5	R719 I721 H722 L832 I833 S834	R719-D836 PolarHBondContact NH1-O 2.68Å; R719-D836 IonicContact NH1-OD2 3.58Å; R719-D836 PolarHBondContact NH2-O 2.74Å; I721-D836 WeakPolarHBondContact CA-OD2 3.43Å; I721-D836 WeakPolarHBondContact CB-OD2 3.24Å; H722-D836 IonicContact CD2-OD1 3.56Å; H722-D836 IonicContact CD2-OD2 2.74Å; H722-D836 IonicContact CE1-OD1 3.41Å; H722-D836 PolarHBondContact CE1-OD1 3.19Å; H722-D836 PolarHBondContact N-OD2 3.36Å; H722-D836 IonicContact ND1-OD1 3.07Å; H722-D836 IonicContact NE2-OD1 3.8Å; L832-D836 PolarHBondContact O-N 2.88Å; I833-D836 WeakPolarHBondContact O-CB 3.47Å; I833-D836 PolarHBondContact O-N 3.35Å; I833-D836 VanDerWaalsContact O-N 3.14Å; S834-D836 VanDerWaalsContact C-N 3.29Å
837	W	70.9	Confident	68.4	Low	79 Å²	79	39.4 Å²	39.4	30%	0.299	22%	0.223	S	C	.	.			trans	-91.7	131.5	179.6	-75.3	74.9	0	0	0	110.8	H722 E835 I839 P842 L855 L858	H722-W837 PolarHBondContact CE1-O 3.14Å; H722-W837 PolarHBondContact NE2-O 3Å; E835-W837 PolarHBondContact O-N 2.68Å; W837-I839 PolarHBondContact O-N 2.85Å; W837-P842 HydrophobicContact CE3-CB 3.6Å; W837-P842 HydrophobicContact CE3-CG 3.51Å; W837-P842 HydrophobicContact CZ3-CB 3.34Å; W837-P842 HydrophobicContact CZ3-CG 3.52Å; W837-L855 HydrophobicContact CD2-CD2 4.27Å; W837-L855 HydrophobicContact CE3-CD2 4.02Å; W837-L855 HydrophobicContact CH2-CD2 3.14Å; W837-L855 HydrophobicContact CZ2-CD2 3.43Å; W837-L855 VanDerWaalsContact CZ2-CD2 3.43Å; W837-L855 HydrophobicContact CZ3-CD2 3.47Å; W837-L855 VanDerWaalsContact CZ3-CD2 3.47Å; W837-L858 HydrophobicContact CH2-CD1 3.93Å; W837-L858 HydrophobicContact CZ2-CB 4.4Å; W837-L858 HydrophobicContact CZ2-CD1 3.91Å
838	P	69.5	Low	66.4	Low	15 Å²	15	44.1 Å²	44.1	10%	0.097	25%	0.248	C	C	.	.			trans	-53.1	138.9	-179.5	-22.1	30.3	0	0	0	113	W840 G841	P838-W840 HydrophobicContact CB-CD2 4.3Å; P838-W840 HydrophobicContact CB-CG 4.17Å; P838-W840 VanDerWaalsContact CB-NE1 3.31Å; P838-W840 PolarHBondContact O-N 3.06Å; P838-G841 WeakPolarHBondContact O-CA 3.49Å; P838-G841 PolarHBondContact O-N 2.65Å
839	I	69.2	Low	64.6	Low	47 Å²	47	51 Å²	51	24%	0.241	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.4	-178.2	-57.4	176.3	0	0	0	112.7	W667 H722 P729 F731 W837 G841	W667-I839 HydrophobicContact CB-CG2 3.5Å; W667-I839 VanDerWaalsContact CB-CG2 3.5Å; W667-I839 HydrophobicContact CD2-CG2 3.98Å; W667-I839 HydrophobicContact CG-CG2 3.48Å; W667-I839 VanDerWaalsContact CG-CG2 3.48Å; H722-I839 HydrophobicContact CB-CD1 3.97Å; H722-I839 HydrophobicContact CB-CG1 4.47Å; H722-I839 WeakPolarHBondContact CE1-CG1 3.26Å; H722-I839 WeakPolarHBondContact NE2-CG1 3.28Å; P729-I839 HydrophobicContact CB-CD1 3.11Å; P729-I839 HydrophobicContact CG-CD1 3.6Å; F731-I839 HydrophobicContact CE1-CD1 4Å; F731-I839 HydrophobicContact CZ-CD1 3.72Å; W837-I839 PolarHBondContact O-N 2.85Å; I839-G841 PolarHBondContact O-N 2.57Å; I839-G841 VanDerWaalsContact O-N 3.1Å
840	W	71.7	Confident	62.8	Low	20 Å²	20	52.5 Å²	52.5	8%	0.076	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	6.5	172.5	38.1	81.7	0	0	0	114.3	H628 N631 I633 V649 W667 L672 F702 G706 L708 L720 P838	H628-W840 AromaticContact CD2-CD1 3.91Å; H628-W840 AromaticContact NE2-CD1 3.9Å; N631-W840 PolarHBondContact ND2-O 3.41Å; I633-W840 HydrophobicContact CD1-CB 3.46Å; I633-W840 VanDerWaalsContact CD1-CB 3.46Å; I633-W840 HydrophobicContact CD1-CG 4.01Å; V649-W840 HydrophobicContact CB-CZ3 4.45Å; V649-W840 HydrophobicContact CG1-CE3 4.5Å; V649-W840 HydrophobicContact CG1-CZ3 4.36Å; V649-W840 HydrophobicContact CG2-CH2 4.07Å; V649-W840 HydrophobicContact CG2-CZ3 4.02Å; W667-W840 HydrophobicContact CH2-CB 3.77Å; W667-W840 HydrophobicContact CH2-CD2 4.32Å; W667-W840 AromaticContact CH2-CE3 3.61Å; W667-W840 HydrophobicContact CH2-CE3 3.61Å; W667-W840 HydrophobicContact CH2-CG 4.45Å; W667-W840 HydrophobicContact CZ2-CB 3.4Å; W667-W840 HydrophobicContact CZ2-CE3 4.35Å; W667-W840 HydrophobicContact CZ2-CG 4.48Å; W667-W840 AromaticContact CZ3-CE3 3.82Å; W667-W840 HydrophobicContact CZ3-CE3 3.82Å; W667-W840 HydrophobicContact CZ3-CZ3 4.42Å; L672-W840 HydrophobicContact CD1-CE3 3.88Å; L672-W840 HydrophobicContact CD1-CZ3 3.52Å; L672-W840 HydrophobicContact CD2-CZ3 4.05Å; L672-W840 HydrophobicContact CG-CZ3 4.45Å; F702-W840 HydrophobicContact CE1-CZ2 4.1Å; G706-W840 PolarHBondContact O-NE1 2.72Å; L708-W840 HydrophobicContact CB-CZ2 4.06Å; L720-W840 HydrophobicContact CD2-CH2 3.61Å; L720-W840 HydrophobicContact CD2-CZ2 4.28Å; P838-W840 HydrophobicContact CB-CD2 4.3Å; P838-W840 HydrophobicContact CB-CG 4.17Å; P838-W840 VanDerWaalsContact CB-NE1 3.31Å; P838-W840 PolarHBondContact O-N 3.06Å
841	G	55.9	Low	60.9	Low	17 Å²	17	54 Å²	54	18%	0.175	30%	0.298	C	S	.	.			trans	73.9	151.9	175.8	0	0	0	0	0	112.1	P838 I839	P838-G841 WeakPolarHBondContact O-CA 3.49Å; P838-G841 PolarHBondContact O-N 2.65Å; I839-G841 PolarHBondContact O-N 2.57Å; I839-G841 VanDerWaalsContact O-N 3.1Å
842	P	55.9	Low	59.5	Low	22 Å²	22	59.7 Å²	59.7	14%	0.143	33%	0.327	C	S	.	.	S	Bend	trans	-69.4	178.5	160.7	32.6	-33.6	0	0	0	110.8	W837 T844 L855	W837-P842 HydrophobicContact CE3-CB 3.6Å; W837-P842 HydrophobicContact CE3-CG 3.51Å; W837-P842 HydrophobicContact CZ3-CB 3.34Å; W837-P842 HydrophobicContact CZ3-CG 3.52Å; P842-T844 VanDerWaalsContact C-N 3.3Å; P842-T844 WeakPolarHBondContact O-CG2 3.08Å; P842-T844 PolarHBondContact O-N 3.2Å; P842-L855 HydrophobicContact CG-CD1 4.29Å; P842-L855 HydrophobicContact CG-CD2 4.09Å
843	N	50.1	Low	58.2	Low	51 Å²	51	59.9 Å²	59.9	27%	0.273	33%	0.333	S	S	.	.			trans	-49.1	89.5	173.7	-61.3	-2.7	0	0	0	110.7	S630 T845 I851	S630-N843 WeakPolarHBondContact CB-OD1 3.26Å; S630-N843 PolarHBondContact OG-OD1 2.91Å; N843-T845 PolarHBondContact O-N 3.26Å; N843-I851 WeakPolarHBondContact O-CD1 3.33Å
844	T	46	Very low	56.6	Low	81 Å²	81	64 Å²	64	50%	0.497	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-83	-1.5	178.5	46.3	0	0	0	0	111.5	P842 D846 A847	P842-T844 VanDerWaalsContact C-N 3.3Å; P842-T844 WeakPolarHBondContact O-CG2 3.08Å; P842-T844 PolarHBondContact O-N 3.2Å; T844-D846 PolarHBondContact O-N 3.33Å; T844-A847 WeakPolarHBondContact O-CB 3.43Å; T844-A847 PolarHBondContact O-N 3.4Å
845	T	46.8	Very low	55.6	Low	32 Å²	32	64.9 Å²	64.9	20%	0.196	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-67.7	-22.9	-179	48.8	0	0	0	0	112.8	N566 N843 A847	N566-T845 PolarHBondContact OD1-O 2.9Å; N566-T845 VanDerWaalsContact OD1-O 3.12Å; N843-T845 PolarHBondContact O-N 3.26Å; T845-A847 VanDerWaalsContact C-N 3.28Å; T845-A847 PolarHBondContact O-N 3.08Å
846	D	42.5	Very low	54.9	Low	116 Å²	116	68.6 Å²	68.6	62%	0.62	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-92.2	34.6	168.4	-92.4	-14.7	0	0	0	111.6	T844 N848 I851	T844-D846 PolarHBondContact O-N 3.33Å; D846-N848 PolarHBondContact O-N 3.16Å; D846-I851 VanDerWaalsContact C-CD1 3.46Å; D846-I851 HydrophobicContact CB-CD1 3.39Å; D846-I851 HydrophobicContact CB-CG1 4.06Å; D846-I851 VanDerWaalsContact O-CD1 3.23Å; D846-I851 WeakPolarHBondContact O-CD1 2.94Å; D846-I851 WeakPolarHBondContact O-CG1 3.43Å
847	A	39.3	Very low	54.3	Low	79 Å²	79	68.9 Å²	68.9	65%	0.653	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	37.6	178.5	0	0	0	0	0	114.8	T844 T845	T844-A847 WeakPolarHBondContact O-CB 3.43Å; T844-A847 PolarHBondContact O-N 3.4Å; T845-A847 VanDerWaalsContact C-N 3.28Å; T845-A847 PolarHBondContact O-N 3.08Å
848	N	43.3	Very low	53.8	Low	109 Å²	109	68.2 Å²	68.2	58%	0.583	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	151.1	146.4	-75.7	-20.1	0	0	0	109.3	D846 D850 I851	D846-N848 PolarHBondContact O-N 3.16Å; N848-D850 HydrophobicContact CB-CB 4.14Å; N848-D850 PolarHBondContact O-N 3.03Å; N848-I851 PolarHBondContact O-N 2.85Å
849	E	50.7	Low	53.7	Low	176 Å²	176	71.3 Å²	71.3	82%	0.822	40%	0.396	S	S	*	.	H	α-helix	trans	-47.4	-24.6	170.5	-70.9	-161.9	153.1	0	0	112.6	I851 L852 S853	E849-I851 PolarHBondContact O-N 2.81Å; E849-L852 PolarHBondContact O-N 3.22Å; E849-S853 WeakPolarHBondContact O-CB 3.46Å; E849-S853 PolarHBondContact O-N 2.86Å
850	D	48	Very low	53.8	Low	95 Å²	95	72.6 Å²	72.6	51%	0.508	41%	0.406	S	S	.	.	H	α-helix	trans	-53.3	-47.6	172.6	-66.8	-22.7	0	0	0	113	N848 S853 H854	N848-D850 HydrophobicContact CB-CB 4.14Å; N848-D850 PolarHBondContact O-N 3.03Å; D850-S853 WeakPolarHBondContact CA-OG 3.41Å; D850-S853 CarbonylContact O-C 3.53Å; D850-S853 PolarHBondContact O-N 3.2Å; D850-S853 PolarHBondContact O-OG 2.82Å; D850-H854 VanDerWaalsContact O-CB 3.29Å; D850-H854 WeakPolarHBondContact O-CB 3.07Å; D850-H854 PolarHBondContact O-CD2 2.77Å; D850-H854 PolarHBondContact O-N 2.81Å
851	I	46.8	Very low	53.9	Low	37 Å²	37	77.3 Å²	77.3	19%	0.19	43%	0.427	C	S	.	.	H	α-helix	trans	-64.8	-45.7	178.5	-76	-171.6	0	0	0	111	N843 D846 N848 E849 S853 H854 L855	N843-I851 WeakPolarHBondContact O-CD1 3.33Å; D846-I851 VanDerWaalsContact C-CD1 3.46Å; D846-I851 HydrophobicContact CB-CD1 3.39Å; D846-I851 HydrophobicContact CB-CG1 4.06Å; D846-I851 VanDerWaalsContact O-CD1 3.23Å; D846-I851 WeakPolarHBondContact O-CD1 2.94Å; D846-I851 WeakPolarHBondContact O-CG1 3.43Å; N848-I851 PolarHBondContact O-N 2.85Å; E849-I851 PolarHBondContact O-N 2.81Å; I851-S853 PolarHBondContact O-N 2.74Å; I851-H854 CarbonylContact O-C 3.5Å; I851-H854 WeakPolarHBondContact O-CA 3.46Å; I851-H854 WeakPolarHBondContact O-CB 3.03Å; I851-H854 PolarHBondContact O-N 2.86Å; I851-L855 HydrophobicContact CG2-CD1 3.71Å; I851-L855 HydrophobicContact CG2-CG 3.81Å; I851-L855 WeakPolarHBondContact O-CB 3.35Å; I851-L855 VanDerWaalsContact O-CG 3.23Å; I851-L855 WeakPolarHBondContact O-CG 3.17Å; I851-L855 PolarHBondContact O-N 2.78Å
852	L	50.8	Low	54.8	Low	119 Å²	119	77.1 Å²	77.1	62%	0.623	42%	0.423	S	S	*	.	H	α-helix	trans	-61.5	-41.7	-179.3	-149.7	129.4	0	0	0	109.5	E849 H854 L855 L856	E849-L852 PolarHBondContact O-N 3.22Å; L852-H854 PolarHBondContact O-N 2.81Å; L852-L855 PolarHBondContact O-N 2.82Å; L852-L856 HydrophobicContact CD2-CD1 3.53Å; L852-L856 HydrophobicContact CG-CD1 4.35Å; L852-L856 WeakPolarHBondContact O-CB 3.42Å; L852-L856 WeakPolarHBondContact O-CD1 3.25Å; L852-L856 PolarHBondContact O-N 3.46Å
853	S	55	Low	56	Low	59 Å²	59	78.2 Å²	78.2	41%	0.413	43%	0.427	S	S	.	.	H	α-helix	trans	-62.5	-39	171.9	87.8	0	0	0	0	112.9	E849 D850 I851 S857	E849-S853 WeakPolarHBondContact O-CB 3.46Å; E849-S853 PolarHBondContact O-N 2.86Å; D850-S853 WeakPolarHBondContact CA-OG 3.41Å; D850-S853 CarbonylContact O-C 3.53Å; D850-S853 PolarHBondContact O-N 3.2Å; D850-S853 PolarHBondContact O-OG 2.82Å; I851-S853 PolarHBondContact O-N 2.74Å; S853-S857 VanDerWaalsContact O-CB 3.28Å; S853-S857 WeakPolarHBondContact O-CB 3.48Å; S853-S857 PolarHBondContact O-N 3.36Å
854	H	50	Low	57.6	Low	105 Å²	105	80.1 Å²	80.1	49%	0.486	44%	0.441	S	S	.	.	H	α-helix	trans	-69	-42.4	177.2	-85.2	-68.9	0	0	0	111.1	D850 I851 L852 S857 L858	D850-H854 VanDerWaalsContact O-CB 3.29Å; D850-H854 WeakPolarHBondContact O-CB 3.07Å; D850-H854 PolarHBondContact O-CD2 2.77Å; D850-H854 PolarHBondContact O-N 2.81Å; I851-H854 CarbonylContact O-C 3.5Å; I851-H854 WeakPolarHBondContact O-CA 3.46Å; I851-H854 WeakPolarHBondContact O-CB 3.03Å; I851-H854 PolarHBondContact O-N 2.86Å; L852-H854 PolarHBondContact O-N 2.81Å; H854-S857 WeakPolarHBondContact CA-OG 3.42Å; H854-S857 CarbonylContact O-C 3.54Å; H854-S857 WeakPolarHBondContact O-CA 3.38Å; H854-S857 WeakPolarHBondContact O-CB 3.18Å; H854-S857 PolarHBondContact O-N 3.27Å; H854-S857 VanDerWaalsContact O-N 3.12Å; H854-S857 PolarHBondContact O-OG 2.8Å; H854-L858 WeakPolarHBondContact O-CB 3.13Å; H854-L858 WeakPolarHBondContact O-CD1 3.47Å; H854-L858 VanDerWaalsContact O-CG 3.22Å; H854-L858 WeakPolarHBondContact O-CG 3.01Å; H854-L858 PolarHBondContact O-N 3.06Å
855	L	55.1	Low	59.3	Low	51 Å²	51	79.5 Å²	79.5	27%	0.267	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-45.7	174.9	-68.4	179	0	0	0	110.6	W837 P842 I851 L852 S857 L858 N859	W837-L855 HydrophobicContact CD2-CD2 4.27Å; W837-L855 HydrophobicContact CE3-CD2 4.02Å; W837-L855 HydrophobicContact CH2-CD2 3.14Å; W837-L855 HydrophobicContact CZ2-CD2 3.43Å; W837-L855 VanDerWaalsContact CZ2-CD2 3.43Å; W837-L855 HydrophobicContact CZ3-CD2 3.47Å; W837-L855 VanDerWaalsContact CZ3-CD2 3.47Å; P842-L855 HydrophobicContact CG-CD1 4.29Å; P842-L855 HydrophobicContact CG-CD2 4.09Å; I851-L855 HydrophobicContact CG2-CD1 3.71Å; I851-L855 HydrophobicContact CG2-CG 3.81Å; I851-L855 WeakPolarHBondContact O-CB 3.35Å; I851-L855 VanDerWaalsContact O-CG 3.23Å; I851-L855 WeakPolarHBondContact O-CG 3.17Å; I851-L855 PolarHBondContact O-N 2.78Å; L852-L855 PolarHBondContact O-N 2.82Å; L855-S857 VanDerWaalsContact C-N 3.3Å; L855-S857 PolarHBondContact O-N 3.08Å; L855-L858 PolarHBondContact O-N 2.76Å; L855-N859 VanDerWaalsContact O-CB 3.28Å; L855-N859 WeakPolarHBondContact O-CB 3.29Å; L855-N859 PolarHBondContact O-N 2.8Å
856	L	60.2	Low	61.2	Low	103 Å²	103	79.2 Å²	79.2	54%	0.539	43%	0.427	S	S	.	.	H	α-helix	trans	-59.9	-40.7	170.1	-90.4	128.7	0	0	0	111.1	L852 T860	L852-L856 HydrophobicContact CD2-CD1 3.53Å; L852-L856 HydrophobicContact CG-CD1 4.35Å; L852-L856 WeakPolarHBondContact O-CB 3.42Å; L852-L856 WeakPolarHBondContact O-CD1 3.25Å; L852-L856 PolarHBondContact O-N 3.46Å; L856-T860 VanDerWaalsContact O-CB 3.32Å; L856-T860 WeakPolarHBondContact O-CB 3.39Å; L856-T860 WeakPolarHBondContact O-CG2 3.27Å; L856-T860 PolarHBondContact O-N 2.96Å; L856-T860 PolarHBondContact O-OG1 2.86Å
857	S	61.9	Low	63.5	Low	33 Å²	33	76.1 Å²	76.1	23%	0.231	41%	0.408	C	S	.	.	H	α-helix	trans	-65.6	-39.4	177.1	90.9	0	0	0	0	112.3	S853 H854 L855 T860 K861	S853-S857 VanDerWaalsContact O-CB 3.28Å; S853-S857 WeakPolarHBondContact O-CB 3.48Å; S853-S857 PolarHBondContact O-N 3.36Å; H854-S857 WeakPolarHBondContact CA-OG 3.42Å; H854-S857 CarbonylContact O-C 3.54Å; H854-S857 WeakPolarHBondContact O-CA 3.38Å; H854-S857 WeakPolarHBondContact O-CB 3.18Å; H854-S857 PolarHBondContact O-N 3.27Å; H854-S857 VanDerWaalsContact O-N 3.12Å; H854-S857 PolarHBondContact O-OG 2.8Å; L855-S857 VanDerWaalsContact C-N 3.3Å; L855-S857 PolarHBondContact O-N 3.08Å; S857-T860 VanDerWaalsContact C-OG1 3.32Å; S857-T860 VanDerWaalsContact CA-OG1 3.25Å; S857-T860 WeakPolarHBondContact CA-OG1 3.16Å; S857-T860 PolarHBondContact O-N 2.83Å; S857-T860 PolarHBondContact O-OG1 3.46Å; S857-K861 WeakPolarHBondContact O-CB 3.43Å; S857-K861 WeakPolarHBondContact O-CG 3.5Å; S857-K861 PolarHBondContact O-N 2.89Å
858	L	61.2	Low	65.9	Low	65 Å²	65	73.6 Å²	73.6	34%	0.34	39%	0.386	S	S	.	.	H	α-helix	trans	-69.5	-47.2	179.6	-75.8	161.1	0	0	0	109.5	W837 H854 L855 T860 K861 S862	W837-L858 HydrophobicContact CH2-CD1 3.93Å; W837-L858 HydrophobicContact CZ2-CB 4.4Å; W837-L858 HydrophobicContact CZ2-CD1 3.91Å; H854-L858 WeakPolarHBondContact O-CB 3.13Å; H854-L858 WeakPolarHBondContact O-CD1 3.47Å; H854-L858 VanDerWaalsContact O-CG 3.22Å; H854-L858 WeakPolarHBondContact O-CG 3.01Å; H854-L858 PolarHBondContact O-N 3.06Å; L855-L858 PolarHBondContact O-N 2.76Å; L858-T860 VanDerWaalsContact C-N 3.32Å; L858-T860 PolarHBondContact O-N 3.46Å; L858-K861 PolarHBondContact O-N 2.76Å; L858-S862 PolarHBondContact O-N 2.88Å; L858-S862 PolarHBondContact O-OG 2.87Å; L858-S862 VanDerWaalsContact O-OG 3.13Å
859	N	67.3	Low	68.2	Low	81 Å²	81	68.9 Å²	68.9	43%	0.433	36%	0.362	S	S	.	.	H	α-helix	trans	-64.7	-36	177.2	-160	1.8	0	0	0	111.7	L855 S862 L863	L855-N859 VanDerWaalsContact O-CB 3.28Å; L855-N859 WeakPolarHBondContact O-CB 3.29Å; L855-N859 PolarHBondContact O-N 2.8Å; N859-S862 WeakPolarHBondContact CA-OG 3.34Å; N859-S862 PolarHBondContact O-OG 3.36Å; N859-L863 WeakPolarHBondContact O-CB 3.14Å; N859-L863 PolarHBondContact O-N 2.81Å
860	T	71.5	Confident	70.2	Confident	73 Å²	73	60.5 Å²	60.5	45%	0.448	32%	0.323	S	S	.	.	H	α-helix	trans	-71.1	-38.1	174.3	51	0	0	0	0	112.4	L856 S857 L858 T864	L856-T860 VanDerWaalsContact O-CB 3.32Å; L856-T860 WeakPolarHBondContact O-CB 3.39Å; L856-T860 WeakPolarHBondContact O-CG2 3.27Å; L856-T860 PolarHBondContact O-N 2.96Å; L856-T860 PolarHBondContact O-OG1 2.86Å; S857-T860 VanDerWaalsContact C-OG1 3.32Å; S857-T860 VanDerWaalsContact CA-OG1 3.25Å; S857-T860 WeakPolarHBondContact CA-OG1 3.16Å; S857-T860 PolarHBondContact O-N 2.83Å; S857-T860 PolarHBondContact O-OG1 3.46Å; L858-T860 VanDerWaalsContact C-N 3.32Å; L858-T860 PolarHBondContact O-N 3.46Å; T860-T864 VanDerWaalsContact O-CB 3.29Å; T860-T864 WeakPolarHBondContact O-CB 3.47Å; T860-T864 PolarHBondContact O-N 2.98Å; T860-T864 PolarHBondContact O-OG1 2.99Å
861	K	73.8	Confident	72.4	Confident	119 Å²	119	56.9 Å²	56.9	52%	0.517	30%	0.303	S	S	.	.	H	α-helix	trans	-64.1	-48.3	173.7	-76.7	172.5	-177.8	179.3	0	111.4	S857 L858 T864 K865	S857-K861 WeakPolarHBondContact O-CB 3.43Å; S857-K861 WeakPolarHBondContact O-CG 3.5Å; S857-K861 PolarHBondContact O-N 2.89Å; L858-K861 PolarHBondContact O-N 2.76Å; K861-T864 PolarHBondContact O-N 3.31Å; K861-K865 WeakPolarHBondContact O-CG 3.22Å; K861-K865 PolarHBondContact O-N 3Å
862	S	74.7	Confident	74.5	Confident	13 Å²	13	59.8 Å²	59.8	9%	0.091	31%	0.311	C	S	.	.	H	α-helix	trans	-63.6	-44.7	177.3	60.5	0	0	0	0	111.3	E835 L858 N859 T864 K865 R866	E835-S862 WeakPolarHBondContact CG-OG 3.19Å; L858-S862 PolarHBondContact O-N 2.88Å; L858-S862 PolarHBondContact O-OG 2.87Å; L858-S862 VanDerWaalsContact O-OG 3.13Å; N859-S862 WeakPolarHBondContact CA-OG 3.34Å; N859-S862 PolarHBondContact O-OG 3.36Å; S862-T864 VanDerWaalsContact C-N 3.34Å; S862-T864 PolarHBondContact O-N 3.11Å; S862-K865 PolarHBondContact O-N 2.84Å; S862-R866 WeakPolarHBondContact O-CB 3.41Å; S862-R866 PolarHBondContact O-N 3.16Å
863	L	81	Confident	76.5	Confident	46 Å²	46	54.4 Å²	54.4	24%	0.241	28%	0.283	C	S	.	.	H	α-helix	trans	-58.8	-43.7	175.1	179	66	0	0	0	111.9	N859 R866 K867 P894	N859-L863 WeakPolarHBondContact O-CB 3.14Å; N859-L863 PolarHBondContact O-N 2.81Å; L863-R866 PolarHBondContact O-N 2.99Å; L863-K867 HydrophobicContact CG-CD 4.47Å; L863-K867 WeakPolarHBondContact O-CB 3.39Å; L863-K867 VanDerWaalsContact O-CG 3.29Å; L863-K867 WeakPolarHBondContact O-CG 3.17Å; L863-K867 PolarHBondContact O-N 3Å; L863-P894 HydrophobicContact CD1-CB 3.71Å; L863-P894 HydrophobicContact CD1-CG 3.7Å
864	T	84.4	Confident	78.4	Confident	91 Å²	91	51.7 Å²	51.7	56%	0.558	26%	0.264	S	S	*	.	H	α-helix	trans	-63.5	-42.8	177.7	-59.8	0	0	0	0	111.2	T860 K861 S862 K867 A868	T860-T864 VanDerWaalsContact O-CB 3.29Å; T860-T864 WeakPolarHBondContact O-CB 3.47Å; T860-T864 PolarHBondContact O-N 2.98Å; T860-T864 PolarHBondContact O-OG1 2.99Å; K861-T864 PolarHBondContact O-N 3.31Å; S862-T864 VanDerWaalsContact C-N 3.34Å; S862-T864 PolarHBondContact O-N 3.11Å; T864-K867 PolarHBondContact O-N 2.87Å; T864-A868 PolarHBondContact O-N 2.86Å
865	K	80.9	Confident	80.5	Confident	67 Å²	67	47.3 Å²	47.3	29%	0.291	25%	0.246	S	C	.	.	H	α-helix	trans	-63.6	-45.8	175.3	-72.2	178	179.5	-176	0	111.4	Y762 E766 K861 S862 K867 A868 V869	Y762-K865 PolarHBondContact OH-NZ 2.71Å; Y762-K865 VanDerWaalsContact OH-NZ 3.16Å; E766-K865 IonicContact OE1-NZ 2.81Å; K861-K865 WeakPolarHBondContact O-CG 3.22Å; K861-K865 PolarHBondContact O-N 3Å; S862-K865 PolarHBondContact O-N 2.84Å; K865-K867 PolarHBondContact O-N 2.96Å; K865-A868 WeakPolarHBondContact O-CB 3.1Å; K865-A868 PolarHBondContact O-N 2.71Å; K865-A868 VanDerWaalsContact O-N 3.09Å; K865-V869 WeakPolarHBondContact O-CG2 3.49Å; K865-V869 PolarHBondContact O-N 3.07Å
866	R	87.1	Confident	82.2	Confident	27 Å²	27	47.1 Å²	47.1	10%	0.102	25%	0.245	C	C	.	.	H	α-helix	trans	-58.3	-44.4	175.5	177.7	164.2	55.1	110.8	-10.9	112.2	Y828 C831 E835 S862 L863 A868 V869 L870	Y828-R866 HydrophobicContact CD2-CG 3.97Å; Y828-R866 HydrophobicContact CE2-CG 3.88Å; C831-R866 HydrophobicContact CB-CB 4.11Å; E835-R866 IonicContact OE1-CZ 2.8Å; E835-R866 IonicContact OE1-NE 3.59Å; E835-R866 PolarHBondContact OE1-NE 2.78Å; E835-R866 IonicContact OE1-NH2 3.5Å; E835-R866 PolarHBondContact OE1-NH2 2.85Å; E835-R866 IonicContact OE2-CZ 2.74Å; E835-R866 VanDerWaalsContact OE2-CZ 3.32Å; E835-R866 IonicContact OE2-NE 2.82Å; E835-R866 PolarHBondContact OE2-NE 2.7Å; E835-R866 IonicContact OE2-NH2 3.58Å; E835-R866 PolarHBondContact OE2-NH2 3.39Å; S862-R866 WeakPolarHBondContact O-CB 3.41Å; S862-R866 PolarHBondContact O-N 3.16Å; L863-R866 PolarHBondContact O-N 2.99Å; R866-A868 VanDerWaalsContact C-N 3.32Å; R866-A868 PolarHBondContact O-N 2.94Å; R866-V869 PolarHBondContact O-N 3.36Å; R866-L870 HydrophobicContact CG-CD1 4.04Å; R866-L870 HydrophobicContact CG-CG 4.49Å; R866-L870 WeakPolarHBondContact O-CB 3.47Å; R866-L870 WeakPolarHBondContact O-CG 3.43Å; R866-L870 PolarHBondContact O-N 3.25Å
867	K	90.6	Very high	83.8	Confident	51 Å²	51	42.5 Å²	42.5	22%	0.222	22%	0.222	C	C	.	.	H	α-helix	trans	-57.1	-45.4	173.3	-74.9	175.6	172.6	-169.7	0	111.4	L863 T864 K865 L871 P894 D895 T898	L863-K867 HydrophobicContact CG-CD 4.47Å; L863-K867 WeakPolarHBondContact O-CB 3.39Å; L863-K867 VanDerWaalsContact O-CG 3.29Å; L863-K867 WeakPolarHBondContact O-CG 3.17Å; L863-K867 PolarHBondContact O-N 3Å; T864-K867 PolarHBondContact O-N 2.87Å; K865-K867 PolarHBondContact O-N 2.96Å; K867-L871 WeakPolarHBondContact O-CB 3.28Å; K867-L871 WeakPolarHBondContact O-CG 3.4Å; K867-L871 PolarHBondContact O-N 3.38Å; K867-P894 HydrophobicContact CD-CG 4.21Å; K867-P894 HydrophobicContact CG-CG 3.58Å; K867-D895 VanDerWaalsContact CE-OD1 3.26Å; K867-D895 WeakPolarHBondContact CE-OD1 3.5Å; K867-D895 WeakPolarHBondContact CE-OD2 3.45Å; K867-D895 IonicContact NZ-OD1 3.52Å; K867-D895 PolarHBondContact NZ-OD1 2.81Å; K867-D895 IonicContact NZ-OD2 3.27Å; K867-D895 PolarHBondContact NZ-OD2 3.22Å; K867-T898 HydrophobicContact CB-CG2 4.34Å; K867-T898 WeakPolarHBondContact CD-OG1 3.28Å; K867-T898 WeakPolarHBondContact CE-OG1 3.35Å; K867-T898 HydrophobicContact CG-CG2 4.3Å
868	A	89.9	Confident	85.2	Confident	25 Å²	25	41 Å²	41	21%	0.207	21%	0.212	C	C	.	.	H	α-helix	trans	-64.1	-43.5	179	0	0	0	0	0	112.6	T864 K865 R866 L871 R872 L1049	T864-A868 PolarHBondContact O-N 2.86Å; K865-A868 WeakPolarHBondContact O-CB 3.1Å; K865-A868 PolarHBondContact O-N 2.71Å; K865-A868 VanDerWaalsContact O-N 3.09Å; R866-A868 VanDerWaalsContact C-N 3.32Å; R866-A868 PolarHBondContact O-N 2.94Å; A868-L871 PolarHBondContact O-N 2.79Å; A868-R872 WeakPolarHBondContact O-CG 3.23Å; A868-R872 PolarHBondContact O-N 2.64Å; A868-R872 VanDerWaalsContact O-N 3.12Å; A868-L1049 HydrophobicContact CB-CD2 4.3Å
869	V	90.7	Very high	86.6	Confident	11 Å²	11	42.5 Å²	42.5	7%	0.067	22%	0.215	C	C	.	.	H	α-helix	trans	-64.1	-46.3	177.4	175.1	0	0	0	0	111.1	L824 N827 K865 R866 L871 R872 L873	L824-V869 HydrophobicContact CB-CG1 4.39Å; L824-V869 HydrophobicContact CD2-CG1 4.3Å; L824-V869 WeakPolarHBondContact O-CG1 3.31Å; N827-V869 HydrophobicContact CB-CG1 4.34Å; N827-V869 HydrophobicContact CB-CG2 4.17Å; K865-V869 WeakPolarHBondContact O-CG2 3.49Å; K865-V869 PolarHBondContact O-N 3.07Å; R866-V869 PolarHBondContact O-N 3.36Å; V869-L871 VanDerWaalsContact C-N 3.35Å; V869-L871 PolarHBondContact O-N 2.85Å; V869-R872 WeakPolarHBondContact O-CB 3.37Å; V869-R872 PolarHBondContact O-N 2.86Å; V869-R872 VanDerWaalsContact O-N 3.11Å; V869-L873 HydrophobicContact CG1-CD1 4.21Å; V869-L873 PolarHBondContact O-N 3.09Å
870	L	93.5	Very high	87.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-38.7	178.1	-75.3	174	0	0	0	112.7	Y828 R866 R872 L873 F874 I889 M892 M893	Y828-L870 HydrophobicContact CD2-CD1 4.3Å; Y828-L870 HydrophobicContact CD2-CD2 3.72Å; Y828-L870 HydrophobicContact CD2-CG 3.84Å; Y828-L870 HydrophobicContact CE2-CD1 3.85Å; Y828-L870 HydrophobicContact CE2-CD2 3.64Å; Y828-L870 HydrophobicContact CE2-CG 3.85Å; Y828-L870 HydrophobicContact CG-CD2 4.37Å; R866-L870 HydrophobicContact CG-CD1 4.04Å; R866-L870 HydrophobicContact CG-CG 4.49Å; R866-L870 WeakPolarHBondContact O-CB 3.47Å; R866-L870 WeakPolarHBondContact O-CG 3.43Å; R866-L870 PolarHBondContact O-N 3.25Å; L870-R872 VanDerWaalsContact C-N 3.3Å; L870-R872 PolarHBondContact O-N 2.58Å; L870-L873 PolarHBondContact O-N 3.42Å; L870-F874 VanDerWaalsContact O-CB 3.26Å; L870-F874 WeakPolarHBondContact O-CB 3.27Å; L870-F874 PolarHBondContact O-N 3.05Å; L870-I889 HydrophobicContact CD2-CG2 4.09Å; L870-I889 WeakPolarHBondContact O-CG2 3.34Å; L870-M892 HydrophobicContact CD1-CB 4.47Å; L870-M892 HydrophobicContact CD2-CB 4.02Å; L870-M892 HydrophobicContact CD2-CE 4.2Å; L870-M893 HydrophobicContact CB-CE 4.5Å; L870-M893 HydrophobicContact CB-CG 4.27Å; L870-M893 HydrophobicContact CD1-CG 4.25Å
871	L	93.5	Very high	88.7	Confident	18 Å²	18	48.1 Å²	48.1	9%	0.094	24%	0.237	C	C	.	.	H	α-helix	trans	-64.4	-35.1	174.3	-76.9	170.9	0	0	0	112.1	K867 A868 V869 A875 M893 T898 L901 A902	K867-L871 WeakPolarHBondContact O-CB 3.28Å; K867-L871 WeakPolarHBondContact O-CG 3.4Å; K867-L871 PolarHBondContact O-N 3.38Å; A868-L871 PolarHBondContact O-N 2.79Å; V869-L871 VanDerWaalsContact C-N 3.35Å; V869-L871 PolarHBondContact O-N 2.85Å; L871-A875 WeakPolarHBondContact O-CB 3.16Å; L871-A875 PolarHBondContact O-N 2.94Å; L871-M893 HydrophobicContact CD2-CE 4Å; L871-T898 HydrophobicContact CD1-CG2 4.1Å; L871-T898 HydrophobicContact CD2-CG2 3.99Å; L871-T898 HydrophobicContact CG-CG2 3.85Å; L871-L901 HydrophobicContact CD1-CD1 4.13Å; L871-L901 HydrophobicContact CD2-CB 4.1Å; L871-A902 HydrophobicContact CD2-CB 4.43Å
872	R	91.8	Very high	89.6	Confident	98 Å²	98	44.7 Å²	44.7	37%	0.37	23%	0.228	S	C	.	.	H	α-helix	trans	-71.5	-44	175.6	-71.5	174.4	178.8	-172.2	-0.1	112.3	N779 L824 A868 V869 L870 F874 A875 L876	N779-R872 VanDerWaalsContact CG-NH1 3.31Å; N779-R872 PolarHBondContact OD1-NH1 3.19Å; L824-R872 HydrophobicContact CD1-CB 4.01Å; L824-R872 HydrophobicContact CD2-CB 4.09Å; A868-R872 WeakPolarHBondContact O-CG 3.23Å; A868-R872 PolarHBondContact O-N 2.64Å; A868-R872 VanDerWaalsContact O-N 3.12Å; V869-R872 WeakPolarHBondContact O-CB 3.37Å; V869-R872 PolarHBondContact O-N 2.86Å; V869-R872 VanDerWaalsContact O-N 3.11Å; L870-R872 VanDerWaalsContact C-N 3.3Å; L870-R872 PolarHBondContact O-N 2.58Å; R872-F874 VanDerWaalsContact C-N 3.29Å; R872-F874 PolarHBondContact O-N 2.8Å; R872-A875 PolarHBondContact O-N 2.89Å; R872-L876 PolarHBondContact O-N 3.21Å
873	L	92.5	Very high	90.4	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-57.3	-45.6	172	-78.4	171.1	0	0	0	110.8	L824 E825 V869 L870 A875 L876 A877 I889	L824-L873 HydrophobicContact CB-CD1 4.38Å; L824-L873 HydrophobicContact CB-CD2 3.43Å; L824-L873 VanDerWaalsContact CB-CD2 3.43Å; L824-L873 HydrophobicContact CB-CG 3.72Å; L824-L873 HydrophobicContact CD1-CD2 4.08Å; L824-L873 HydrophobicContact CD1-CG 4.31Å; L824-L873 HydrophobicContact CG-CD2 4.42Å; E825-L873 HydrophobicContact CG-CD1 4.45Å; E825-L873 HydrophobicContact CG-CD2 4Å; V869-L873 HydrophobicContact CG1-CD1 4.21Å; V869-L873 PolarHBondContact O-N 3.09Å; L870-L873 PolarHBondContact O-N 3.42Å; L873-A875 VanDerWaalsContact C-N 3.34Å; L873-A875 PolarHBondContact O-N 2.86Å; L873-L876 PolarHBondContact O-N 2.79Å; L873-A877 PolarHBondContact O-N 3.18Å; L873-I889 HydrophobicContact CB-CD1 4Å; L873-I889 HydrophobicContact CB-CG1 4.46Å; L873-I889 HydrophobicContact CB-CG2 4.1Å
874	F	95.7	Very high	90.9	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.009	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-45.2	175.9	177.5	-92.4	0	0	0	111.2	L870 R872 L876 A877 A878 S886 I889 M893 A902 Y905 A906 L918	L870-F874 VanDerWaalsContact O-CB 3.26Å; L870-F874 WeakPolarHBondContact O-CB 3.27Å; L870-F874 PolarHBondContact O-N 3.05Å; R872-F874 VanDerWaalsContact C-N 3.29Å; R872-F874 PolarHBondContact O-N 2.8Å; F874-L876 VanDerWaalsContact C-N 3.3Å; F874-L876 PolarHBondContact O-N 3.31Å; F874-A877 PolarHBondContact O-N 2.8Å; F874-A878 HydrophobicContact CE1-CB 4.24Å; F874-A878 HydrophobicContact CZ-CB 4.44Å; F874-A878 WeakPolarHBondContact O-CB 3.44Å; F874-A878 PolarHBondContact O-N 3.18Å; F874-S886 WeakPolarHBondContact CD2-O 3.44Å; F874-I889 HydrophobicContact CB-CG2 3.89Å; F874-M893 HydrophobicContact CB-CE 3.75Å; F874-M893 HydrophobicContact CD2-CE 4.3Å; F874-M893 HydrophobicContact CG-CE 4.05Å; F874-A902 HydrophobicContact CD1-CB 3.75Å; F874-A902 HydrophobicContact CD2-CB 4.19Å; F874-A902 HydrophobicContact CE1-CB 3.59Å; F874-A902 WeakPolarHBondContact CE1-O 3.28Å; F874-A902 HydrophobicContact CE2-CB 4.05Å; F874-A902 HydrophobicContact CG-CB 4.06Å; F874-A902 HydrophobicContact CZ-CB 3.76Å; F874-Y905 HydrophobicContact CD1-CD1 4.24Å; F874-Y905 AromaticContact CE1-CD1 3.97Å; F874-Y905 HydrophobicContact CE1-CD1 3.97Å; F874-A906 HydrophobicContact CZ-CB 4.29Å; F874-L918 HydrophobicContact CE2-CD1 3.65Å; F874-L918 HydrophobicContact CE2-CD2 4.06Å; F874-L918 HydrophobicContact CZ-CD1 3.44Å; F874-L918 VanDerWaalsContact CZ-CD1 3.44Å
875	A	93.4	Very high	91.3	Very high	13 Å²	13	50.6 Å²	50.6	11%	0.107	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-36.9	178.4	0	0	0	0	0	112.6	L871 R872 L873 K879 Y905	L871-A875 WeakPolarHBondContact O-CB 3.16Å; L871-A875 PolarHBondContact O-N 2.94Å; R872-A875 PolarHBondContact O-N 2.89Å; L873-A875 VanDerWaalsContact C-N 3.34Å; L873-A875 PolarHBondContact O-N 2.86Å; A875-K879 WeakPolarHBondContact O-CB 3.25Å; A875-K879 WeakPolarHBondContact O-CG 3.14Å; A875-K879 PolarHBondContact O-N 2.94Å; A875-K879 VanDerWaalsContact O-N 3.11Å; A875-Y905 HydrophobicContact CB-CD1 4.44Å; A875-Y905 HydrophobicContact CB-CE1 3.73Å
876	L	91.9	Very high	91.9	Very high	46 Å²	46	47.4 Å²	47.4	24%	0.241	23%	0.23	C	C	.	.	H	α-helix	trans	-68	-50.7	176	-169	151.8	0	0	0	111	D820 Q821 R872 L873 F874 A878 K879 L880	D820-L876 HydrophobicContact CB-CD1 4.45Å; Q821-L876 HydrophobicContact CB-CD1 4.45Å; Q821-L876 HydrophobicContact CB-CD2 4.39Å; R872-L876 PolarHBondContact O-N 3.21Å; L873-L876 PolarHBondContact O-N 2.79Å; F874-L876 VanDerWaalsContact C-N 3.3Å; F874-L876 PolarHBondContact O-N 3.31Å; L876-A878 VanDerWaalsContact C-N 3.32Å; L876-A878 PolarHBondContact O-N 2.84Å; L876-K879 PolarHBondContact O-N 2.97Å; L876-L880 HydrophobicContact CD2-CD1 3.58Å; L876-L880 HydrophobicContact CD2-CG 4.29Å; L876-L880 WeakPolarHBondContact O-CG 3.32Å; L876-L880 PolarHBondContact O-N 2.76Å
877	A	93.2	Very high	92.3	Very high	7 Å²	7	48.2 Å²	48.2	6%	0.058	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-39.1	177.1	0	0	0	0	0	112.8	L873 F874 K879 L880 E881 S882 A885 I889	L873-A877 PolarHBondContact O-N 3.18Å; F874-A877 PolarHBondContact O-N 2.8Å; A877-K879 VanDerWaalsContact C-N 3.35Å; A877-L880 PolarHBondContact O-N 2.71Å; A877-E881 PolarHBondContact O-N 2.71Å; A877-S882 PolarHBondContact O-N 3.12Å; A877-S882 VanDerWaalsContact O-N 3.14Å; A877-A885 HydrophobicContact CB-CB 4.03Å; A877-I889 HydrophobicContact CB-CD1 3.69Å
878	A	91.6	Very high	92.5	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.017	24%	0.238	C	C	.	.	H	α-helix	trans	-68.6	-33.1	178.2	0	0	0	0	0	112.4	F874 L876 S886 Y905 L909 R911	F874-A878 HydrophobicContact CE1-CB 4.24Å; F874-A878 HydrophobicContact CZ-CB 4.44Å; F874-A878 WeakPolarHBondContact O-CB 3.44Å; F874-A878 PolarHBondContact O-N 3.18Å; L876-A878 VanDerWaalsContact C-N 3.32Å; L876-A878 PolarHBondContact O-N 2.84Å; A878-S886 PolarHBondContact N-OG 2.84Å; A878-Y905 HydrophobicContact CB-CE1 4.3Å; A878-L909 HydrophobicContact CB-CD1 3.93Å; A878-R911 PolarHBondContact O-NH1 3.18Å
879	K	90.9	Very high	92.7	Very high	95 Å²	95	46.9 Å²	46.9	41%	0.413	23%	0.233	S	C	.	.	H	α-helix	trans	-72.4	-34.9	173.2	-77.9	175.9	-172.4	-177.9	0	112.7	A875 L876 A877 E881 Y905	A875-K879 WeakPolarHBondContact O-CB 3.25Å; A875-K879 WeakPolarHBondContact O-CG 3.14Å; A875-K879 PolarHBondContact O-N 2.94Å; A875-K879 VanDerWaalsContact O-N 3.11Å; L876-K879 PolarHBondContact O-N 2.97Å; A877-K879 VanDerWaalsContact C-N 3.35Å; K879-E881 PolarHBondContact O-N 3.24Å; K879-Y905 WeakPolarHBondContact CE-OH 3.43Å
880	L	91.9	Very high	92.9	Very high	118 Å²	118	46.4 Å²	46.4	62%	0.618	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	11.1	174.7	-67	-179.8	0	0	0	113.5	L876 A877 S882	L876-L880 HydrophobicContact CD2-CD1 3.58Å; L876-L880 HydrophobicContact CD2-CG 4.29Å; L876-L880 WeakPolarHBondContact O-CG 3.32Å; L876-L880 PolarHBondContact O-N 2.76Å; A877-L880 PolarHBondContact O-N 2.71Å; L880-S882 PolarHBondContact O-N 3.07Å
881	E	90.2	Very high	92.9	Very high	155 Å²	155	50.5 Å²	50.5	72%	0.724	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	14.7	179.8	-59.6	-169.6	170.2	0	0	115.3	A877 K879 D883 R911	A877-E881 PolarHBondContact O-N 2.71Å; K879-E881 PolarHBondContact O-N 3.24Å; E881-D883 PolarHBondContact O-N 3.25Å; E881-R911 VanDerWaalsContact C-NH2 3.27Å; E881-R911 PolarHBondContact O-NH2 3.04Å
882	S	93.3	Very high	92.8	Very high	47 Å²	47	53.3 Å²	53.3	33%	0.329	27%	0.265	S	S	.	.			trans	-85.8	98.2	180	-175.3	0	0	0	0	112.1	A877 L880 A885 S886	A877-S882 PolarHBondContact O-N 3.12Å; A877-S882 VanDerWaalsContact O-N 3.14Å; L880-S882 PolarHBondContact O-N 3.07Å; S882-A885 VanDerWaalsContact OG-CB 3.26Å; S882-A885 WeakPolarHBondContact OG-CB 3.43Å; S882-A885 PolarHBondContact OG-N 3.3Å; S882-S886 WeakPolarHBondContact O-CB 3.47Å; S882-S886 PolarHBondContact O-N 3.45Å; S882-S886 VanDerWaalsContact O-N 3.11Å; S882-S886 PolarHBondContact O-OG 3.34Å
883	D	90.5	Very high	92.9	Very high	48 Å²	48	48.9 Å²	48.9	26%	0.257	25%	0.249	S	C	.	.	H	α-helix	trans	-64.4	-42	179.1	-80.7	-22.8	0	0	0	112.6	E881 S886 L887 R911 L914 R917	E881-D883 PolarHBondContact O-N 3.25Å; D883-S886 PolarHBondContact O-N 2.95Å; D883-L887 WeakPolarHBondContact O-CB 3.2Å; D883-L887 PolarHBondContact O-N 3.39Å; D883-R911 VanDerWaalsContact CG-NH2 3.32Å; D883-R911 IonicContact OD1-CZ 3.04Å; D883-R911 VanDerWaalsContact OD1-CZ 3.24Å; D883-R911 IonicContact OD1-NE 3.48Å; D883-R911 IonicContact OD1-NH1 3.2Å; D883-R911 IonicContact OD1-NH2 2.69Å; D883-R911 PolarHBondContact OD1-NH2 2.69Å; D883-R911 IonicContact OD2-NH2 3.63Å; D883-L914 HydrophobicContact CB-CD1 4.5Å; D883-R917 IonicContact OD1-NH2 3.66Å; D883-R917 IonicContact OD2-CZ 2.82Å; D883-R917 IonicContact OD2-NH2 3.66Å; D883-R917 PolarHBondContact OD2-NH2 3.35Å
884	W	92.2	Very high	92.6	Very high	200 Å²	200	50.9 Å²	50.9	76%	0.758	26%	0.262	S	S	*	.	H	α-helix	trans	-66.7	-45.9	-178.3	177.5	91.2	0	0	0	111.4	S886 L887 A888	W884-S886 VanDerWaalsContact C-N 3.32Å; W884-S886 PolarHBondContact O-N 3.1Å; W884-L887 WeakPolarHBondContact O-CB 3.02Å; W884-L887 PolarHBondContact O-N 3.15Å; W884-A888 WeakPolarHBondContact O-CB 3.29Å; W884-A888 PolarHBondContact O-N 3.28Å
885	A	93.1	Very high	92.3	Very high	25 Å²	25	53 Å²	53	21%	0.207	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-41.1	177.4	0	0	0	0	0	111.2	A877 S882 L887 A888 I889	A877-A885 HydrophobicContact CB-CB 4.03Å; S882-A885 VanDerWaalsContact OG-CB 3.26Å; S882-A885 WeakPolarHBondContact OG-CB 3.43Å; S882-A885 PolarHBondContact OG-N 3.3Å; A885-L887 VanDerWaalsContact C-N 3.33Å; A885-L887 PolarHBondContact O-N 2.84Å; A885-A888 PolarHBondContact O-N 3.42Å; A885-I889 WeakPolarHBondContact O-CD1 3.29Å; A885-I889 VanDerWaalsContact O-CG1 3.23Å; A885-I889 WeakPolarHBondContact O-CG1 3.41Å; A885-I889 PolarHBondContact O-N 2.95Å
886	S	93.5	Very high	92.2	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-42.4	175	-59.2	0	0	0	0	112	F874 A878 S882 D883 W884 A890	F874-S886 WeakPolarHBondContact CD2-O 3.44Å; A878-S886 PolarHBondContact N-OG 2.84Å; S882-S886 WeakPolarHBondContact O-CB 3.47Å; S882-S886 PolarHBondContact O-N 3.45Å; S882-S886 VanDerWaalsContact O-N 3.11Å; S882-S886 PolarHBondContact O-OG 3.34Å; D883-S886 PolarHBondContact O-N 2.95Å; W884-S886 VanDerWaalsContact C-N 3.32Å; W884-S886 PolarHBondContact O-N 3.1Å; S886-A890 WeakPolarHBondContact O-CB 3.42Å; S886-A890 PolarHBondContact O-N 3.22Å
887	L	94	Very high	92.2	Very high	44 Å²	44	53.8 Å²	53.8	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-44.2	176.4	-166.7	85.2	0	0	0	111.7	D883 W884 A885 I889 A890 N891 R917 V921	D883-L887 WeakPolarHBondContact O-CB 3.2Å; D883-L887 PolarHBondContact O-N 3.39Å; W884-L887 WeakPolarHBondContact O-CB 3.02Å; W884-L887 PolarHBondContact O-N 3.15Å; A885-L887 VanDerWaalsContact C-N 3.33Å; A885-L887 PolarHBondContact O-N 2.84Å; L887-I889 PolarHBondContact O-N 2.85Å; L887-A890 PolarHBondContact O-N 2.82Å; L887-N891 PolarHBondContact O-N 2.92Å; L887-N891 PolarHBondContact O-ND2 3.15Å; L887-R917 HydrophobicContact CD1-CB 4.03Å; L887-V921 HydrophobicContact CD1-CG2 4.02Å
888	A	94.9	Very high	92.2	Very high	32 Å²	32	53.7 Å²	53.7	26%	0.264	29%	0.285	S	S	.	.	H	α-helix	trans	-59.8	-45.9	177.1	0	0	0	0	0	111.4	W884 A885 A890 N891 M892	W884-A888 WeakPolarHBondContact O-CB 3.29Å; W884-A888 PolarHBondContact O-N 3.28Å; A885-A888 PolarHBondContact O-N 3.42Å; A888-A890 PolarHBondContact O-N 2.86Å; A888-N891 WeakPolarHBondContact O-CB 3.43Å; A888-N891 PolarHBondContact O-N 3.26Å; A888-M892 WeakPolarHBondContact O-CG 3.12Å; A888-M892 PolarHBondContact O-N 3.28Å
889	I	94.8	Very high	92.4	Very high	17 Å²	17	53.6 Å²	53.6	9%	0.087	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-40.4	176.5	-63.2	158.7	0	0	0	111.4	L870 L873 F874 A877 A885 L887 N891 M892 M893	L870-I889 HydrophobicContact CD2-CG2 4.09Å; L870-I889 WeakPolarHBondContact O-CG2 3.34Å; L873-I889 HydrophobicContact CB-CD1 4Å; L873-I889 HydrophobicContact CB-CG1 4.46Å; L873-I889 HydrophobicContact CB-CG2 4.1Å; F874-I889 HydrophobicContact CB-CG2 3.89Å; A877-I889 HydrophobicContact CB-CD1 3.69Å; A885-I889 WeakPolarHBondContact O-CD1 3.29Å; A885-I889 VanDerWaalsContact O-CG1 3.23Å; A885-I889 WeakPolarHBondContact O-CG1 3.41Å; A885-I889 PolarHBondContact O-N 2.95Å; L887-I889 PolarHBondContact O-N 2.85Å; I889-N891 VanDerWaalsContact C-N 3.31Å; I889-N891 PolarHBondContact O-N 3.26Å; I889-M892 HydrophobicContact CB-CE 4.21Å; I889-M892 HydrophobicContact CG1-CE 3.9Å; I889-M892 WeakPolarHBondContact O-CB 3.37Å; I889-M892 PolarHBondContact O-N 2.73Å; I889-M892 VanDerWaalsContact O-N 3.13Å; I889-M893 HydrophobicContact CG2-CE 4.35Å; I889-M893 PolarHBondContact O-N 2.84Å
890	A	94.2	Very high	92.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-34.8	175.9	0	0	0	0	0	112.8	S886 L887 A888 M892 M893 L918 K925	S886-A890 WeakPolarHBondContact O-CB 3.42Å; S886-A890 PolarHBondContact O-N 3.22Å; L887-A890 PolarHBondContact O-N 2.82Å; A888-A890 PolarHBondContact O-N 2.86Å; A890-M892 VanDerWaalsContact C-N 3.28Å; A890-M892 PolarHBondContact O-N 3.09Å; A890-M893 WeakPolarHBondContact O-CB 3.46Å; A890-M893 PolarHBondContact O-N 2.76Å; A890-L918 HydrophobicContact CB-CD2 3.17Å; A890-K925 PolarHBondContact O-NZ 2.82Å
891	N	93.1	Very high	92.7	Very high	87 Å²	87	49.4 Å²	49.4	47%	0.465	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-34.7	172.9	-72.9	-27	0	0	0	111.7	L887 A888 I889 M893 V921 K925	L887-N891 PolarHBondContact O-N 2.92Å; L887-N891 PolarHBondContact O-ND2 3.15Å; A888-N891 WeakPolarHBondContact O-CB 3.43Å; A888-N891 PolarHBondContact O-N 3.26Å; I889-N891 VanDerWaalsContact C-N 3.31Å; I889-N891 PolarHBondContact O-N 3.26Å; N891-M893 VanDerWaalsContact C-N 3.32Å; N891-M893 PolarHBondContact O-N 2.85Å; N891-V921 VanDerWaalsContact OD1-CG1 3.24Å; N891-V921 WeakPolarHBondContact OD1-CG1 3.41Å; N891-V921 VanDerWaalsContact OD1-CG2 3.32Å; N891-V921 WeakPolarHBondContact OD1-CG2 3.23Å; N891-K925 PolarHBondContact O-NZ 2.81Å
892	M	91.8	Very high	92.9	Very high	77 Å²	77	42 Å²	42	38%	0.379	23%	0.23	S	C	.	.	H	α-helix	trans	-72.7	-16.3	176.2	-64	-170.9	-70.4	0	0	115	Y828 L870 A888 I889 A890	Y828-M892 HydrophobicContact CE1-SD 3.94Å; L870-M892 HydrophobicContact CD1-CB 4.47Å; L870-M892 HydrophobicContact CD2-CB 4.02Å; L870-M892 HydrophobicContact CD2-CE 4.2Å; A888-M892 WeakPolarHBondContact O-CG 3.12Å; A888-M892 PolarHBondContact O-N 3.28Å; I889-M892 HydrophobicContact CB-CE 4.21Å; I889-M892 HydrophobicContact CG1-CE 3.9Å; I889-M892 WeakPolarHBondContact O-CB 3.37Å; I889-M892 PolarHBondContact O-N 2.73Å; I889-M892 VanDerWaalsContact O-N 3.13Å; A890-M892 VanDerWaalsContact C-N 3.28Å; A890-M892 PolarHBondContact O-N 3.09Å
893	M	93.4	Very high	92.9	Very high	4 Å²	4	41 Å²	41	2%	0.02	22%	0.221	C	C	.	.			trans	-61.4	140.4	179.8	-66.9	178.3	179.4	0	0	112	L870 L871 F874 I889 A890 N891 D895 T898 V899 A902 K925	L870-M893 HydrophobicContact CB-CE 4.5Å; L870-M893 HydrophobicContact CB-CG 4.27Å; L870-M893 HydrophobicContact CD1-CG 4.25Å; L871-M893 HydrophobicContact CD2-CE 4Å; F874-M893 HydrophobicContact CB-CE 3.75Å; F874-M893 HydrophobicContact CD2-CE 4.3Å; F874-M893 HydrophobicContact CG-CE 4.05Å; I889-M893 HydrophobicContact CG2-CE 4.35Å; I889-M893 PolarHBondContact O-N 2.84Å; A890-M893 WeakPolarHBondContact O-CB 3.46Å; A890-M893 PolarHBondContact O-N 2.76Å; N891-M893 VanDerWaalsContact C-N 3.32Å; N891-M893 PolarHBondContact O-N 2.85Å; M893-D895 PolarHBondContact O-N 2.97Å; M893-T898 HydrophobicContact CB-CG2 4.23Å; M893-T898 HydrophobicContact CG-CG2 4.04Å; M893-T898 HydrophobicContact SD-CG2 3.76Å; M893-V899 HydrophobicContact CB-CG2 3.85Å; M893-V899 HydrophobicContact CG-CG2 4.47Å; M893-V899 HydrophobicContact SD-CB 4.5Å; M893-V899 HydrophobicContact SD-CG2 3.98Å; M893-A902 HydrophobicContact CE-CB 3.97Å; M893-A902 HydrophobicContact SD-CB 4.16Å; M893-K925 WeakPolarHBondContact O-CE 3.47Å; M893-K925 PolarHBondContact O-NZ 2.76Å
894	P	86.3	Confident	93	Very high	50 Å²	50	46.7 Å²	46.7	33%	0.325	24%	0.239	S	C	.	.	S	Bend	trans	-68.6	-36.7	-172.4	23	-32.4	0	0	0	114.1	L863 K867	L863-P894 HydrophobicContact CD1-CB 3.71Å; L863-P894 HydrophobicContact CD1-CG 3.7Å; K867-P894 HydrophobicContact CD-CG 4.21Å; K867-P894 HydrophobicContact CG-CG 3.58Å
895	D	89.4	Confident	93.1	Very high	47 Å²	47	38.7 Å²	38.7	25%	0.251	21%	0.209	S	C	.	.	S	Bend	trans	-136.8	159.3	-170.7	58.9	-15	0	0	0	112.2	K867 M893 A897 T898 V899	K867-D895 VanDerWaalsContact CE-OD1 3.26Å; K867-D895 WeakPolarHBondContact CE-OD1 3.5Å; K867-D895 WeakPolarHBondContact CE-OD2 3.45Å; K867-D895 IonicContact NZ-OD1 3.52Å; K867-D895 PolarHBondContact NZ-OD1 2.81Å; K867-D895 IonicContact NZ-OD2 3.27Å; K867-D895 PolarHBondContact NZ-OD2 3.22Å; M893-D895 PolarHBondContact O-N 2.97Å; D895-A897 VanDerWaalsContact C-N 3.26Å; D895-A897 PolarHBondContact O-N 2.97Å; D895-T898 PolarHBondContact O-N 3.02Å; D895-T898 WeakPolarHBondContact OD1-CB 3.44Å; D895-T898 PolarHBondContact OD1-N 2.78Å; D895-T898 PolarHBondContact OD1-OG1 3.29Å; D895-V899 PolarHBondContact O-N 3.03Å
896	A	92.1	Very high	93.1	Very high	12 Å²	12	37.5 Å²	37.5	10%	0.099	20%	0.199	C	C	.	.	H	α-helix	trans	-60.8	-35.6	178	0	0	0	0	0	112.3	T898 V899 Q900 K925 E926	A896-T898 VanDerWaalsContact C-N 3.33Å; A896-T898 PolarHBondContact O-N 2.78Å; A896-V899 CarbonylContact O-C 3.57Å; A896-V899 WeakPolarHBondContact O-CA 3.43Å; A896-V899 WeakPolarHBondContact O-CB 3.29Å; A896-V899 PolarHBondContact O-N 3.05Å; A896-V899 VanDerWaalsContact O-N 3.08Å; A896-Q900 WeakPolarHBondContact O-CG 3.48Å; A896-Q900 PolarHBondContact O-N 2.88Å; A896-K925 HydrophobicContact CB-CB 4.05Å; A896-E926 HydrophobicContact CB-CG 3.47Å; A896-E926 VanDerWaalsContact CB-CG 3.47Å
897	A	92.3	Very high	93.1	Very high	62 Å²	62	38.7 Å²	38.7	51%	0.512	21%	0.211	S	C	.	.	H	α-helix	trans	-59.5	-39.9	178.4	0	0	0	0	0	112.9	D895 Q900 L901	D895-A897 VanDerWaalsContact C-N 3.26Å; D895-A897 PolarHBondContact O-N 2.97Å; A897-Q900 WeakPolarHBondContact O-CB 3.48Å; A897-Q900 PolarHBondContact O-N 3.25Å; A897-L901 PolarHBondContact O-N 2.9Å
898	T	93.4	Very high	93	Very high	6 Å²	6	43.6 Å²	43.6	4%	0.037	23%	0.227	C	C	.	.	H	α-helix	trans	-68	-38.2	175.2	-56.2	0	0	0	0	111.1	K867 L871 M893 D895 A896 Q900 L901 A902	K867-T898 HydrophobicContact CB-CG2 4.34Å; K867-T898 WeakPolarHBondContact CD-OG1 3.28Å; K867-T898 WeakPolarHBondContact CE-OG1 3.35Å; K867-T898 HydrophobicContact CG-CG2 4.3Å; L871-T898 HydrophobicContact CD1-CG2 4.1Å; L871-T898 HydrophobicContact CD2-CG2 3.99Å; L871-T898 HydrophobicContact CG-CG2 3.85Å; M893-T898 HydrophobicContact CB-CG2 4.23Å; M893-T898 HydrophobicContact CG-CG2 4.04Å; M893-T898 HydrophobicContact SD-CG2 3.76Å; D895-T898 PolarHBondContact O-N 3.02Å; D895-T898 WeakPolarHBondContact OD1-CB 3.44Å; D895-T898 PolarHBondContact OD1-N 2.78Å; D895-T898 PolarHBondContact OD1-OG1 3.29Å; A896-T898 VanDerWaalsContact C-N 3.33Å; A896-T898 PolarHBondContact O-N 2.78Å; T898-Q900 VanDerWaalsContact C-N 3.32Å; T898-Q900 PolarHBondContact O-N 2.7Å; T898-L901 WeakPolarHBondContact O-CB 3.38Å; T898-L901 PolarHBondContact O-N 2.77Å; T898-A902 PolarHBondContact O-N 3.24Å
899	V	95.3	Very high	92.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-37	174.1	-177	0	0	0	0	111.4	M893 D895 A896 L901 A902 I903 V921 A922 K925	M893-V899 HydrophobicContact CB-CG2 3.85Å; M893-V899 HydrophobicContact CG-CG2 4.47Å; M893-V899 HydrophobicContact SD-CB 4.5Å; M893-V899 HydrophobicContact SD-CG2 3.98Å; D895-V899 PolarHBondContact O-N 3.03Å; A896-V899 CarbonylContact O-C 3.57Å; A896-V899 WeakPolarHBondContact O-CA 3.43Å; A896-V899 WeakPolarHBondContact O-CB 3.29Å; A896-V899 PolarHBondContact O-N 3.05Å; A896-V899 VanDerWaalsContact O-N 3.08Å; V899-L901 VanDerWaalsContact C-N 3.3Å; V899-L901 PolarHBondContact O-N 3.09Å; V899-A902 CarbonylContact O-C 3.58Å; V899-A902 WeakPolarHBondContact O-CA 3.32Å; V899-A902 VanDerWaalsContact O-CB 3.28Å; V899-A902 WeakPolarHBondContact O-CB 3.45Å; V899-A902 PolarHBondContact O-N 2.97Å; V899-I903 HydrophobicContact CG1-CD1 4.29Å; V899-I903 HydrophobicContact CG1-CG1 4.46Å; V899-I903 WeakPolarHBondContact O-CG1 3.42Å; V899-I903 PolarHBondContact O-N 2.61Å; V899-V921 HydrophobicContact CG1-CG1 4.48Å; V899-V921 HydrophobicContact CG2-CG1 4.49Å; V899-A922 HydrophobicContact CB-CB 4.25Å; V899-A922 HydrophobicContact CG1-CB 3.92Å; V899-K925 HydrophobicContact CG2-CD 4.02Å
900	Q	94.8	Very high	92.8	Very high	68 Å²	68	54.8 Å²	54.8	32%	0.318	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-35.8	175.7	-69.2	-70.1	-6.9	0	0	112.7	A896 A897 T898 A902 I903 R904	A896-Q900 WeakPolarHBondContact O-CG 3.48Å; A896-Q900 PolarHBondContact O-N 2.88Å; A897-Q900 WeakPolarHBondContact O-CB 3.48Å; A897-Q900 PolarHBondContact O-N 3.25Å; T898-Q900 VanDerWaalsContact C-N 3.32Å; T898-Q900 PolarHBondContact O-N 2.7Å; Q900-A902 VanDerWaalsContact C-N 3.34Å; Q900-I903 PolarHBondContact O-N 3Å; Q900-R904 WeakPolarHBondContact O-CG 3.23Å; Q900-R904 PolarHBondContact O-N 2.99Å
901	L	93.4	Very high	92.7	Very high	56 Å²	56	56.9 Å²	56.9	29%	0.293	27%	0.273	S	S	.	.	H	α-helix	trans	-64.6	-40.2	172.1	-65.2	173.9	0	0	0	111.4	L871 A897 T898 V899 R904 Y905	L871-L901 HydrophobicContact CD1-CD1 4.13Å; L871-L901 HydrophobicContact CD2-CB 4.1Å; A897-L901 PolarHBondContact O-N 2.9Å; T898-L901 WeakPolarHBondContact O-CB 3.38Å; T898-L901 PolarHBondContact O-N 2.77Å; V899-L901 VanDerWaalsContact C-N 3.3Å; V899-L901 PolarHBondContact O-N 3.09Å; L901-R904 PolarHBondContact O-N 2.83Å; L901-Y905 PolarHBondContact O-N 2.77Å
902	A	94.2	Very high	92.4	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-41	174.7	0	0	0	0	0	112.3	L871 F874 M893 T898 V899 Q900 Y905 A906	L871-A902 HydrophobicContact CD2-CB 4.43Å; F874-A902 HydrophobicContact CD1-CB 3.75Å; F874-A902 HydrophobicContact CD2-CB 4.19Å; F874-A902 HydrophobicContact CE1-CB 3.59Å; F874-A902 WeakPolarHBondContact CE1-O 3.28Å; F874-A902 HydrophobicContact CE2-CB 4.05Å; F874-A902 HydrophobicContact CG-CB 4.06Å; F874-A902 HydrophobicContact CZ-CB 3.76Å; M893-A902 HydrophobicContact CE-CB 3.97Å; M893-A902 HydrophobicContact SD-CB 4.16Å; T898-A902 PolarHBondContact O-N 3.24Å; V899-A902 CarbonylContact O-C 3.58Å; V899-A902 WeakPolarHBondContact O-CA 3.32Å; V899-A902 VanDerWaalsContact O-CB 3.28Å; V899-A902 WeakPolarHBondContact O-CB 3.45Å; V899-A902 PolarHBondContact O-N 2.97Å; Q900-A902 VanDerWaalsContact C-N 3.34Å; A902-Y905 PolarHBondContact O-N 3.22Å; A902-A906 WeakPolarHBondContact O-CB 3.34Å; A902-A906 PolarHBondContact O-N 2.64Å
903	I	93.9	Very high	92.4	Very high	26 Å²	26	60.9 Å²	60.9	13%	0.133	29%	0.293	C	S	.	.	H	α-helix	trans	-58.8	-48.6	173.9	-67.8	167.1	0	0	0	110.6	V899 Q900 Y905 A906 G907 A915 L918 A919 A922	V899-I903 HydrophobicContact CG1-CD1 4.29Å; V899-I903 HydrophobicContact CG1-CG1 4.46Å; V899-I903 WeakPolarHBondContact O-CG1 3.42Å; V899-I903 PolarHBondContact O-N 2.61Å; Q900-I903 PolarHBondContact O-N 3Å; I903-Y905 VanDerWaalsContact C-N 3.29Å; I903-Y905 PolarHBondContact O-N 3.16Å; I903-A906 PolarHBondContact O-N 2.85Å; I903-G907 PolarHBondContact O-N 3.31Å; I903-A915 HydrophobicContact CG2-CB 4.33Å; I903-L918 HydrophobicContact CD1-CB 4.25Å; I903-L918 HydrophobicContact CG1-CB 3.52Å; I903-A919 HydrophobicContact CD1-CB 4.21Å; I903-A922 HydrophobicContact CD1-CB 4.03Å
904	R	93.9	Very high	92.3	Very high	167 Å²	167	60.8 Å²	60.8	63%	0.63	29%	0.292	S	S	*	.	H	α-helix	trans	-59.7	-40.7	177.2	-70.3	175.1	-173.2	178.3	2.9	111.5	Q900 L901 G907 R908	Q900-R904 WeakPolarHBondContact O-CG 3.23Å; Q900-R904 PolarHBondContact O-N 2.99Å; L901-R904 PolarHBondContact O-N 2.83Å; R904-G907 PolarHBondContact O-N 2.85Å; R904-R908 WeakPolarHBondContact O-CG 3.37Å; R904-R908 PolarHBondContact O-N 3.09Å
905	Y	93.7	Very high	92.6	Very high	31 Å²	31	58.8 Å²	58.8	12%	0.122	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-46.2	177.4	-174	-98.2	0	0	0	112.4	F874 A875 A878 K879 L901 A902 I903 G907 R908 L909 L1050	F874-Y905 HydrophobicContact CD1-CD1 4.24Å; F874-Y905 AromaticContact CE1-CD1 3.97Å; F874-Y905 HydrophobicContact CE1-CD1 3.97Å; A875-Y905 HydrophobicContact CB-CD1 4.44Å; A875-Y905 HydrophobicContact CB-CE1 3.73Å; A878-Y905 HydrophobicContact CB-CE1 4.3Å; K879-Y905 WeakPolarHBondContact CE-OH 3.43Å; L901-Y905 PolarHBondContact O-N 2.77Å; A902-Y905 PolarHBondContact O-N 3.22Å; I903-Y905 VanDerWaalsContact C-N 3.29Å; I903-Y905 PolarHBondContact O-N 3.16Å; Y905-G907 VanDerWaalsContact C-N 3.27Å; Y905-G907 PolarHBondContact O-N 3.34Å; Y905-R908 WeakPolarHBondContact O-CB 3.21Å; Y905-R908 PolarHBondContact O-N 2.83Å; Y905-R908 VanDerWaalsContact O-N 3.12Å; Y905-L909 HydrophobicContact CD1-CD1 4Å; Y905-L909 HydrophobicContact CE1-CD1 3.43Å; Y905-L909 VanDerWaalsContact CE1-CD1 3.43Å; Y905-L909 HydrophobicContact CE1-CG 4.12Å; Y905-L909 PolarHBondContact O-N 3.32Å; Y905-L909 VanDerWaalsContact O-N 3.07Å; Y905-L1050 HydrophobicContact CD2-CD2 3.9Å; Y905-L1050 HydrophobicContact CE2-CD2 4.14Å
906	A	93.3	Very high	92.9	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-37.7	174.5	0	0	0	0	0	112.3	F874 A902 I903 L909 R910 R911 L914 A915 L918	F874-A906 HydrophobicContact CZ-CB 4.29Å; A902-A906 WeakPolarHBondContact O-CB 3.34Å; A902-A906 PolarHBondContact O-N 2.64Å; I903-A906 PolarHBondContact O-N 2.85Å; A906-L909 CarbonylContact O-C 3.53Å; A906-L909 PolarHBondContact O-N 2.98Å; A906-R910 PolarHBondContact O-N 2.84Å; A906-R911 PolarHBondContact O-N 2.86Å; A906-L914 HydrophobicContact CB-CD2 4.32Å; A906-L914 HydrophobicContact CB-CG 4.42Å; A906-A915 HydrophobicContact CB-CB 4.16Å; A906-L918 HydrophobicContact CB-CD1 4.15Å
907	G	92.3	Very high	93	Very high	25 Å²	25	68.2 Å²	68.2	26%	0.258	32%	0.315	S	S	.	.	H	α-helix	trans	-62.1	-42.5	172.9	0	0	0	0	0	112.9	I903 R904 Y905 L909 R910	I903-G907 PolarHBondContact O-N 3.31Å; R904-G907 PolarHBondContact O-N 2.85Å; Y905-G907 VanDerWaalsContact C-N 3.27Å; Y905-G907 PolarHBondContact O-N 3.34Å; G907-L909 VanDerWaalsContact C-N 3.29Å; G907-L909 PolarHBondContact O-N 3.03Å; G907-R910 WeakPolarHBondContact O-CA 3.36Å; G907-R910 PolarHBondContact O-N 2.87Å
908	R	92.6	Very high	93.1	Very high	147 Å²	147	65.3 Å²	65.3	56%	0.555	29%	0.291	S	S	*	.	H	α-helix	trans	-62.7	-34.9	174.3	-71.5	-179	-171.8	-175	1.8	112.3	R904 Y905 R910 D1051	R904-R908 WeakPolarHBondContact O-CG 3.37Å; R904-R908 PolarHBondContact O-N 3.09Å; Y905-R908 WeakPolarHBondContact O-CB 3.21Å; Y905-R908 PolarHBondContact O-N 2.83Å; Y905-R908 VanDerWaalsContact O-N 3.12Å; R908-R910 PolarHBondContact O-N 3.07Å; R908-D1051 IonicContact NH1-OD1 3.91Å
909	L	93.2	Very high	93.1	Very high	65 Å²	65	66.6 Å²	66.6	34%	0.34	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	5.9	172.8	-66.2	-179.8	0	0	0	113.7	A878 Y905 A906 G907 R911	A878-L909 HydrophobicContact CB-CD1 3.93Å; Y905-L909 HydrophobicContact CD1-CD1 4Å; Y905-L909 HydrophobicContact CE1-CD1 3.43Å; Y905-L909 VanDerWaalsContact CE1-CD1 3.43Å; Y905-L909 HydrophobicContact CE1-CG 4.12Å; Y905-L909 PolarHBondContact O-N 3.32Å; Y905-L909 VanDerWaalsContact O-N 3.07Å; A906-L909 CarbonylContact O-C 3.53Å; A906-L909 PolarHBondContact O-N 2.98Å; G907-L909 VanDerWaalsContact C-N 3.29Å; G907-L909 PolarHBondContact O-N 3.03Å; L909-R911 HydrophobicContact CB-CG 4.29Å; L909-R911 PolarHBondContact O-N 3.01Å
910	R	92	Very high	93	Very high	219 Å²	219	68.6 Å²	68.6	83%	0.826	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	21.8	-177.8	-55	-178.5	180	-175.3	-0.3	114.3	A906 G907 R908 Q912	A906-R910 PolarHBondContact O-N 2.84Å; G907-R910 WeakPolarHBondContact O-CA 3.36Å; G907-R910 PolarHBondContact O-N 2.87Å; R908-R910 PolarHBondContact O-N 3.07Å; R910-Q912 PolarHBondContact O-N 2.85Å
911	R	91.4	Very high	92.9	Very high	44 Å²	44	66.2 Å²	66.2	17%	0.166	31%	0.313	C	S	.	.			trans	-94	70.9	178.5	-60.7	-172.4	73.1	-175.5	8.6	111.3	A878 E881 D883 A906 L909 N913 L914 A915	A878-R911 PolarHBondContact O-NH1 3.18Å; E881-R911 VanDerWaalsContact C-NH2 3.27Å; E881-R911 PolarHBondContact O-NH2 3.04Å; D883-R911 VanDerWaalsContact CG-NH2 3.32Å; D883-R911 IonicContact OD1-CZ 3.04Å; D883-R911 VanDerWaalsContact OD1-CZ 3.24Å; D883-R911 IonicContact OD1-NE 3.48Å; D883-R911 IonicContact OD1-NH1 3.2Å; D883-R911 IonicContact OD1-NH2 2.69Å; D883-R911 PolarHBondContact OD1-NH2 2.69Å; D883-R911 IonicContact OD2-NH2 3.63Å; A906-R911 PolarHBondContact O-N 2.86Å; L909-R911 HydrophobicContact CB-CG 4.29Å; L909-R911 PolarHBondContact O-N 3.01Å; R911-N913 PolarHBondContact O-N 2.93Å; R911-L914 HydrophobicContact CB-CB 4.12Å; R911-L914 PolarHBondContact O-N 2.7Å; R911-A915 PolarHBondContact O-N 3.32Å
912	Q	88.1	Confident	92.9	Very high	120 Å²	120	63.6 Å²	63.6	56%	0.561	30%	0.3	S	S	*	.	H	α-helix	trans	-63.4	-37.3	-173.1	-58.5	-57.8	-24.6	0	0	113.5	R910 L914 A915 H916	R910-Q912 PolarHBondContact O-N 2.85Å; Q912-L914 VanDerWaalsContact C-N 3.33Å; Q912-L914 PolarHBondContact O-N 2.71Å; Q912-A915 PolarHBondContact O-N 2.86Å; Q912-H916 WeakPolarHBondContact O-CB 3.21Å; Q912-H916 PolarHBondContact O-N 2.77Å
913	N	91.4	Very high	92.9	Very high	129 Å²	129	68.9 Å²	68.9	69%	0.69	33%	0.327	S	S	*	.	H	α-helix	trans	-65.5	-36.1	178	-67.8	-14.2	0	0	0	112.5	R911 R917	R911-N913 PolarHBondContact O-N 2.93Å; N913-R917 PolarHBondContact O-N 3.38Å
914	L	91.8	Very high	92.7	Very high	1 Å²	1	70.5 Å²	70.5	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-69.3	-47.6	173.8	177.8	60	0	0	0	110.1	D883 A906 R911 Q912 H916 R917 L918	D883-L914 HydrophobicContact CB-CD1 4.5Å; A906-L914 HydrophobicContact CB-CD2 4.32Å; A906-L914 HydrophobicContact CB-CG 4.42Å; R911-L914 HydrophobicContact CB-CB 4.12Å; R911-L914 PolarHBondContact O-N 2.7Å; Q912-L914 VanDerWaalsContact C-N 3.33Å; Q912-L914 PolarHBondContact O-N 2.71Å; L914-H916 VanDerWaalsContact C-N 3.27Å; L914-H916 PolarHBondContact O-N 3.21Å; L914-R917 PolarHBondContact O-N 3.32Å; L914-R917 VanDerWaalsContact O-N 3.14Å; L914-L918 HydrophobicContact CD1-CD1 4.22Å; L914-L918 HydrophobicContact CD1-CG 4.22Å; L914-L918 HydrophobicContact CG-CD1 3.94Å; L914-L918 HydrophobicContact CG-CG 4.4Å; L914-L918 VanDerWaalsContact O-CG 3.26Å; L914-L918 WeakPolarHBondContact O-CG 3.21Å; L914-L918 PolarHBondContact O-N 3.31Å
915	A	92.8	Very high	92.5	Very high	9 Å²	9	63.6 Å²	63.6	7%	0.074	31%	0.309	C	S	.	.	H	α-helix	trans	-56.5	-39.5	176.8	0	0	0	0	0	112.6	I903 A906 R911 Q912 L918 A919	I903-A915 HydrophobicContact CG2-CB 4.33Å; A906-A915 HydrophobicContact CB-CB 4.16Å; R911-A915 PolarHBondContact O-N 3.32Å; Q912-A915 PolarHBondContact O-N 2.86Å; A915-L918 PolarHBondContact O-N 2.89Å; A915-A919 PolarHBondContact O-N 3.04Å
916	H	93.9	Very high	92.4	Very high	148 Å²	148	66.2 Å²	66.2	69%	0.685	32%	0.322	S	S	*	.	H	α-helix	trans	-65.3	-44.4	175.6	-174	71	0	0	0	112.6	Q912 L914 L918 A919 G920	Q912-H916 WeakPolarHBondContact O-CB 3.21Å; Q912-H916 PolarHBondContact O-N 2.77Å; L914-H916 VanDerWaalsContact C-N 3.27Å; L914-H916 PolarHBondContact O-N 3.21Å; H916-L918 VanDerWaalsContact C-N 3.32Å; H916-L918 PolarHBondContact O-N 2.64Å; H916-A919 WeakPolarHBondContact O-CB 3.48Å; H916-A919 PolarHBondContact O-N 3.19Å; H916-G920 PolarHBondContact O-N 3.13Å
917	R	94.9	Very high	92.2	Very high	109 Å²	109	71.4 Å²	71.4	41%	0.411	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-38.8	175	-78.4	-174.2	-81.9	175.8	-7.3	112.3	D883 L887 N913 L914 A919 G920 V921	D883-R917 IonicContact OD1-NH2 3.66Å; D883-R917 IonicContact OD2-CZ 2.82Å; D883-R917 IonicContact OD2-NH2 3.66Å; D883-R917 PolarHBondContact OD2-NH2 3.35Å; L887-R917 HydrophobicContact CD1-CB 4.03Å; N913-R917 PolarHBondContact O-N 3.38Å; L914-R917 PolarHBondContact O-N 3.32Å; L914-R917 VanDerWaalsContact O-N 3.14Å; R917-A919 VanDerWaalsContact C-N 3.31Å; R917-A919 PolarHBondContact O-N 3.48Å; R917-G920 PolarHBondContact O-N 3Å; R917-V921 PolarHBondContact O-N 3.36Å
918	L	94.2	Very high	91.7	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-31.9	176	-67.9	170.9	0	0	0	112.7	F874 A890 I903 A906 L914 A915 H916 G920 V921 A922	F874-L918 HydrophobicContact CE2-CD1 3.65Å; F874-L918 HydrophobicContact CE2-CD2 4.06Å; F874-L918 HydrophobicContact CZ-CD1 3.44Å; F874-L918 VanDerWaalsContact CZ-CD1 3.44Å; A890-L918 HydrophobicContact CB-CD2 3.17Å; I903-L918 HydrophobicContact CD1-CB 4.25Å; I903-L918 HydrophobicContact CG1-CB 3.52Å; A906-L918 HydrophobicContact CB-CD1 4.15Å; L914-L918 HydrophobicContact CD1-CD1 4.22Å; L914-L918 HydrophobicContact CD1-CG 4.22Å; L914-L918 HydrophobicContact CG-CD1 3.94Å; L914-L918 HydrophobicContact CG-CG 4.4Å; L914-L918 VanDerWaalsContact O-CG 3.26Å; L914-L918 WeakPolarHBondContact O-CG 3.21Å; L914-L918 PolarHBondContact O-N 3.31Å; A915-L918 PolarHBondContact O-N 2.89Å; H916-L918 VanDerWaalsContact C-N 3.32Å; H916-L918 PolarHBondContact O-N 2.64Å; L918-G920 VanDerWaalsContact C-N 3.28Å; L918-G920 PolarHBondContact O-N 2.92Å; L918-V921 WeakPolarHBondContact O-CB 3.37Å; L918-V921 PolarHBondContact O-N 3.03Å; L918-V921 VanDerWaalsContact O-N 3.16Å; L918-A922 PolarHBondContact O-N 2.77Å
919	A	93.4	Very high	91	Very high	34 Å²	34	73.7 Å²	73.7	28%	0.281	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-37.3	173.1	0	0	0	0	0	111.9	I903 A915 H916 R917 V921 A922 L923	I903-A919 HydrophobicContact CD1-CB 4.21Å; A915-A919 PolarHBondContact O-N 3.04Å; H916-A919 WeakPolarHBondContact O-CB 3.48Å; H916-A919 PolarHBondContact O-N 3.19Å; R917-A919 VanDerWaalsContact C-N 3.31Å; R917-A919 PolarHBondContact O-N 3.48Å; A919-V921 PolarHBondContact O-N 3.4Å; A919-A922 PolarHBondContact O-N 2.88Å; A919-L923 WeakPolarHBondContact O-CG 3.49Å; A919-L923 PolarHBondContact O-N 3.16Å
920	G	93.5	Very high	89.9	Confident	42 Å²	42	73.9 Å²	73.9	43%	0.433	36%	0.359	S	S	.	.	H	α-helix	trans	-60.6	-42.2	171.9	0	0	0	0	0	112.9	H916 R917 L918 L923 E924	H916-G920 PolarHBondContact O-N 3.13Å; R917-G920 PolarHBondContact O-N 3Å; L918-G920 VanDerWaalsContact C-N 3.28Å; L918-G920 PolarHBondContact O-N 2.92Å; G920-L923 PolarHBondContact O-N 3.08Å; G920-E924 WeakPolarHBondContact O-CB 3.29Å; G920-E924 PolarHBondContact O-N 2.92Å
921	V	92.6	Very high	88.8	Confident	17 Å²	17	67.6 Å²	67.6	10%	0.103	34%	0.339	C	S	.	.	H	α-helix	trans	-65.1	-39	175.9	178.7	0	0	0	0	111.7	L887 N891 V899 R917 L918 A919 K925	L887-V921 HydrophobicContact CD1-CG2 4.02Å; N891-V921 VanDerWaalsContact OD1-CG1 3.24Å; N891-V921 WeakPolarHBondContact OD1-CG1 3.41Å; N891-V921 VanDerWaalsContact OD1-CG2 3.32Å; N891-V921 WeakPolarHBondContact OD1-CG2 3.23Å; V899-V921 HydrophobicContact CG1-CG1 4.48Å; V899-V921 HydrophobicContact CG2-CG1 4.49Å; R917-V921 PolarHBondContact O-N 3.36Å; L918-V921 WeakPolarHBondContact O-CB 3.37Å; L918-V921 PolarHBondContact O-N 3.03Å; L918-V921 VanDerWaalsContact O-N 3.16Å; A919-V921 PolarHBondContact O-N 3.4Å; V921-K925 HydrophobicContact CG1-CD 4.47Å; V921-K925 WeakPolarHBondContact O-CG 3.2Å; V921-K925 PolarHBondContact O-N 3.13Å; V921-K925 VanDerWaalsContact O-N 3.13Å
922	A	93.4	Very high	87.2	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.008	36%	0.357	C	S	.	.	H	α-helix	trans	-64.1	-46.5	176.6	0	0	0	0	0	111.7	V899 I903 L918 A919 E924 K925 E926	V899-A922 HydrophobicContact CB-CB 4.25Å; V899-A922 HydrophobicContact CG1-CB 3.92Å; I903-A922 HydrophobicContact CD1-CB 4.03Å; L918-A922 PolarHBondContact O-N 2.77Å; A919-A922 PolarHBondContact O-N 2.88Å; A922-E924 VanDerWaalsContact C-N 3.34Å; A922-E924 PolarHBondContact O-N 2.89Å; A922-K925 PolarHBondContact O-N 2.94Å; A922-K925 VanDerWaalsContact O-N 3.14Å; A922-E926 PolarHBondContact O-N 2.89Å
923	L	93.7	Very high	85.7	Confident	113 Å²	113	68.1 Å²	68.1	59%	0.592	36%	0.355	S	S	*	.	H	α-helix	trans	-59.9	-43.4	176.8	-73.2	171.6	0	0	0	111.9	A919 G920 K925 E926 R927	A919-L923 WeakPolarHBondContact O-CG 3.49Å; A919-L923 PolarHBondContact O-N 3.16Å; G920-L923 PolarHBondContact O-N 3.08Å; L923-K925 PolarHBondContact O-N 2.84Å; L923-E926 PolarHBondContact O-N 3.07Å; L923-R927 WeakPolarHBondContact O-CB 3.23Å; L923-R927 PolarHBondContact O-N 2.88Å
924	E	91	Very high	83.6	Confident	60 Å²	60	68.7 Å²	68.7	28%	0.28	35%	0.354	S	S	.	.	H	α-helix	trans	-66.5	-27.4	178.6	-178.7	48.8	-148.4	0	0	112.2	G920 A922 R927 R928	G920-E924 WeakPolarHBondContact O-CB 3.29Å; G920-E924 PolarHBondContact O-N 2.92Å; A922-E924 VanDerWaalsContact C-N 3.34Å; A922-E924 PolarHBondContact O-N 2.89Å; E924-R927 IonicContact OE1-CZ 3.66Å; E924-R927 IonicContact OE1-NE 3.34Å; E924-R927 IonicContact OE1-NH2 3.73Å; E924-R927 PolarHBondContact OE1-NH2 3.15Å; E924-R927 IonicContact OE2-CZ 2.59Å; E924-R927 IonicContact OE2-NE 3.61Å; E924-R927 PolarHBondContact OE2-NE 2.9Å; E924-R927 IonicContact OE2-NH2 3.63Å; E924-R928 WeakPolarHBondContact O-CG 3.09Å; E924-R928 PolarHBondContact O-N 2.8Å; E924-R928 PolarHBondContact O-NH1 3.25Å; E924-R928 IonicContact OE1-CZ 3.19Å; E924-R928 IonicContact OE1-NE 3.92Å; E924-R928 IonicContact OE1-NH1 3.57Å; E924-R928 IonicContact OE1-NH2 3.89Å; E924-R928 PolarHBondContact OE1-NH2 3.19Å
925	K	90.3	Very high	81.4	Confident	21 Å²	21	73.5 Å²	73.5	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-77.3	-38.7	172.1	-74.6	-179.6	-179.2	-178.9	0	112.9	A890 N891 M893 A896 V899 V921 A922 L923 R927 R928 V929	A890-K925 PolarHBondContact O-NZ 2.82Å; N891-K925 PolarHBondContact O-NZ 2.81Å; M893-K925 WeakPolarHBondContact O-CE 3.47Å; M893-K925 PolarHBondContact O-NZ 2.76Å; A896-K925 HydrophobicContact CB-CB 4.05Å; V899-K925 HydrophobicContact CG2-CD 4.02Å; V921-K925 HydrophobicContact CG1-CD 4.47Å; V921-K925 WeakPolarHBondContact O-CG 3.2Å; V921-K925 PolarHBondContact O-N 3.13Å; V921-K925 VanDerWaalsContact O-N 3.13Å; A922-K925 PolarHBondContact O-N 2.94Å; A922-K925 VanDerWaalsContact O-N 3.14Å; L923-K925 PolarHBondContact O-N 2.84Å; K925-R927 VanDerWaalsContact C-N 3.32Å; K925-R928 PolarHBondContact O-N 3.16Å; K925-V929 WeakPolarHBondContact O-CG2 3.42Å; K925-V929 PolarHBondContact O-N 3.13Å
926	E	90.3	Very high	78.8	Confident	87 Å²	87	79 Å²	79	41%	0.407	41%	0.412	S	S	.	.	H	α-helix	trans	-62.1	-42.5	172.7	-70.5	171.6	-175.8	0	0	110.8	A896 A922 L923 R928 V929 S930	A896-E926 HydrophobicContact CB-CG 3.47Å; A896-E926 VanDerWaalsContact CB-CG 3.47Å; A922-E926 PolarHBondContact O-N 2.89Å; L923-E926 PolarHBondContact O-N 3.07Å; E926-R928 PolarHBondContact O-N 3.06Å; E926-V929 PolarHBondContact O-N 3.2Å; E926-V929 VanDerWaalsContact O-N 3.17Å; E926-S930 PolarHBondContact O-N 3.37Å; E926-S930 PolarHBondContact O-OG 3.5Å
927	R	89.7	Confident	76.1	Confident	109 Å²	109	77.9 Å²	77.9	41%	0.411	41%	0.41	S	S	.	.	H	α-helix	trans	-58	-46.2	175.9	-165.6	-175.6	72.6	71.9	14.8	112.4	L923 E924 K925 V929 S930 E931	L923-R927 WeakPolarHBondContact O-CB 3.23Å; L923-R927 PolarHBondContact O-N 2.88Å; E924-R927 IonicContact OE1-CZ 3.66Å; E924-R927 IonicContact OE1-NE 3.34Å; E924-R927 IonicContact OE1-NH2 3.73Å; E924-R927 PolarHBondContact OE1-NH2 3.15Å; E924-R927 IonicContact OE2-CZ 2.59Å; E924-R927 IonicContact OE2-NE 3.61Å; E924-R927 PolarHBondContact OE2-NE 2.9Å; E924-R927 IonicContact OE2-NH2 3.63Å; K925-R927 VanDerWaalsContact C-N 3.32Å; R927-V929 VanDerWaalsContact C-N 3.31Å; R927-V929 PolarHBondContact O-N 3.39Å; R927-S930 PolarHBondContact O-N 3.49Å; R927-E931 IonicContact CZ-OE1 3.72Å; R927-E931 IonicContact CZ-OE2 3.17Å; R927-E931 IonicContact NH1-OE1 3.16Å; R927-E931 PolarHBondContact NH1-OE1 3.01Å; R927-E931 IonicContact NH1-OE2 3.19Å; R927-E931 PolarHBondContact NH1-OE2 2.98Å; R927-E931 IonicContact NH2-OE2 2.75Å; R927-E931 WeakPolarHBondContact O-CG 3.29Å; R927-E931 PolarHBondContact O-N 2.92Å
928	R	81.2	Confident	73.1	Confident	128 Å²	128	83.2 Å²	83.2	48%	0.483	43%	0.431	S	S	.	.	H	α-helix	trans	-61.9	-36.3	176.4	-74.3	-171.7	-169.4	93.7	5.6	113	E924 K925 E926 T932	E924-R928 WeakPolarHBondContact O-CG 3.09Å; E924-R928 PolarHBondContact O-N 2.8Å; E924-R928 PolarHBondContact O-NH1 3.25Å; E924-R928 IonicContact OE1-CZ 3.19Å; E924-R928 IonicContact OE1-NE 3.92Å; E924-R928 IonicContact OE1-NH1 3.57Å; E924-R928 IonicContact OE1-NH2 3.89Å; E924-R928 PolarHBondContact OE1-NH2 3.19Å; K925-R928 PolarHBondContact O-N 3.16Å; E926-R928 PolarHBondContact O-N 3.06Å; R928-T932 WeakPolarHBondContact O-CG2 3.01Å; R928-T932 PolarHBondContact O-N 3.2Å; R928-T932 PolarHBondContact O-OG1 2.97Å
929	V	77.4	Confident	70.1	Confident	91 Å²	91	90.5 Å²	90.5	55%	0.552	47%	0.47	S	S	*	.	H	α-helix	trans	-66.8	-42.8	175.6	174.5	0	0	0	0	110.3	K925 E926 R927 T932 V933	K925-V929 WeakPolarHBondContact O-CG2 3.42Å; K925-V929 PolarHBondContact O-N 3.13Å; E926-V929 PolarHBondContact O-N 3.2Å; E926-V929 VanDerWaalsContact O-N 3.17Å; R927-V929 VanDerWaalsContact C-N 3.31Å; R927-V929 PolarHBondContact O-N 3.39Å; V929-T932 PolarHBondContact O-N 3.2Å; V929-T932 PolarHBondContact O-OG1 3.45Å; V929-V933 WeakPolarHBondContact O-CG2 3.49Å; V929-V933 PolarHBondContact O-N 3.15Å
930	S	71.6	Confident	67.1	Low	69 Å²	69	96.1 Å²	96.1	48%	0.483	50%	0.495	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176.1	-58.8	0	0	0	0	112.9	E926 R927 T932 V933 E934	E926-S930 PolarHBondContact O-N 3.37Å; E926-S930 PolarHBondContact O-OG 3.5Å; R927-S930 PolarHBondContact O-N 3.49Å; S930-T932 VanDerWaalsContact C-N 3.32Å; S930-T932 PolarHBondContact O-N 2.79Å; S930-V933 PolarHBondContact O-N 2.5Å; S930-V933 VanDerWaalsContact O-N 3.11Å; S930-E934 PolarHBondContact O-N 3.29Å; S930-E934 VanDerWaalsContact O-N 3.16Å
931	E	68.6	Low	64	Low	88 Å²	88	101.2 Å²	101.2	41%	0.411	51%	0.511	S	S	.	.	H	α-helix	trans	-61	-39.1	176.8	-72.7	179.4	145.9	0	0	112.3	R927 V933 E934 V935	R927-E931 IonicContact CZ-OE1 3.72Å; R927-E931 IonicContact CZ-OE2 3.17Å; R927-E931 IonicContact NH1-OE1 3.16Å; R927-E931 PolarHBondContact NH1-OE1 3.01Å; R927-E931 IonicContact NH1-OE2 3.19Å; R927-E931 PolarHBondContact NH1-OE2 2.98Å; R927-E931 IonicContact NH2-OE2 2.75Å; R927-E931 WeakPolarHBondContact O-CG 3.29Å; R927-E931 PolarHBondContact O-N 2.92Å; E931-V933 PolarHBondContact O-N 3.43Å; E931-E934 PolarHBondContact O-N 2.84Å; E931-V935 WeakPolarHBondContact O-CG2 3.49Å; E931-V935 PolarHBondContact O-N 3.22Å; E931-V935 VanDerWaalsContact O-N 3.14Å
932	T	57.6	Low	60.9	Low	87 Å²	87	105.4 Å²	105.4	53%	0.534	54%	0.538	S	S	.	.	H	α-helix	trans	-67	-25	176.6	53.2	0	0	0	0	113.6	R928 V929 S930	R928-T932 WeakPolarHBondContact O-CG2 3.01Å; R928-T932 PolarHBondContact O-N 3.2Å; R928-T932 PolarHBondContact O-OG1 2.97Å; V929-T932 PolarHBondContact O-N 3.2Å; V929-T932 PolarHBondContact O-OG1 3.45Å; S930-T932 VanDerWaalsContact C-N 3.32Å; S930-T932 PolarHBondContact O-N 2.79Å
933	V	55.6	Low	57.8	Low	87 Å²	87	115.2 Å²	115.2	53%	0.527	58%	0.584	S	S	.	*	H	α-helix	trans	-76.5	-41.9	175.1	176.6	0	0	0	0	110.3	V929 S930 E931 V935 N936	V929-V933 WeakPolarHBondContact O-CG2 3.49Å; V929-V933 PolarHBondContact O-N 3.15Å; S930-V933 PolarHBondContact O-N 2.5Å; S930-V933 VanDerWaalsContact O-N 3.11Å; E931-V933 PolarHBondContact O-N 3.43Å; V933-V935 PolarHBondContact O-N 2.9Å; V933-N936 PolarHBondContact O-N 2.83Å
934	E	48.7	Very low	54.5	Low	141 Å²	141	114.5 Å²	114.5	66%	0.659	59%	0.588	S	S	*	*	H	α-helix	trans	-68.9	-32.4	-179.6	-69.5	-175.9	179.4	0	0	113.6	S930 E931 N936 D937	S930-E934 PolarHBondContact O-N 3.29Å; S930-E934 VanDerWaalsContact O-N 3.16Å; E931-E934 PolarHBondContact O-N 2.84Å; E934-N936 VanDerWaalsContact C-N 3.32Å; E934-D937 PolarHBondContact O-N 3.33Å
935	V	45.9	Very low	51.4	Low	102 Å²	102	116.7 Å²	116.7	62%	0.618	61%	0.611	S	S	*	*	H	α-helix	trans	-71.9	-27.3	177.3	176.3	0	0	0	0	112.1	E931 V933 D937 W938	E931-V935 WeakPolarHBondContact O-CG2 3.49Å; E931-V935 PolarHBondContact O-N 3.22Å; E931-V935 VanDerWaalsContact O-N 3.14Å; V933-V935 PolarHBondContact O-N 2.9Å; V935-D937 VanDerWaalsContact C-N 3.29Å; V935-D937 PolarHBondContact O-N 2.68Å; V935-W938 PolarHBondContact O-N 3.4Å
936	N	38.2	Very low	48.3	Very low	126 Å²	126	121.8 Å²	121.8	67%	0.674	64%	0.643	S	S	*	*	H	α-helix	trans	-77.4	-14.5	177.5	-76.1	-6.5	0	0	0	113.3	V933 E934 W938	V933-N936 PolarHBondContact O-N 2.83Å; E934-N936 VanDerWaalsContact C-N 3.32Å; N936-W938 VanDerWaalsContact C-N 3.25Å; N936-W938 PolarHBondContact O-N 2.87Å
937	D	37.5	Very low	45.1	Very low	123 Å²	123	127 Å²	127	66%	0.658	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	5.4	174.6	-79.8	-18.4	0	0	0	113.1	E934 V935 D939	E934-D937 PolarHBondContact O-N 3.33Å; V935-D937 VanDerWaalsContact C-N 3.29Å; V935-D937 PolarHBondContact O-N 2.68Å; D937-D939 PolarHBondContact O-N 2.79Å
938	W	30.1	Very low	42	Very low	221 Å²	221	130.5 Å²	130.5	84%	0.837	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	32.4	174.6	-81.2	43.6	0	0	0	114.1	V935 N936 D940	V935-W938 PolarHBondContact O-N 3.4Å; N936-W938 VanDerWaalsContact C-N 3.25Å; N936-W938 PolarHBondContact O-N 2.87Å; W938-D940 PolarHBondContact O-N 2.83Å
939	D	31.4	Very low	39.3	Very low	154 Å²	154	126.6 Å²	126.6	82%	0.824	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	0.9	164.5	-91	-23.3	0	0	0	112.9	D937 I941	D937-D939 PolarHBondContact O-N 2.79Å; D939-I941 VanDerWaalsContact C-N 3.33Å; D939-I941 PolarHBondContact O-N 2.82Å; D939-I941 VanDerWaalsContact O-N 3.14Å
940	D	30.3	Very low	36.7	Very low	151 Å²	151	131.7 Å²	131.7	81%	0.807	70%	0.698	S	S	*	*			trans	-87.6	63.3	173.6	-82.5	-23	0	0	0	112.3	W938 P942	W938-D940 PolarHBondContact O-N 2.83Å; D940-P942 WeakPolarHBondContact O-CD 3.38Å
941	I	28.6	Very low	34.5	Very low	149 Å²	149	138 Å²	138	76%	0.764	71%	0.713	S	S	*	*			trans	-70.6	118.6	153.2	-64.2	174.3	0	0	0	106.3	D939 Q943	D939-I941 VanDerWaalsContact C-N 3.33Å; D939-I941 PolarHBondContact O-N 2.82Å; D939-I941 VanDerWaalsContact O-N 3.14Å; I941-Q943 PolarHBondContact O-N 3.05Å; I941-Q943 VanDerWaalsContact O-N 3.16Å
942	P	28.7	Very low	32.4	Very low	106 Å²	106	141.6 Å²	141.6	69%	0.688	73%	0.734	S	S	*	*			trans	-63.2	123.2	-168.2	21.8	-30.5	0	0	0	110.2	D940 S944	D940-P942 WeakPolarHBondContact O-CD 3.38Å; P942-S944 PolarHBondContact O-N 2.89Å
943	Q	26.6	Very low	30.9	Very low	207 Å²	207	148 Å²	148	97%	0.967	75%	0.749	S	S	*	*			trans	-54.8	78.3	169.5	-65.7	180	-1.5	0	0	110.4	I941	I941-Q943 PolarHBondContact O-N 3.05Å; I941-Q943 VanDerWaalsContact O-N 3.16Å
944	S	25.7	Very low	29.5	Very low	97 Å²	97	150.2 Å²	150.2	68%	0.678	76%	0.758	S	S	*	*			trans	-107.9	114.3	168.7	69.8	0	0	0	0	108.8	P942	P942-S944 PolarHBondContact O-N 2.89Å
945	S	25.2	Very low	28.4	Very low	107 Å²	107	149.7 Å²	149.7	75%	0.748	77%	0.767	S	S	*	*			trans	60.9	91.1	169.6	63.3	0	0	0	0	117.1	F947	S945-F947 PolarHBondContact O-N 3.18Å
946	T	24.5	Very low	27.4	Very low	127 Å²	127	150.3 Å²	150.3	78%	0.779	77%	0.771	S	S	*	*			trans	-47	79.6	152.8	-37.4	0	0	0	0	111.8	K948	T946-K948 HydrophobicContact CG2-CG 4.16Å; T946-K948 PolarHBondContact O-N 3.35Å; T946-K948 VanDerWaalsContact O-N 3.1Å
947	F	24.7	Very low	26.8	Very low	196 Å²	196	150.6 Å²	150.6	86%	0.86	78%	0.777	S	S	*	*			trans	-79.7	93	167.1	-160.1	-100.9	0	0	0	108.1	S945 G949	S945-F947 PolarHBondContact O-N 3.18Å; F947-G949 PolarHBondContact O-N 3.47Å
948	K	23.4	Very low	26.1	Very low	183 Å²	183	154.1 Å²	154.1	80%	0.796	79%	0.787	S	S	*	*			trans	-62.6	80.9	172.8	-71.5	-175.5	174.8	178.7	0	110.4	T946 K950	T946-K948 HydrophobicContact CG2-CG 4.16Å; T946-K948 PolarHBondContact O-N 3.35Å; T946-K948 VanDerWaalsContact O-N 3.1Å; K948-K950 PolarHBondContact O-N 3.07Å
949	G	24.2	Very low	26	Very low	47 Å²	47	147.9 Å²	147.9	49%	0.485	78%	0.777	S	S	.	*			trans	-78.6	91.4	164.4	0	0	0	0	0	109.8	F947 Y951	F947-G949 PolarHBondContact O-N 3.47Å; G949-Y951 PolarHBondContact O-N 3.3Å
950	K	24	Very low	25.6	Very low	198 Å²	198	144 Å²	144	86%	0.861	77%	0.774	S	S	*	*			trans	-58.2	106.3	168.5	-72.7	178.5	175.6	179.9	0	109.5	K948	K948-K950 PolarHBondContact O-N 3.07Å
951	Y	25.2	Very low	25.4	Very low	201 Å²	201	144.7 Å²	144.7	79%	0.788	77%	0.772	S	S	*	*			trans	-126.5	69.1	161.4	-78.4	-81	0	0	0	109.6	G949 R953	G949-Y951 PolarHBondContact O-N 3.3Å; Y951-R953 PolarHBondContact O-N 3.03Å
952	N	23.9	Very low	25.1	Very low	163 Å²	163	143 Å²	143	87%	0.872	77%	0.773	S	S	*	*			trans	-75.8	100.2	144.5	-93.5	-0.1	0	0	0	105.7
953	R	26.5	Very low	25	Very low	222 Å²	222	144 Å²	144	84%	0.838	78%	0.78	S	S	*	*			trans	-119.7	107.5	158.8	-102.1	-170.9	172.7	-173.7	-2.3	107.1	Y951	Y951-R953 PolarHBondContact O-N 3.03Å
954	D	25.9	Very low	25	Very low	133 Å²	133	139.5 Å²	139.5	71%	0.711	77%	0.771	S	S	*	*			trans	-53.8	145.6	168.4	-68.1	-51.4	0	0	0	110.8	T956	D954-T956 PolarHBondContact O-N 3.26Å
955	P	25.1	Very low	25	Very low	130 Å²	130	142 Å²	142	84%	0.844	78%	0.777	S	S	*	*			trans	-79.2	85.9	-177.8	32	-32.8	0	0	0	109.9
956	T	26.5	Very low	25	Very low	115 Å²	115	143.8 Å²	143.8	71%	0.706	78%	0.778	S	S	*	*			trans	-107.3	108.3	168.7	56.9	0	0	0	0	110.5	D954	D954-T956 PolarHBondContact O-N 3.26Å
957	T	24.5	Very low	25.1	Very low	132 Å²	132	148.2 Å²	148.2	81%	0.81	78%	0.781	S	S	*	*			trans	42.6	87.9	142.2	47.1	0	0	0	0	116.5	S959	T957-S959 PolarHBondContact O-N 3.36Å
958	F	23.8	Very low	25.1	Very low	197 Å²	197	146 Å²	146	86%	0.864	78%	0.777	S	S	*	*			trans	-88.6	92.2	159	-144.1	-97.2	0	0	0	108.5
959	S	26.5	Very low	25.3	Very low	90 Å²	90	144.2 Å²	144.2	63%	0.629	77%	0.771	S	S	*	*			trans	-60.7	139.7	169.8	50.4	0	0	0	0	110.8	T957 H961	T957-S959 PolarHBondContact O-N 3.36Å; S959-H961 PolarHBondContact O-N 3.06Å
960	G	23.7	Very low	25.3	Very low	74 Å²	74	146.4 Å²	146.4	76%	0.763	78%	0.779	S	S	*	*			trans	-54.9	132	-177.4	0	0	0	0	0	114.4
961	H	25.9	Very low	25.5	Very low	164 Å²	164	145 Å²	145	76%	0.759	77%	0.774	S	S	*	*			trans	-100.8	97	156.5	-76.2	-64.6	0	0	0	107.7	S959	S959-H961 PolarHBondContact O-N 3.06Å
962	S	23.4	Very low	25.5	Very low	113 Å²	113	140 Å²	140	79%	0.79	77%	0.769	S	S	*	*			trans	-55.8	127.3	164.3	-90.4	0	0	0	0	109.4	S964	S962-S964 PolarHBondContact O-N 3.18Å; S962-S964 VanDerWaalsContact O-N 3.11Å
963	P	26.9	Very low	25.5	Very low	128 Å²	128	142.5 Å²	142.5	83%	0.831	77%	0.772	S	S	*	*			trans	-74.3	104.6	174.6	29	-29.2	0	0	0	108.4	N965	P963-N965 PolarHBondContact O-N 3.28Å
964	S	26.3	Very low	25.5	Very low	112 Å²	112	138.1 Å²	138.1	78%	0.783	77%	0.77	S	S	*	*			trans	-68.2	124.1	171.4	53.4	0	0	0	0	110.4	S962	S962-S964 PolarHBondContact O-N 3.18Å; S962-S964 VanDerWaalsContact O-N 3.11Å
965	N	24.2	Very low	25.6	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	78%	0.775	S	S	*	*			trans	-37.3	131.4	158.1	-89.6	-26	0	0	0	112.8	P963	P963-N965 PolarHBondContact O-N 3.28Å
966	N	25.4	Very low	25.5	Very low	145 Å²	145	142 Å²	142	78%	0.775	78%	0.776	S	S	*	*			trans	148.9	106.7	135.2	-80.8	-22.3	0	0	0	110.6
967	R	27.6	Very low	25.7	Very low	219 Å²	219	142.3 Å²	142.3	83%	0.826	78%	0.78	S	S	*	*				-165.8	94	128.6	-110.5	169.6	179.1	163.2	-0.5	110.7	H969	R967-H969 PolarHBondContact O-N 3.29Å
968	I	24.2	Very low	25.8	Very low	151 Å²	151	141.6 Å²	141.6	77%	0.774	78%	0.775	S	S	*	*			trans	-62.8	106.8	157.1	-63.9	163.2	0	0	0	106.3
969	H	28.8	Very low	26.1	Very low	145 Å²	145	139.6 Å²	139.6	67%	0.671	77%	0.773	S	S	*	*			trans	-110.1	90.8	160.9	-87.6	-64.4	0	0	0	108.1	R967 H971	R967-H969 PolarHBondContact O-N 3.29Å; H969-H971 PolarHBondContact O-N 2.88Å
970	S	22.8	Very low	26	Very low	93 Å²	93	142.9 Å²	142.9	65%	0.65	78%	0.784	S	S	*	*			trans	-75	107.2	161.9	51.9	0	0	0	0	108.9
971	H	28.1	Very low	26.2	Very low	167 Å²	167	143.6 Å²	143.6	77%	0.773	78%	0.777	S	S	*	*			trans	-144.5	120.2	158.9	-85.9	-63.7	0	0	0	112.5	H969	H969-H971 PolarHBondContact O-N 2.88Å
972	S	26.3	Very low	26.4	Very low	96 Å²	96	142.2 Å²	142.2	67%	0.671	78%	0.776	S	S	*	*			trans	59.7	102.3	143.3	56.9	0	0	0	0	119.4	T974	S972-T974 PolarHBondContact O-N 3.08Å
973	K	23.1	Very low	26.6	Very low	216 Å²	216	147.7 Å²	147.7	94%	0.939	78%	0.781	S	S	*	*			trans	-33.4	116	141.6	-64.3	171.5	175.8	178.4	0	111.7
974	T	27.6	Very low	26.9	Very low	130 Å²	130	149.3 Å²	149.3	80%	0.798	78%	0.777	S	S	*	*			trans	-121.2	129	156.5	51.5	0	0	0	0	108.8	S972	S972-T974 PolarHBondContact O-N 3.08Å
975	S	26.2	Very low	26.8	Very low	115 Å²	115	151.5 Å²	151.5	80%	0.804	78%	0.78	S	S	*	*			trans	-57.7	135.7	-170	43	0	0	0	0	114.6
976	R	24.3	Very low	27.2	Very low	231 Å²	231	151.1 Å²	151.1	87%	0.872	78%	0.782	S	S	*	*			trans	-63.5	122.9	164.6	-162.4	179.9	-163.9	175.3	2.4	109.6
977	P	30.4	Very low	27.2	Very low	121 Å²	121	148 Å²	148	79%	0.786	78%	0.777	S	S	*	*			trans	-89.2	115.7	159.7	17.5	-1.3	0	0	0	108.2
978	T	26.4	Very low	27.2	Very low	117 Å²	117	145 Å²	145	72%	0.718	78%	0.777	S	S	*	*			trans	-72.1	121.7	161.9	46.8	0	0	0	0	108
979	N	29.5	Very low	27.5	Very low	154 Å²	154	144.3 Å²	144.3	82%	0.824	78%	0.78	S	S	*	*			trans	-142.2	84	160.5	-128.4	23.3	0	0	0	107.5
980	D	24.8	Very low	27.5	Very low	160 Å²	160	142.7 Å²	142.7	86%	0.856	79%	0.785	S	S	*	*			trans	-74.1	120.1	156.4	-80.9	-37.4	0	0	0	107.2
981	S	28.4	Very low	27.8	Very low	89 Å²	89	146 Å²	146	62%	0.622	79%	0.794	S	S	*	*			trans	-179.7	123.9	145.1	56.4	0	0	0	0	110.9
982	D	30.3	Very low	27.8	Very low	135 Å²	135	144.3 Å²	144.3	72%	0.722	80%	0.796	S	S	*	*			trans	81.7	85.7	140.9	-53.5	-19.7	0	0	0	119.1	H984	D982-H984 PolarHBondContact O-N 3Å
983	Y	26.6	Very low	28.1	Very low	228 Å²	228	145.4 Å²	145.4	89%	0.894	80%	0.804	S	S	*	*			trans	-48	111.8	138.1	-93.1	-103.3	0	0	0	110.4
984	H	32.8	Very low	28.3	Very low	162 Å²	162	140.8 Å²	140.8	75%	0.75	80%	0.798	S	S	*	*			trans	-125.7	109.3	157.2	-91.7	-61.8	0	0	0	109.3	D982 V986	D982-H984 PolarHBondContact O-N 3Å; H984-V986 PolarHBondContact O-N 3.37Å
985	D	25.5	Very low	28.3	Very low	158 Å²	158	137.6 Å²	137.6	85%	0.845	79%	0.791	S	S	*	*			trans	-54.3	118	160.3	-85	-38.8	0	0	0	109.6
986	V	31.5	Very low	28.5	Very low	142 Å²	142	138.4 Å²	138.4	86%	0.861	79%	0.792	S	S	*	*			trans	-129.3	102.2	157.6	-101.4	0	0	0	0	107.8	H984	H984-V986 PolarHBondContact O-N 3.37Å
987	A	26.7	Very low	28.5	Very low	80 Å²	80	134.9 Å²	134.9	66%	0.661	79%	0.79	S	S	*	*			trans	-57.4	147.8	169	0	0	0	0	0	111.8
988	D	27.5	Very low	28.5	Very low	156 Å²	156	136.9 Å²	136.9	83%	0.834	79%	0.794	S	S	*	*			trans	58.6	82.5	143.5	-57.5	-20.3	0	0	0	117.8
989	T	31.1	Very low	28.4	Very low	135 Å²	135	134.4 Å²	134.4	83%	0.828	79%	0.792	S	S	*	*			trans	-112.6	101.7	146	37.6	0	0	0	0	109.9	L991	T989-L991 PolarHBondContact O-N 2.87Å; T989-L991 VanDerWaalsContact O-N 3.07Å
990	S	28.1	Very low	28.4	Very low	112 Å²	112	135.8 Å²	135.8	78%	0.783	79%	0.793	S	S	*	*			trans	-57.6	95.8	169.7	41.3	0	0	0	0	111.4	V992	S990-V992 PolarHBondContact O-N 3.04Å
991	L	28.6	Very low	28.4	Very low	161 Å²	161	134.3 Å²	134.3	84%	0.843	79%	0.79	S	S	*	*			trans	-88.8	96.9	164.8	-81.9	170.6	0	0	0	109.8	T989 S993	T989-L991 PolarHBondContact O-N 2.87Å; T989-L991 VanDerWaalsContact O-N 3.07Å; L991-S993 PolarHBondContact O-N 2.84Å; L991-S993 VanDerWaalsContact O-N 3.11Å
992	V	27.7	Very low	28.4	Very low	132 Å²	132	137.2 Å²	137.2	80%	0.8	80%	0.799	S	S	*	*			trans	-54.4	106.3	160.7	-178.7	0	0	0	0	108	S990	S990-V992 PolarHBondContact O-N 3.04Å
993	S	33.7	Very low	28.2	Very low	120 Å²	120	137 Å²	137	84%	0.839	80%	0.802	S	S	*	*			trans	-97.9	109.5	167.8	42.7	0	0	0	0	108.7	L991	L991-S993 PolarHBondContact O-N 2.84Å; L991-S993 VanDerWaalsContact O-N 3.11Å
994	S	26.1	Very low	28.4	Very low	118 Å²	118	131 Å²	131	83%	0.825	79%	0.793	S	S	*	*			trans	-88.4	138.9	163.9	46.4	0	0	0	0	109.1
995	G	28.3	Very low	28	Very low	63 Å²	63	130.8 Å²	130.8	65%	0.649	80%	0.796	S	S	*	*			trans	141.9	104.2	159.7	0	0	0	0	0	115.6
996	T	29.6	Very low	28.1	Very low	133 Å²	133	130.3 Å²	130.3	82%	0.816	79%	0.794	S	S	*	*			trans	57.1	100.8	137.4	58.2	0	0	0	0	117.3
997	D	25.1	Very low	28	Very low	157 Å²	157	131.2 Å²	131.2	84%	0.84	79%	0.794	S	S	*	*				62.8	81.7	83.8	-156.9	28.5	0	0	0	112.2
998	D	30.1	Very low	27.9	Very low	162 Å²	162	135.4 Å²	135.4	87%	0.866	80%	0.804	S	S	*	*			trans	-143.2	108.1	156.6	-91.3	-34.3	0	0	0	107.9	H1000	D998-H1000 PolarHBondContact O-N 2.92Å
999	G	24.2	Very low	27.9	Very low	65 Å²	65	133.8 Å²	133.8	67%	0.67	80%	0.802	S	S	*	*			trans	-75.7	117.1	-179.3	0	0	0	0	0	112.1
1000	H	29.3	Very low	27.6	Very low	183 Å²	183	135.5 Å²	135.5	85%	0.847	81%	0.805	S	S	*	*			trans	-134.5	111.8	151.6	-88.9	-73.3	0	0	0	108.7	D998 D1002	D998-H1000 PolarHBondContact O-N 2.92Å; H1000-D1002 PolarHBondContact O-N 3.09Å; H1000-D1002 VanDerWaalsContact O-N 3.09Å
1001	T	25.4	Very low	27.6	Very low	130 Å²	130	134.6 Å²	134.6	80%	0.798	80%	0.804	S	S	*	*			trans	-75.6	84.9	-177.3	49.3	0	0	0	0	110.4	V1003	T1001-V1003 PolarHBondContact O-N 3.14Å
1002	D	28	Very low	27.6	Very low	149 Å²	149	134.3 Å²	134.3	80%	0.797	80%	0.803	S	S	*	*			trans	-82.9	102.3	166.6	-88.3	-21.8	0	0	0	109.8	H1000 S1004	H1000-D1002 PolarHBondContact O-N 3.09Å; H1000-D1002 VanDerWaalsContact O-N 3.09Å; D1002-S1004 VanDerWaalsContact C-N 3.29Å; D1002-S1004 PolarHBondContact O-N 3.07Å; D1002-S1004 PolarHBondContact O-OG 3.3Å
1003	V	27.2	Very low	27.6	Very low	131 Å²	131	133.9 Å²	133.9	79%	0.794	81%	0.806	S	S	*	*			trans	-65.4	87.2	174.8	179.6	0	0	0	0	108.8	T1001 I1005	T1001-V1003 PolarHBondContact O-N 3.14Å; V1003-I1005 PolarHBondContact O-N 3.26Å
1004	S	29.1	Very low	27.3	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	81%	0.805	S	S	*	*			trans	-82.7	106	174.3	-59.7	0	0	0	0	109.6	D1002 N1006	D1002-S1004 VanDerWaalsContact C-N 3.29Å; D1002-S1004 PolarHBondContact O-N 3.07Å; D1002-S1004 PolarHBondContact O-OG 3.3Å; S1004-N1006 PolarHBondContact O-N 2.5Å
1005	I	25.2	Very low	27.3	Very low	157 Å²	157	136.4 Å²	136.4	81%	0.805	81%	0.805	S	S	*	*			trans	-70.9	92.5	173.1	-64.8	169.6	0	0	0	108.1	V1003	V1003-I1005 PolarHBondContact O-N 3.26Å
1006	N	27.5	Very low	27.1	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	82%	0.815	S	S	*	*			trans	-150.3	73.9	164.4	-92.4	-21	0	0	0	108.6	S1004	S1004-N1006 PolarHBondContact O-N 2.5Å
1007	N	28.7	Very low	26.9	Very low	161 Å²	161	139.7 Å²	139.7	86%	0.861	81%	0.809	S	S	*	*			trans	-135.3	69.8	170.2	-82.4	-36.2	0	0	0	109.2
1008	L	25.5	Very low	27	Very low	168 Å²	168	141.4 Å²	141.4	88%	0.88	81%	0.812	S	S	*	*			trans	-88.5	117.2	148.2	-88.3	158.5	0	0	0	105.8	L1010	L1008-L1010 PolarHBondContact O-N 2.89Å; L1008-L1010 VanDerWaalsContact O-N 3.14Å
1009	P	28.3	Very low	26.7	Very low	121 Å²	121	138.1 Å²	138.1	79%	0.786	80%	0.802	S	S	*	*			trans	-68.8	114.4	-177.3	5.2	4.6	0	0	0	109.1	A1011	P1009-A1011 PolarHBondContact O-N 2.86Å
1010	L	25	Very low	26.9	Very low	172 Å²	172	141.5 Å²	141.5	90%	0.901	81%	0.809	S	S	*	*			trans	-65.6	108.2	159.3	-128.8	75.9	0	0	0	106	L1008	L1008-L1010 PolarHBondContact O-N 2.89Å; L1008-L1010 VanDerWaalsContact O-N 3.14Å
1011	A	27.4	Very low	26.8	Very low	92 Å²	92	140.6 Å²	140.6	76%	0.76	81%	0.81	S	S	*	*			trans	-75.2	125.3	171.8	0	0	0	0	0	108.4	P1009 S1013	P1009-A1011 PolarHBondContact O-N 2.86Å; A1011-S1013 PolarHBondContact O-N 3.5Å
1012	D	29.2	Very low	26.8	Very low	155 Å²	155	139.9 Å²	139.9	83%	0.829	81%	0.805	S	S	*	*			trans	-50.7	123.9	174.9	-69	-49.8	0	0	0	110.7	E1014	D1012-E1014 VanDerWaalsContact C-N 3.25Å; D1012-E1014 PolarHBondContact O-N 2.94Å
1013	S	26.4	Very low	26.8	Very low	123 Å²	123	139 Å²	139	86%	0.86	81%	0.807	S	S	*	*			trans	-71.9	77.1	175.7	55.1	0	0	0	0	110	A1011 S1015	A1011-S1013 PolarHBondContact O-N 3.5Å; S1013-S1015 PolarHBondContact O-N 3.1Å
1014	E	28.6	Very low	26.8	Very low	174 Å²	174	137.8 Å²	137.8	81%	0.813	81%	0.805	S	S	*	*			trans	-80.6	114.4	162.1	-75.2	-163.1	164.5	0	0	109.2	D1012 L1016	D1012-E1014 VanDerWaalsContact C-N 3.25Å; D1012-E1014 PolarHBondContact O-N 2.94Å; E1014-L1016 PolarHBondContact O-N 3.17Å
1015	S	25.1	Very low	26.8	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	81%	0.811	S	S	*	*			trans	-58.3	93.7	178.1	53.5	0	0	0	0	111.5	S1013 S1017	S1013-S1015 PolarHBondContact O-N 3.1Å; S1015-S1017 PolarHBondContact O-N 3.13Å
1016	L	24.4	Very low	27	Very low	166 Å²	166	142.2 Å²	142.2	87%	0.869	81%	0.814	S	S	*	*			trans	-77.6	93.4	169.9	-75.3	166.7	0	0	0	109.4	E1014 H1018	E1014-L1016 PolarHBondContact O-N 3.17Å; L1016-H1018 PolarHBondContact O-N 3.08Å
1017	S	26.1	Very low	27.1	Very low	99 Å²	99	141.6 Å²	141.6	69%	0.692	81%	0.811	S	S	*	*			trans	-53.4	122.3	167.3	53.6	0	0	0	0	110.7	S1015 S1019	S1015-S1017 PolarHBondContact O-N 3.13Å; S1017-S1019 PolarHBondContact O-N 2.81Å
1018	H	25.3	Very low	27.3	Very low	194 Å²	194	139.4 Å²	139.4	90%	0.898	81%	0.806	S	S	*	*			trans	-48.5	97	172.5	-68	-87.8	0	0	0	111.8	L1016	L1016-H1018 PolarHBondContact O-N 3.08Å
1019	S	25.3	Very low	27.5	Very low	93 Å²	93	140.1 Å²	140.1	65%	0.65	80%	0.802	S	S	*	*			trans	-104.1	110.4	166.1	34	0	0	0	0	108.1	S1017 L1021	S1017-S1019 PolarHBondContact O-N 2.81Å; S1019-L1021 PolarHBondContact O-N 2.87Å
1020	V	27.2	Very low	27.4	Very low	136 Å²	136	143.8 Å²	143.8	82%	0.824	81%	0.806	S	S	*	*			trans	-59.6	94.1	177.5	177.8	0	0	0	0	108.7	T1022	V1020-T1022 PolarHBondContact O-N 2.84Å
1021	L	27.2	Very low	27.4	Very low	164 Å²	164	141.4 Å²	141.4	86%	0.859	80%	0.803	S	S	*	*			trans	-83.8	107.6	171.8	-75.6	170.5	0	0	0	108.8	S1019	S1019-L1021 PolarHBondContact O-N 2.87Å
1022	T	26.1	Very low	27.4	Very low	115 Å²	115	141.6 Å²	141.6	71%	0.706	80%	0.799	S	S	*	*			trans	-63.5	144.4	168.6	46.5	0	0	0	0	110.5	V1020 S1024	V1020-T1022 PolarHBondContact O-N 2.84Å; T1022-S1024 PolarHBondContact O-N 3Å
1023	P	27.7	Very low	27.3	Very low	129 Å²	129	142.4 Å²	142.4	84%	0.838	80%	0.797	S	S	*	*			trans	-78	101	-171.1	27.8	-25.6	0	0	0	109.7	S1025	P1023-S1025 PolarHBondContact O-N 3.07Å
1024	S	28.5	Very low	27.3	Very low	107 Å²	107	144.3 Å²	144.3	75%	0.748	80%	0.798	S	S	*	*			trans	-72.9	118.6	172.9	78.1	0	0	0	0	109.9	T1022 R1026	T1022-S1024 PolarHBondContact O-N 3Å; S1024-R1026 PolarHBondContact O-N 3.07Å; S1024-R1026 VanDerWaalsContact O-N 3.07Å
1025	S	28.4	Very low	27.3	Very low	120 Å²	120	141.8 Å²	141.8	84%	0.839	80%	0.796	S	S	*	*			trans	-64.3	97.5	173.3	49.2	0	0	0	0	111.5	P1023	P1023-S1025 PolarHBondContact O-N 3.07Å
1026	R	29.6	Very low	27.3	Very low	231 Å²	231	145.8 Å²	145.8	87%	0.872	80%	0.799	S	S	*	*			trans	-122.7	97.5	159	-91.2	-175.2	173.7	179.9	-0.3	109.3	S1024 P1028	S1024-R1026 PolarHBondContact O-N 3.07Å; S1024-R1026 VanDerWaalsContact O-N 3.07Å; R1026-P1028 WeakPolarHBondContact O-CD 3.4Å
1027	N	28.9	Very low	27.2	Very low	137 Å²	137	147.1 Å²	147.1	73%	0.733	80%	0.801	S	S	*	*			trans	-68.5	113.2	174.5	-135.1	-1.3	0	0	0	108.8	F1029	N1027-F1029 VanDerWaalsContact C-N 3.29Å; N1027-F1029 PolarHBondContact O-N 2.73Å; N1027-F1029 VanDerWaalsContact OD1-CD2 3.3Å; N1027-F1029 WeakPolarHBondContact OD1-CD2 3.43Å; N1027-F1029 WeakPolarHBondContact OD1-CE2 2.96Å
1028	P	33.5	Very low	27.2	Very low	115 Å²	115	149.9 Å²	149.9	75%	0.747	81%	0.806	S	S	*	*			trans	-90.8	16.2	-173.1	35.5	-30.9	0	0	0	113.1	R1026 K1030	R1026-P1028 WeakPolarHBondContact O-CD 3.4Å; P1028-K1030 PolarHBondContact O-N 2.89Å
1029	F	28.6	Very low	27.1	Very low	183 Å²	183	146.5 Å²	146.5	80%	0.803	80%	0.799	S	S	*	*			trans	-72.5	75	173.8	-61.7	-74.8	0	0	0	111.3	N1027	N1027-F1029 VanDerWaalsContact C-N 3.29Å; N1027-F1029 PolarHBondContact O-N 2.73Å; N1027-F1029 VanDerWaalsContact OD1-CD2 3.3Å; N1027-F1029 WeakPolarHBondContact OD1-CD2 3.43Å; N1027-F1029 WeakPolarHBondContact OD1-CE2 2.96Å
1030	K	27	Very low	27.2	Very low	198 Å²	198	148 Å²	148	86%	0.861	81%	0.807	S	S	*	*			trans	-126.4	95	160.4	-154	170.5	-175.3	177.9	0	109.1	P1028	P1028-K1030 PolarHBondContact O-N 2.89Å
1031	S	24	Very low	27.1	Very low	122 Å²	122	152.5 Å²	152.5	85%	0.853	81%	0.809	S	S	*	*			trans	-39.5	126.2	169.8	142.2	0	0	0	0	112.9
1032	S	28.1	Very low	27	Very low	95 Å²	95	150.6 Å²	150.6	66%	0.664	81%	0.81	S	S	*	*			trans	-151.5	137.2	145.5	73.4	0	0	0	0	111.6
1033	H	27.3	Very low	27.1	Very low	172 Å²	172	152.3 Å²	152.3	80%	0.796	81%	0.813	S	S	*	*			trans	80.4	96.5	164	-63.1	-65.4	0	0	0	119.7	P1035	H1033-P1035 WeakPolarHBondContact O-CD 3.39Å
1034	D	26.6	Very low	27.1	Very low	164 Å²	164	150.2 Å²	150.2	88%	0.877	81%	0.807	S	S	*	*			trans	-53	121.5	154.2	-65.2	-53.5	0	0	0	112.3
1035	P	29	Very low	26.8	Very low	120 Å²	120	154.9 Å²	154.9	78%	0.779	82%	0.816	S	S	*	*			trans	-97.3	121.2	160.7	25.3	-9.7	0	0	0	109.6	H1033	H1033-P1035 WeakPolarHBondContact O-CD 3.39Å
1036	K	25.3	Very low	26.8	Very low	201 Å²	201	150.7 Å²	150.7	87%	0.874	79%	0.792	S	S	*	*			trans	-45.8	134.8	176.6	-72.3	170.5	174.1	174	0	113.1	I1038	K1036-I1038 PolarHBondContact O-N 3.4Å
1037	E	22.4	Very low	27	Very low	195 Å²	195	144.9 Å²	144.9	91%	0.911	78%	0.782	S	S	*	*			trans	-51.8	118.8	171.3	-67.5	175	138.9	0	0	111.7
1038	I	25.2	Very low	27.5	Very low	156 Å²	156	146.8 Å²	146.8	80%	0.8	79%	0.787	S	S	*	*			trans	-117.8	111.4	158.6	-60.3	176.8	0	0	0	106.1	K1036	K1036-I1038 PolarHBondContact O-N 3.4Å
1039	T	23.7	Very low	27.8	Very low	123 Å²	123	146.6 Å²	146.6	76%	0.755	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.1	121	177.5	41.9	0	0	0	0	110.2	R1041	T1039-R1041 PolarHBondContact O-N 3.09Å
1040	P	28.1	Very low	28.3	Very low	125 Å²	125	140.4 Å²	140.4	81%	0.812	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-79.3	123	175	30.5	-28.7	0	0	0	108.8	S1042	P1040-S1042 PolarHBondContact O-N 3.06Å
1041	R	24.5	Very low	28.9	Very low	231 Å²	231	135.2 Å²	135.2	87%	0.872	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-62.3	130.1	169.9	-75.6	177.2	172.7	167.9	-2.8	109.7	T1039 I1043	T1039-R1041 PolarHBondContact O-N 3.09Å; R1041-I1043 PolarHBondContact O-N 2.87Å
1042	S	24.4	Very low	29.6	Very low	124 Å²	124	135.1 Å²	135.1	87%	0.867	73%	0.73	S	S	*	*			trans	-47.5	115.9	169.4	173.6	0	0	0	0	111.5	P1040	P1040-S1042 PolarHBondContact O-N 3.06Å
1043	I	28.1	Very low	29.5	Very low	151 Å²	151	139.8 Å²	139.8	77%	0.774	73%	0.733	S	S	*	*			trans	-133.4	117.6	168	-62.8	178.1	0	0	0	108.8	R1041	R1041-I1043 PolarHBondContact O-N 2.87Å
1044	A	27.2	Very low	29.6	Very low	85 Å²	85	136.9 Å²	136.9	70%	0.702	73%	0.727	S	S	*	*			trans	62.9	121.6	153.2	0	0	0	0	0	119.8	G1046	A1044-G1046 PolarHBondContact O-N 3Å
1045	H	23.9	Very low	29.6	Very low	204 Å²	204	134.1 Å²	134.1	94%	0.944	72%	0.719	S	S	*	*			trans	-46.7	122.7	168.1	-68.6	-12.7	0	0	0	112.8
1046	G	27.9	Very low	29.3	Very low	33 Å²	33	138.6 Å²	138.6	34%	0.34	73%	0.726	S	S	.	*			trans	-132.6	113.2	173	0	0	0	0	0	110.5	A1044	A1044-G1046 PolarHBondContact O-N 3Å
1047	T	34	Very low	29.4	Very low	108 Å²	108	134.5 Å²	134.5	66%	0.663	72%	0.718	S	S	*	*			trans	9.1	118.7	161.5	57.6	0	0	0	0	118.1	L1049	T1047-L1049 PolarHBondContact O-N 2.81Å
1048	E	39	Very low	29.4	Very low	177 Å²	177	132.2 Å²	132.2	83%	0.827	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-8.6	-171.7	-59.2	-174.5	163.5	0	0	117.4	L1050 D1051	E1048-L1050 VanDerWaalsContact C-N 3.31Å; E1048-L1050 PolarHBondContact O-N 2.9Å; E1048-D1051 PolarHBondContact O-N 2.83Å
1049	L	40.1	Very low	29.5	Very low	111 Å²	111	129 Å²	129	58%	0.581	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-24.8	-171.4	-151.8	92.2	0	0	0	114	A868 T1047	A868-L1049 HydrophobicContact CB-CD2 4.3Å; T1047-L1049 PolarHBondContact O-N 2.81Å
1050	L	37.7	Very low	29.5	Very low	53 Å²	53	129.4 Å²	129.4	28%	0.277	72%	0.717	S	S	.	*	S	Bend	trans	-99.8	-14	-177.6	-77.5	160.9	0	0	0	113.6	Y905 E1048 V1052	Y905-L1050 HydrophobicContact CD2-CD2 3.9Å; Y905-L1050 HydrophobicContact CE2-CD2 4.14Å; E1048-L1050 VanDerWaalsContact C-N 3.31Å; E1048-L1050 PolarHBondContact O-N 2.9Å; L1050-V1052 PolarHBondContact O-N 3.16Å
1051	D	40.4	Very low	29.2	Very low	90 Å²	90	130.9 Å²	130.9	48%	0.481	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86	-7	-168.7	-77.5	-7	0	0	0	113.9	R908 E1048 W1053	R908-D1051 IonicContact NH1-OD1 3.91Å; E1048-D1051 PolarHBondContact O-N 2.83Å; D1051-W1053 PolarHBondContact O-N 2.89Å; D1051-W1053 VanDerWaalsContact O-N 3.13Å
1052	V	38.1	Very low	29.3	Very low	120 Å²	120	126.4 Å²	126.4	73%	0.727	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-13.2	-178.2	-177.4	0	0	0	0	112.8	L1050	L1050-V1052 PolarHBondContact O-N 3.16Å
1053	W	27.1	Very low	29.2	Very low	192 Å²	192	130.1 Å²	130.1	73%	0.727	72%	0.716	S	S	*	*			trans	-118.2	67.9	-179.9	-73.2	39.3	0	0	0	111.6	D1051	D1051-W1053 PolarHBondContact O-N 2.89Å; D1051-W1053 VanDerWaalsContact O-N 3.13Å
1054	T	30	Very low	29	Very low	111 Å²	111	129.2 Å²	129.2	68%	0.681	72%	0.718	S	S	*	*			trans	-81.2	135.9	157	54	0	0	0	0	109.6	K1056	T1054-K1056 PolarHBondContact O-N 3.08Å
1055	P	25.6	Very low	28.8	Very low	107 Å²	107	130.6 Å²	130.6	70%	0.695	72%	0.722	S	S	*	*			trans	-58.1	131.9	178.7	23.3	-31.3	0	0	0	110.3	T1057	P1055-T1057 VanDerWaalsContact C-N 3.27Å; P1055-T1057 PolarHBondContact O-N 3.17Å
1056	K	23.3	Very low	28.9	Very low	213 Å²	213	129.5 Å²	129.5	93%	0.926	72%	0.718	S	S	*	*			trans	-62.7	89.4	169.5	-76	-178.7	178.3	177	0	108.3	T1054	T1054-K1056 PolarHBondContact O-N 3.08Å
1057	T	26.2	Very low	28.7	Very low	116 Å²	116	137.6 Å²	137.6	71%	0.712	74%	0.744	S	S	*	*			trans	-79.2	122.9	165.2	51.7	0	0	0	0	107.5	P1055 A1059	P1055-T1057 VanDerWaalsContact C-N 3.27Å; P1055-T1057 PolarHBondContact O-N 3.17Å; T1057-A1059 PolarHBondContact O-N 3.3Å
1058	T	22.2	Very low	28.3	Very low	146 Å²	146	138.3 Å²	138.3	90%	0.896	75%	0.75	S	S	*	*			trans	-66.4	78.2	173.1	34.9	0	0	0	0	109.4
1059	A	27.6	Very low	27.6	Very low	88 Å²	88	137.4 Å²	137.4	73%	0.727	75%	0.751	S	S	*	*			trans	-92.6	118.6	175.4	0	0	0	0	0	110.1	T1057	T1057-A1059 PolarHBondContact O-N 3.3Å
1060	T	24.9	Very low	27.1	Very low	133 Å²	133	138.9 Å²	138.9	82%	0.816	76%	0.764	S	S	*	*			trans	-62.1	137.4	178.8	37	0	0	0	0	112.5	T1062	T1060-T1062 PolarHBondContact O-N 2.97Å
1061	N	21.7	Very low	26.5	Very low	155 Å²	155	143.3 Å²	143.3	83%	0.829	79%	0.788	S	S	*	*			trans	-45.6	114	174.3	-84.5	-44.2	0	0	0	113.1
1062	T	26.5	Very low	25.8	Very low	137 Å²	137	148.8 Å²	148.8	84%	0.84	81%	0.808	S	S	*	*			trans	-133.7	105.7	149.1	39.6	0	0	0	0	109.6	T1060 V1064	T1060-T1062 PolarHBondContact O-N 2.97Å; T1062-V1064 PolarHBondContact O-N 3.43Å
1063	K	21.5	Very low	25.2	Very low	202 Å²	202	149.8 Å²	149.8	88%	0.878	81%	0.814	S	S	*	*			trans	-66.6	118.1	171	-73.3	172.2	173.8	173.9	0	109
1064	V	24.9	Very low	25.1	Very low	133 Å²	133	148.6 Å²	148.6	81%	0.806	82%	0.816	S	S	*	*			trans	-134.2	116.1	151.1	-178.5	0	0	0	0	109	T1062	T1062-V1064 PolarHBondContact O-N 3.43Å
1065	S	22.8	Very low	24.9	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	83%	0.828	S	S	*	*			trans	-79	118.6	178.7	159.3	0	0	0	0	110.5
1066	Q	25.9	Very low	24.8	Very low	182 Å²	182	152.3 Å²	152.3	85%	0.85	83%	0.826	S	S	*	*			trans	-147.2	101.7	151.8	-70.1	-166.5	-5.8	0	0	109.8
1067	K	23.1	Very low	25	Very low	203 Å²	203	152.3 Å²	152.3	88%	0.883	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-102	123.4	165.8	-88	-177.2	175.5	177.7	0	108.4
1068	P	26.2	Very low	24.9	Very low	122 Å²	122	156 Å²	156	79%	0.792	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-88.6	132.8	166.3	31.1	-24.9	0	0	0	110.7
1069	N	23.2	Very low	25.1	Very low	159 Å²	159	161 Å²	161	85%	0.85	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-62.7	131.3	170.2	-86	-32.4	0	0	0	111.3
1070	V	29.3	Very low	24.9	Very low	141 Å²	141	162.2 Å²	162.2	86%	0.855	84%	0.838	S	S	*	*			trans	-136.3	134.4	153.5	-178.2	0	0	0	0	109.4
1071	N	26.8	Very low	25	Very low	147 Å²	147	164.3 Å²	164.3	79%	0.786	84%	0.844	S	S	*	*			trans	-70.2	135.7	-158.2	-68.8	-39.6	0	0	0	114.8
1072	K	24.6	Very low	25.2	Very low	205 Å²	205	161.7 Å²	161.7	89%	0.891	84%	0.843	S	S	*	*			trans	-78.2	115.1	162	-76	178.9	174.8	178	0	109.4
1073	T	25.3	Very low	25.1	Very low	140 Å²	140	160.3 Å²	160.3	86%	0.859	84%	0.839	S	S	*	*			trans	-84.5	115.1	162.9	32.9	0	0	0	0	109.4
1074	Q	25.9	Very low	25.2	Very low	167 Å²	167	157 Å²	157	78%	0.78	84%	0.84	S	S	*	*			trans	-71.2	129.9	173	-68.1	170.6	-16	0	0	109.3
1075	N	25.4	Very low	25.2	Very low	172 Å²	172	159.8 Å²	159.8	92%	0.92	84%	0.844	S	S	*	*			trans	-124.4	106.3	157.2	-115	-13.2	0	0	0	109.7
1076	N	24	Very low	25.2	Very low	125 Å²	125	165.8 Å²	165.8	67%	0.668	85%	0.85	S	S	*	*			trans	-71	117.8	175.4	-79.3	-48.9	0	0	0	110.3
1077	K	27.8	Very low	25.2	Very low	213 Å²	213	162.4 Å²	162.4	93%	0.926	85%	0.846	S	S	*	*			trans	-136	91.7	145.4	-82.5	-169.7	178.3	172.1	0	109.6
1078	K	24	Very low	25.3	Very low	194 Å²	194	162.5 Å²	162.5	84%	0.843	85%	0.846	S	S	*	*			trans	-65	120.3	163.5	-69.5	175.4	175.6	178	0	108.4
1079	R	24.9	Very low	25.1	Very low	249 Å²	249	164 Å²	164	94%	0.94	85%	0.847	S	S	*	*			trans	-133	116.7	151	-108.1	-177.2	164.2	-170.4	-5.7	108
1080	S	23.4	Very low	25.3	Very low	115 Å²	115	161.8 Å²	161.8	80%	0.804	84%	0.842	S	S	*	*			trans	-64	124.9	-179.9	49.4	0	0	0	0	111.4
1081	L	27.4	Very low	25	Very low	177 Å²	177	164.6 Å²	164.6	93%	0.927	84%	0.842	S	S	*	*			trans	-117.3	131.7	148.6	-109.4	103.4	0	0	0	108.2
1082	A	26.4	Very low	24.8	Very low	99 Å²	99	166.6 Å²	166.6	82%	0.818	85%	0.849	S	S	*	*			trans	-64.4	140	-167.9	0	0	0	0	0	112.6	C1084	A1082-C1084 PolarHBondContact O-N 3.47Å
1083	S	23.8	Very low	24.8	Very low	108 Å²	108	166 Å²	166	76%	0.755	85%	0.847	S	S	*	*			trans	-68.8	110.7	172	53.5	0	0	0	0	111.1
1084	C	23.1	Very low	24.8	Very low	133 Å²	133	164.1 Å²	164.1	90%	0.899	84%	0.839	S	S	*	*			trans	-91.4	113.2	155.9	-99.1	0	0	0	0	108.4	A1082 R1086	A1082-C1084 PolarHBondContact O-N 3.47Å; C1084-R1086 PolarHBondContact O-N 3.42Å; C1084-R1086 VanDerWaalsContact O-N 3.08Å
1085	Q	25.8	Very low	24.9	Very low	191 Å²	191	161.4 Å²	161.4	89%	0.893	83%	0.834	S	S	*	*			trans	-68.3	98.1	175.6	-68.2	177.1	-18.8	0	0	109.2	S1087	Q1085-S1087 PolarHBondContact O-N 2.99Å
1086	R	22.7	Very low	24.9	Very low	240 Å²	240	157 Å²	157	91%	0.906	81%	0.813	S	S	*	*			trans	-82.4	107.6	169.8	-150.7	173.9	-172.1	-178.9	1.6	107.9	C1084 K1088	C1084-R1086 PolarHBondContact O-N 3.42Å; C1084-R1086 VanDerWaalsContact O-N 3.08Å; R1086-K1088 PolarHBondContact O-N 2.55Å
1087	S	25.6	Very low	25.4	Very low	111 Å²	111	158.1 Å²	158.1	78%	0.776	82%	0.817	S	S	*	*			trans	-54.3	120.2	173.4	48.9	0	0	0	0	110.1	Q1085 L1089	Q1085-S1087 PolarHBondContact O-N 2.99Å; S1087-L1089 PolarHBondContact O-N 2.82Å
1088	K	25.2	Very low	25.8	Very low	204 Å²	204	152.9 Å²	152.9	89%	0.887	80%	0.803	S	S	*	*			trans	-69.9	105.2	175.3	-66.5	179.4	177.8	178.4	0	108.6	R1086	R1086-K1088 PolarHBondContact O-N 2.55Å
1089	L	22.2	Very low	26.9	Very low	154 Å²	154	148.1 Å²	148.1	81%	0.806	79%	0.787	S	S	*	*			trans	-69.8	139.1	159.2	-135.3	84.1	0	0	0	107.8	S1087 K1091	S1087-L1089 PolarHBondContact O-N 2.82Å; L1089-K1091 PolarHBondContact O-N 3.04Å
1090	P	27.5	Very low	28.2	Very low	113 Å²	113	139.6 Å²	139.6	73%	0.734	76%	0.762	S	S	*	*			trans	-67.3	128.3	-177.3	-9.4	24.5	0	0	0	109.6	M1092	P1090-M1092 PolarHBondContact O-N 2.93Å; P1090-M1092 VanDerWaalsContact O-N 3.07Å
1091	K	22.7	Very low	30	Very low	200 Å²	200	139.4 Å²	139.4	87%	0.87	75%	0.753	S	S	*	*			trans	-62.9	108.7	170.8	-68	-178.2	175	-172.8	0	108.2	L1089 K1093	L1089-K1091 PolarHBondContact O-N 3.04Å; K1091-K1093 PolarHBondContact O-N 3.15Å; K1091-K1093 VanDerWaalsContact O-N 3.1Å
1092	M	22.8	Very low	32.2	Very low	189 Å²	189	136 Å²	136	93%	0.931	73%	0.732	S	S	*	*			trans	-64.7	107.2	161.4	-73.8	177.1	71.3	0	0	106.5	P1090 S1094	P1090-M1092 PolarHBondContact O-N 2.93Å; P1090-M1092 VanDerWaalsContact O-N 3.07Å; M1092-S1094 PolarHBondContact O-N 2.85Å
1093	K	25.9	Very low	35	Very low	193 Å²	193	136.4 Å²	136.4	84%	0.839	72%	0.717	S	S	*	*			trans	-66.5	115.6	171.3	-76.1	-177.5	172.7	-173.8	0	107	K1091 V1095	K1091-K1093 PolarHBondContact O-N 3.15Å; K1091-K1093 VanDerWaalsContact O-N 3.1Å; K1093-V1095 PolarHBondContact O-N 2.76Å
1094	S	24.1	Very low	38.2	Very low	100 Å²	100	132.6 Å²	132.6	70%	0.699	69%	0.687	S	S	*	*			trans	-62.3	116.7	165.8	52.4	0	0	0	0	107.9	M1092 T1096	M1092-S1094 PolarHBondContact O-N 2.85Å; S1094-T1096 PolarHBondContact O-N 3Å; S1094-T1096 VanDerWaalsContact O-N 3.1Å
1095	V	27.9	Very low	41.2	Very low	110 Å²	110	129.2 Å²	129.2	67%	0.667	66%	0.662	S	S	*	*			trans	-69.2	105	175.4	179.7	0	0	0	0	107.4	K1093 D1099 V1100	K1093-V1095 PolarHBondContact O-N 2.76Å; V1095-D1099 HydrophobicContact CG1-CB 4.44Å; V1095-V1100 HydrophobicContact CG1-CG2 3.96Å
1096	T	25.4	Very low	44.2	Very low	79 Å²	79	124.4 Å²	124.4	49%	0.485	64%	0.642	S	S	.	*			trans	-73.4	143.9	170.8	19.3	0	0	0	0	109.5	S1094 T1098 D1099	S1094-T1096 PolarHBondContact O-N 3Å; S1094-T1096 VanDerWaalsContact O-N 3.1Å; T1096-T1098 PolarHBondContact O-N 2.8Å; T1096-D1099 PolarHBondContact O-N 3.28Å
1097	I	34.1	Very low	47.6	Very low	148 Å²	148	114.9 Å²	114.9	76%	0.759	61%	0.606	S	S	*	*	H	α-helix	trans	-54.1	-26.7	-174.7	-64.6	170.6	0	0	0	112.5	D1099 V1100	I1097-D1099 PolarHBondContact O-N 3Å; I1097-V1100 PolarHBondContact O-N 3.19Å
1098	T	36.8	Very low	50.9	Low	103 Å²	103	110.6 Å²	110.6	63%	0.632	57%	0.574	S	S	*	*	H	α-helix	trans	-68.3	-28.1	175.8	49.1	0	0	0	0	114.5	T1096 V1100 Q1102	T1096-T1098 PolarHBondContact O-N 2.8Å; T1098-V1100 VanDerWaalsContact C-N 3.29Å; T1098-V1100 PolarHBondContact O-N 2.66Å; T1098-Q1102 PolarHBondContact O-N 2.9Å
1099	D	47.3	Very low	54	Low	95 Å²	95	107.8 Å²	107.8	51%	0.508	56%	0.564	S	S	.	*	H	α-helix	trans	-70.4	-29	178.8	-81.9	-22	0	0	0	111.7	V1095 T1096 I1097 E1103	V1095-D1099 HydrophobicContact CG1-CB 4.44Å; T1096-D1099 PolarHBondContact O-N 3.28Å; I1097-D1099 PolarHBondContact O-N 3Å; D1099-E1103 PolarHBondContact O-N 2.9Å
1100	V	51.9	Low	57.2	Low	69 Å²	69	108.1 Å²	108.1	42%	0.418	56%	0.562	S	S	.	*	H	α-helix	trans	-70.8	-37.3	-178.9	-174.5	0	0	0	0	111.1	V1095 I1097 T1098	V1095-V1100 HydrophobicContact CG1-CG2 3.96Å; I1097-V1100 PolarHBondContact O-N 3.19Å; T1098-V1100 VanDerWaalsContact C-N 3.29Å; T1098-V1100 PolarHBondContact O-N 2.66Å
1101	D	61.5	Low	60.3	Low	112 Å²	112	105 Å²	105	60%	0.599	54%	0.539	S	S	*	.	H	α-helix	trans	-72.9	-36.1	178	-76.3	-22	0	0	0	111.8	T1105	D1101-T1105 WeakPolarHBondContact O-CB 3.35Å; D1101-T1105 PolarHBondContact O-N 2.8Å; D1101-T1105 VanDerWaalsContact O-N 3.08Å; D1101-T1105 PolarHBondContact O-OG1 3.39Å
1102	Q	74.4	Confident	63.6	Low	106 Å²	106	99.6 Å²	99.6	50%	0.495	51%	0.513	S	S	.	.	H	α-helix	trans	-67.6	-40.3	178	-165.1	65	42.1	0	0	111.9	T1098 F1104 T1105 D1106	T1098-Q1102 PolarHBondContact O-N 2.9Å; Q1102-F1104 VanDerWaalsContact C-N 3.34Å; Q1102-F1104 PolarHBondContact O-N 3.44Å; Q1102-T1105 PolarHBondContact O-N 2.89Å; Q1102-T1105 VanDerWaalsContact O-N 3.1Å; Q1102-D1106 PolarHBondContact NE2-OD1 3.22Å; Q1102-D1106 PolarHBondContact O-N 2.92Å
1103	E	84.4	Confident	66.8	Low	106 Å²	106	96.7 Å²	96.7	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-38	-179.2	-160.8	-178.2	-149.9	0	0	112.5	D1099 W1107 Y1135 K1139	D1099-E1103 PolarHBondContact O-N 2.9Å; E1103-W1107 WeakPolarHBondContact O-CB 3.36Å; E1103-W1107 PolarHBondContact O-N 3.18Å; E1103-Y1135 WeakPolarHBondContact CG-OH 3.29Å; E1103-Y1135 PolarHBondContact OE2-OH 2.91Å; E1103-Y1135 VanDerWaalsContact OE2-OH 3.07Å; E1103-K1139 IonicContact OE2-NZ 3.56Å; E1103-K1139 PolarHBondContact OE2-NZ 2.78Å
1104	F	91.4	Very high	69.8	Low	28 Å²	28	91.3 Å²	91.3	12%	0.123	48%	0.484	C	S	.	.	H	α-helix	trans	-68.7	-41.8	171.5	169.3	-105.6	0	0	0	111.7	Q1102 D1106 W1107 F1108 V1128 Q1132 Y1135	Q1102-F1104 VanDerWaalsContact C-N 3.34Å; Q1102-F1104 PolarHBondContact O-N 3.44Å; F1104-D1106 PolarHBondContact O-N 3.24Å; F1104-W1107 HydrophobicContact CD2-CE3 4.35Å; F1104-W1107 HydrophobicContact CE2-CE3 4.18Å; F1104-W1107 HydrophobicContact CE2-CZ3 4.35Å; F1104-W1107 PolarHBondContact O-N 2.98Å; F1104-F1108 HydrophobicContact CE1-CB 4.3Å; F1104-F1108 HydrophobicContact CE2-CB 4.16Å; F1104-F1108 HydrophobicContact CE2-CD2 4.41Å; F1104-F1108 HydrophobicContact CZ-CB 3.93Å; F1104-F1108 AromaticContact CZ-CD2 3.96Å; F1104-F1108 HydrophobicContact CZ-CD2 3.96Å; F1104-F1108 HydrophobicContact CZ-CG 4.08Å; F1104-F1108 VanDerWaalsContact O-CB 3.31Å; F1104-F1108 WeakPolarHBondContact O-CB 3.11Å; F1104-F1108 PolarHBondContact O-N 3.14Å; F1104-V1128 HydrophobicContact CE1-CG1 4.32Å; F1104-V1128 HydrophobicContact CZ-CG1 4.35Å; F1104-Q1132 HydrophobicContact CD1-CG 4.32Å; F1104-Q1132 HydrophobicContact CD2-CG 4.24Å; F1104-Q1132 HydrophobicContact CE1-CG 3.65Å; F1104-Q1132 HydrophobicContact CE2-CB 4.18Å; F1104-Q1132 HydrophobicContact CE2-CG 3.57Å; F1104-Q1132 HydrophobicContact CZ-CB 4.23Å; F1104-Q1132 HydrophobicContact CZ-CG 3.23Å; F1104-Y1135 HydrophobicContact CB-CD1 4.35Å; F1104-Y1135 HydrophobicContact CB-CE1 4.22Å; F1104-Y1135 AromaticContact CD2-CD1 3.87Å; F1104-Y1135 HydrophobicContact CD2-CD1 3.87Å; F1104-Y1135 AromaticContact CD2-CG 3.85Å; F1104-Y1135 HydrophobicContact CD2-CG 3.85Å
1105	T	86.4	Confident	73	Confident	62 Å²	62	86.7 Å²	86.7	38%	0.38	45%	0.452	S	S	.	.	H	α-helix	trans	-61.3	-45.6	-178	-52.7	0	0	0	0	111.2	D1101 Q1102 F1108 E1109	D1101-T1105 WeakPolarHBondContact O-CB 3.35Å; D1101-T1105 PolarHBondContact O-N 2.8Å; D1101-T1105 VanDerWaalsContact O-N 3.08Å; D1101-T1105 PolarHBondContact O-OG1 3.39Å; Q1102-T1105 PolarHBondContact O-N 2.89Å; Q1102-T1105 VanDerWaalsContact O-N 3.1Å; T1105-F1108 PolarHBondContact O-N 2.76Å; T1105-E1109 WeakPolarHBondContact O-CG 3.02Å; T1105-E1109 PolarHBondContact O-N 2.96Å
1106	D	88.2	Confident	75.9	Confident	90 Å²	90	85.2 Å²	85.2	48%	0.481	44%	0.438	S	S	.	.	H	α-helix	trans	-64.6	-42.9	178.1	-64.9	-7.3	0	0	0	111.1	Q1102 F1104 F1108 E1109 E1110	Q1102-D1106 PolarHBondContact NE2-OD1 3.22Å; Q1102-D1106 PolarHBondContact O-N 2.92Å; F1104-D1106 PolarHBondContact O-N 3.24Å; D1106-F1108 PolarHBondContact O-N 3.07Å; D1106-E1109 PolarHBondContact O-N 3.17Å; D1106-E1110 PolarHBondContact O-N 2.93Å; D1106-E1110 VanDerWaalsContact O-N 3.16Å
1107	W	93.9	Very high	79	Confident	40 Å²	40	89.2 Å²	89.2	15%	0.152	45%	0.451	C	S	.	.	H	α-helix	trans	-64.3	-39	175.4	179.5	88.6	0	0	0	112.4	E1103 F1104 E1110 N1111 G1131 E1134 Y1135 I1138	E1103-W1107 WeakPolarHBondContact O-CB 3.36Å; E1103-W1107 PolarHBondContact O-N 3.18Å; F1104-W1107 HydrophobicContact CD2-CE3 4.35Å; F1104-W1107 HydrophobicContact CE2-CE3 4.18Å; F1104-W1107 HydrophobicContact CE2-CZ3 4.35Å; F1104-W1107 PolarHBondContact O-N 2.98Å; W1107-E1110 PolarHBondContact O-N 3.42Å; W1107-N1111 VanDerWaalsContact CD1-ND2 3.35Å; W1107-N1111 HydrophobicContact CH2-CB 4.36Å; W1107-N1111 HydrophobicContact CZ2-CB 4.27Å; W1107-N1111 PolarHBondContact NE1-ND2 3.36Å; W1107-N1111 PolarHBondContact O-N 3.18Å; W1107-N1111 VanDerWaalsContact O-N 3.09Å; W1107-N1111 PolarHBondContact O-ND2 2.53Å; W1107-G1131 WeakPolarHBondContact CZ3-O 3.37Å; W1107-E1134 HydrophobicContact CH2-CB 3.92Å; W1107-Y1135 HydrophobicContact CB-CD2 3.9Å; W1107-Y1135 HydrophobicContact CB-CE2 3.87Å; W1107-Y1135 AromaticContact CD1-CD2 3.95Å; W1107-Y1135 AromaticContact CD2-CD2 3.46Å; W1107-Y1135 HydrophobicContact CD2-CD2 3.46Å; W1107-Y1135 VanDerWaalsContact CD2-CD2 3.46Å; W1107-Y1135 HydrophobicContact CD2-CE2 4.31Å; W1107-Y1135 HydrophobicContact CD2-CG 4.21Å; W1107-Y1135 AromaticContact CE2-CD2 3.97Å; W1107-Y1135 AromaticContact CE3-CD2 3.84Å; W1107-Y1135 HydrophobicContact CE3-CD2 3.84Å; W1107-Y1135 HydrophobicContact CE3-CG 4.15Å; W1107-Y1135 AromaticContact CG-CD2 3.47Å; W1107-Y1135 HydrophobicContact CG-CD2 3.47Å; W1107-Y1135 VanDerWaalsContact CG-CD2 3.47Å; W1107-Y1135 AromaticContact CG-CE2 3.84Å; W1107-Y1135 HydrophobicContact CG-CE2 3.84Å; W1107-I1138 HydrophobicContact CZ2-CD1 3.56Å
1108	F	96.1	Very high	81.6	Confident	21 Å²	21	85.6 Å²	85.6	9%	0.092	44%	0.439	C	S	.	.	H	α-helix	trans	-68.1	-41.7	179.8	-176.7	-100.9	0	0	0	111.2	F1104 T1105 D1106 E1110 N1111 R1112 L1115 L1127 V1128	F1104-F1108 HydrophobicContact CE1-CB 4.3Å; F1104-F1108 HydrophobicContact CE2-CB 4.16Å; F1104-F1108 HydrophobicContact CE2-CD2 4.41Å; F1104-F1108 HydrophobicContact CZ-CB 3.93Å; F1104-F1108 AromaticContact CZ-CD2 3.96Å; F1104-F1108 HydrophobicContact CZ-CD2 3.96Å; F1104-F1108 HydrophobicContact CZ-CG 4.08Å; F1104-F1108 VanDerWaalsContact O-CB 3.31Å; F1104-F1108 WeakPolarHBondContact O-CB 3.11Å; F1104-F1108 PolarHBondContact O-N 3.14Å; T1105-F1108 PolarHBondContact O-N 2.76Å; D1106-F1108 PolarHBondContact O-N 3.07Å; F1108-E1110 VanDerWaalsContact C-N 3.33Å; F1108-E1110 PolarHBondContact O-N 3.3Å; F1108-N1111 PolarHBondContact O-N 2.9Å; F1108-R1112 WeakPolarHBondContact O-CA 3.48Å; F1108-R1112 WeakPolarHBondContact O-CB 3.24Å; F1108-R1112 PolarHBondContact O-N 3.37Å; F1108-L1115 HydrophobicContact CD2-CD1 4.05Å; F1108-L1115 HydrophobicContact CE2-CD1 3.8Å; F1108-L1127 HydrophobicContact CE2-CD2 4.48Å; F1108-L1127 HydrophobicContact CZ-CD2 4.14Å; F1108-V1128 HydrophobicContact CE1-CG2 3.74Å; F1108-V1128 HydrophobicContact CE2-CB 4.43Å; F1108-V1128 HydrophobicContact CE2-CG2 4.15Å; F1108-V1128 HydrophobicContact CZ-CB 4.22Å; F1108-V1128 HydrophobicContact CZ-CG2 3.48Å; F1108-V1128 VanDerWaalsContact CZ-CG2 3.48Å
1109	E	89	Confident	84.3	Confident	145 Å²	145	84.9 Å²	84.9	68%	0.678	43%	0.425	S	S	*	.	H	α-helix	trans	-62.6	-38.1	174.9	-69.9	-122.3	148.4	0	0	112.2	T1105 D1106	T1105-E1109 WeakPolarHBondContact O-CG 3.02Å; T1105-E1109 PolarHBondContact O-N 2.96Å; D1106-E1109 PolarHBondContact O-N 3.17Å
1110	E	89.8	Confident	86	Confident	162 Å²	162	85.4 Å²	85.4	76%	0.757	43%	0.434	S	S	*	.	H	α-helix	trans	-69.4	-31.4	176.4	-76.3	-173.9	168.1	0	0	113.7	D1106 W1107 F1108	D1106-E1110 PolarHBondContact O-N 2.93Å; D1106-E1110 VanDerWaalsContact O-N 3.16Å; W1107-E1110 PolarHBondContact O-N 3.42Å; F1108-E1110 VanDerWaalsContact C-N 3.33Å; F1108-E1110 PolarHBondContact O-N 3.3Å
1111	N	93.1	Very high	87.7	Confident	48 Å²	48	91.2 Å²	91.2	26%	0.257	46%	0.456	S	S	.	.	H	α-helix	trans	-104.8	3.3	-175.6	-64.7	-74	0	0	0	114	W1107 F1108 D1113 T1114 L1115	W1107-N1111 VanDerWaalsContact CD1-ND2 3.35Å; W1107-N1111 HydrophobicContact CH2-CB 4.36Å; W1107-N1111 HydrophobicContact CZ2-CB 4.27Å; W1107-N1111 PolarHBondContact NE1-ND2 3.36Å; W1107-N1111 PolarHBondContact O-N 3.18Å; W1107-N1111 VanDerWaalsContact O-N 3.09Å; W1107-N1111 PolarHBondContact O-ND2 2.53Å; F1108-N1111 PolarHBondContact O-N 2.9Å; N1111-D1113 PolarHBondContact O-N 3.3Å; N1111-T1114 WeakPolarHBondContact CA-OG1 3.48Å; N1111-T1114 PolarHBondContact O-N 3.3Å; N1111-T1114 PolarHBondContact O-OG1 3.41Å; N1111-L1115 WeakPolarHBondContact O-CG 3.35Å; N1111-L1115 PolarHBondContact O-N 2.84Å
1112	R	91.7	Very high	89.1	Confident	85 Å²	85	88.3 Å²	88.3	32%	0.321	44%	0.442	S	S	.	.	H	α-helix	trans	-58.8	-49	-176.7	-178	178.5	176.4	148.9	5.6	112.7	F1108 T1114 L1115 E1116	F1108-R1112 WeakPolarHBondContact O-CA 3.48Å; F1108-R1112 WeakPolarHBondContact O-CB 3.24Å; F1108-R1112 PolarHBondContact O-N 3.37Å; R1112-T1114 VanDerWaalsContact C-N 3.29Å; R1112-T1114 PolarHBondContact O-N 3.25Å; R1112-L1115 PolarHBondContact O-N 3.25Å; R1112-L1115 VanDerWaalsContact O-N 3.1Å; R1112-E1116 HydrophobicContact CG-CG 4.38Å; R1112-E1116 IonicContact CZ-OE1 2.7Å; R1112-E1116 IonicContact NE-OE1 3.38Å; R1112-E1116 PolarHBondContact NE-OE1 2.89Å; R1112-E1116 IonicContact NH2-OE1 3.74Å; R1112-E1116 PolarHBondContact NH2-OE1 3.07Å; R1112-E1116 VanDerWaalsContact NH2-OE1 3.07Å; R1112-E1116 PolarHBondContact O-N 3.03Å
1113	D	89.2	Confident	89.8	Confident	129 Å²	129	86.1 Å²	86.1	69%	0.69	44%	0.439	S	S	*	.	H	α-helix	trans	-60.9	-40	-177.4	-68.1	-17.7	0	0	0	111.3	N1111 E1116 E1117	N1111-D1113 PolarHBondContact O-N 3.3Å; D1113-E1116 PolarHBondContact O-N 3.46Å; D1113-E1117 PolarHBondContact O-N 2.76Å
1114	T	89	Confident	89.7	Confident	79 Å²	79	85.1 Å²	85.1	49%	0.485	44%	0.44	S	S	.	.	H	α-helix	trans	-66.3	-37.3	174.2	20.6	0	0	0	0	113.3	N1111 R1112 S1118	N1111-T1114 WeakPolarHBondContact CA-OG1 3.48Å; N1111-T1114 PolarHBondContact O-N 3.3Å; N1111-T1114 PolarHBondContact O-OG1 3.41Å; R1112-T1114 VanDerWaalsContact C-N 3.29Å; R1112-T1114 PolarHBondContact O-N 3.25Å; T1114-S1118 WeakPolarHBondContact O-CB 3.16Å; T1114-S1118 PolarHBondContact O-N 2.61Å; T1114-S1118 VanDerWaalsContact O-N 3.13Å; T1114-S1118 PolarHBondContact O-OG 3.45Å
1115	L	90.7	Very high	89.2	Confident	4 Å²	4	91.1 Å²	91.1	2%	0.021	47%	0.468	C	S	.	.	H	α-helix	trans	-69.4	-39	174.7	-74.2	169.1	0	0	0	111.3	F1108 N1111 R1112 S1118 Y1119 L1127 I1130	F1108-L1115 HydrophobicContact CD2-CD1 4.05Å; F1108-L1115 HydrophobicContact CE2-CD1 3.8Å; N1111-L1115 WeakPolarHBondContact O-CG 3.35Å; N1111-L1115 PolarHBondContact O-N 2.84Å; R1112-L1115 PolarHBondContact O-N 3.25Å; R1112-L1115 VanDerWaalsContact O-N 3.1Å; L1115-S1118 WeakPolarHBondContact CA-OG 3.34Å; L1115-S1118 PolarHBondContact O-N 3.3Å; L1115-S1118 PolarHBondContact O-OG 3.29Å; L1115-Y1119 HydrophobicContact CD2-CD2 4.34Å; L1115-Y1119 HydrophobicContact CD2-CE2 4.21Å; L1115-Y1119 WeakPolarHBondContact O-CB 3.21Å; L1115-Y1119 WeakPolarHBondContact O-CD2 3.33Å; L1115-Y1119 PolarHBondContact O-N 2.92Å; L1115-L1127 HydrophobicContact CB-CD2 3.74Å; L1115-L1127 HydrophobicContact CB-CG 4.1Å; L1115-I1130 HydrophobicContact CD2-CG2 4.09Å
1116	E	89.8	Confident	89.2	Confident	78 Å²	78	91.9 Å²	91.9	36%	0.364	47%	0.467	S	S	.	.	H	α-helix	trans	-67.8	-35.2	175.9	-71.2	-176.4	-177	0	0	112	R1112 D1113 Y1119 P1120 L1127	R1112-E1116 HydrophobicContact CG-CG 4.38Å; R1112-E1116 IonicContact CZ-OE1 2.7Å; R1112-E1116 IonicContact NE-OE1 3.38Å; R1112-E1116 PolarHBondContact NE-OE1 2.89Å; R1112-E1116 IonicContact NH2-OE1 3.74Å; R1112-E1116 PolarHBondContact NH2-OE1 3.07Å; R1112-E1116 VanDerWaalsContact NH2-OE1 3.07Å; R1112-E1116 PolarHBondContact O-N 3.03Å; D1113-E1116 PolarHBondContact O-N 3.46Å; E1116-Y1119 CarbonylContact O-C 3.56Å; E1116-P1120 WeakPolarHBondContact O-CA 3.15Å; E1116-L1127 HydrophobicContact CG-CD1 4.21Å; E1116-L1127 HydrophobicContact CG-CD2 3.73Å
1117	E	89.6	Confident	89.3	Confident	164 Å²	164	87.9 Å²	87.9	77%	0.766	45%	0.446	S	S	*	.	H	α-helix	trans	-70.7	-35.5	175.8	-169.7	172.8	-161.8	0	0	112.7	D1113	D1113-E1117 PolarHBondContact O-N 2.76Å
1118	S	90.1	Very high	89.2	Confident	71 Å²	71	88 Å²	88	50%	0.497	45%	0.451	S	S	.	.	H	α-helix	trans	-81.4	-26.8	179.1	46.7	0	0	0	0	113.4	T1114 L1115	T1114-S1118 WeakPolarHBondContact O-CB 3.16Å; T1114-S1118 PolarHBondContact O-N 2.61Å; T1114-S1118 VanDerWaalsContact O-N 3.13Å; T1114-S1118 PolarHBondContact O-OG 3.45Å; L1115-S1118 WeakPolarHBondContact CA-OG 3.34Å; L1115-S1118 PolarHBondContact O-N 3.3Å; L1115-S1118 PolarHBondContact O-OG 3.29Å
1119	Y	92	Very high	88.9	Confident	88 Å²	88	93.7 Å²	93.7	35%	0.345	47%	0.472	S	S	.	.			trans	-128.6	64.8	-179.4	-58.4	-78.4	0	0	0	112.8	L1115 E1116 E1121 V1122 I1130	L1115-Y1119 HydrophobicContact CD2-CD2 4.34Å; L1115-Y1119 HydrophobicContact CD2-CE2 4.21Å; L1115-Y1119 WeakPolarHBondContact O-CB 3.21Å; L1115-Y1119 WeakPolarHBondContact O-CD2 3.33Å; L1115-Y1119 PolarHBondContact O-N 2.92Å; E1116-Y1119 CarbonylContact O-C 3.56Å; Y1119-E1121 VanDerWaalsContact C-N 3.27Å; Y1119-E1121 PolarHBondContact O-N 2.92Å; Y1119-V1122 HydrophobicContact CD1-CG2 4.48Å; Y1119-V1122 PolarHBondContact O-N 3.19Å; Y1119-I1130 HydrophobicContact CD1-CD1 4.09Å; Y1119-I1130 HydrophobicContact CD2-CD1 4.32Å; Y1119-I1130 HydrophobicContact CD2-CG2 4.15Å; Y1119-I1130 HydrophobicContact CE1-CD1 4.3Å; Y1119-I1130 HydrophobicContact CE2-CG2 3.64Å; Y1119-I1130 HydrophobicContact CG-CD1 4.09Å
1120	P	84.2	Confident	89	Confident	106 Å²	106	88.6 Å²	88.6	69%	0.688	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.7	-172	26.8	-35.2	0	0	0	114.7	E1116	E1116-P1120 WeakPolarHBondContact O-CA 3.15Å
1121	E	87.8	Confident	89.2	Confident	192 Å²	192	80.9 Å²	80.9	90%	0.897	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	3	-177.8	-57.3	-164.3	-179.8	0	0	113.6	Y1119	Y1119-E1121 VanDerWaalsContact C-N 3.27Å; Y1119-E1121 PolarHBondContact O-N 2.92Å
1122	V	90.6	Very high	89.2	Confident	50 Å²	50	81.9 Å²	81.9	30%	0.303	42%	0.416	S	S	.	.	S	Bend	trans	-98.8	141.7	-169.5	179.7	0	0	0	0	111.2	Y1119 E1126 L1127 I1130	Y1119-V1122 HydrophobicContact CD1-CG2 4.48Å; Y1119-V1122 PolarHBondContact O-N 3.19Å; V1122-E1126 HydrophobicContact CG1-CB 3.4Å; V1122-E1126 HydrophobicContact CG1-CG 3.55Å; V1122-L1127 HydrophobicContact CB-CD1 4.42Å; V1122-I1130 HydrophobicContact CG1-CD1 4.13Å
1123	S	88.8	Confident	88.9	Confident	60 Å²	60	81.7 Å²	81.7	42%	0.42	43%	0.428	S	S	.	.			trans	-68.7	155.5	175.8	75.6	0	0	0	0	111.3	E1125 E1126 L1127	S1123-E1125 PolarHBondContact O-N 3.23Å; S1123-E1126 PolarHBondContact O-N 3.32Å; S1123-E1126 VanDerWaalsContact O-N 3.1Å; S1123-E1126 WeakPolarHBondContact OG-CB 3.29Å; S1123-E1126 PolarHBondContact OG-N 3.33Å; S1123-L1127 WeakPolarHBondContact O-CB 3.47Å; S1123-L1127 PolarHBondContact O-N 3.48Å
1124	V	81.9	Confident	89	Confident	85 Å²	85	79.6 Å²	79.6	52%	0.515	41%	0.414	S	S	.	.	H	α-helix	trans	-56.1	-37	179.8	-177.9	0	0	0	0	112.1	L1127 V1128	V1124-L1127 WeakPolarHBondContact O-CB 3.42Å; V1124-L1127 PolarHBondContact O-N 2.73Å; V1124-V1128 WeakPolarHBondContact O-CG2 3.4Å; V1124-V1128 PolarHBondContact O-N 3Å; V1124-V1128 VanDerWaalsContact O-N 3.1Å
1125	E	81.4	Confident	89.2	Confident	154 Å²	154	77.2 Å²	77.2	72%	0.72	40%	0.396	S	S	*	.	H	α-helix	trans	-68.5	-38.1	179.8	-66.5	158.5	176	0	0	112.5	S1123 R1129	S1123-E1125 PolarHBondContact O-N 3.23Å; E1125-R1129 PolarHBondContact O-N 2.73Å
1126	E	86	Confident	88.9	Confident	79 Å²	79	85.4 Å²	85.4	37%	0.369	43%	0.427	S	S	.	.	H	α-helix	trans	-75	-33.8	176.5	-165.7	98.4	-141.4	0	0	110.4	V1122 S1123 V1128 R1129 I1130	V1122-E1126 HydrophobicContact CG1-CB 3.4Å; V1122-E1126 HydrophobicContact CG1-CG 3.55Å; S1123-E1126 PolarHBondContact O-N 3.32Å; S1123-E1126 VanDerWaalsContact O-N 3.1Å; S1123-E1126 WeakPolarHBondContact OG-CB 3.29Å; S1123-E1126 PolarHBondContact OG-N 3.33Å; E1126-V1128 VanDerWaalsContact C-N 3.33Å; E1126-V1128 PolarHBondContact O-N 2.67Å; E1126-R1129 VanDerWaalsContact CD-CZ 3.49Å; E1126-R1129 WeakPolarHBondContact O-CB 3.33Å; E1126-R1129 PolarHBondContact O-N 3.32Å; E1126-R1129 VanDerWaalsContact O-N 3.13Å; E1126-R1129 IonicContact OE1-CZ 2.72Å; E1126-R1129 VanDerWaalsContact OE1-CZ 3.22Å; E1126-R1129 IonicContact OE1-NH1 3.59Å; E1126-R1129 PolarHBondContact OE1-NH1 3.38Å; E1126-R1129 IonicContact OE1-NH2 3.99Å; E1126-R1129 PolarHBondContact OE1-NH2 2.86Å; E1126-R1129 VanDerWaalsContact OE1-NH2 3.16Å; E1126-R1129 IonicContact OE2-CZ 3.28Å; E1126-R1129 IonicContact OE2-NH1 2.65Å; E1126-R1129 IonicContact OE2-NH2 3.38Å; E1126-R1129 PolarHBondContact OE2-NH2 3.25Å; E1126-I1130 WeakPolarHBondContact O-CG1 3.17Å; E1126-I1130 PolarHBondContact O-N 3.4Å
1127	L	90.9	Very high	88.5	Confident	5 Å²	5	84.8 Å²	84.8	3%	0.026	43%	0.431	C	S	.	.	H	α-helix	trans	-60.8	-39.6	173.2	-147.1	108.2	0	0	0	111.9	F1108 L1115 E1116 V1122 S1123 V1124 I1130 G1131	F1108-L1127 HydrophobicContact CE2-CD2 4.48Å; F1108-L1127 HydrophobicContact CZ-CD2 4.14Å; L1115-L1127 HydrophobicContact CB-CD2 3.74Å; L1115-L1127 HydrophobicContact CB-CG 4.1Å; E1116-L1127 HydrophobicContact CG-CD1 4.21Å; E1116-L1127 HydrophobicContact CG-CD2 3.73Å; V1122-L1127 HydrophobicContact CB-CD1 4.42Å; S1123-L1127 WeakPolarHBondContact O-CB 3.47Å; S1123-L1127 PolarHBondContact O-N 3.48Å; V1124-L1127 WeakPolarHBondContact O-CB 3.42Å; V1124-L1127 PolarHBondContact O-N 2.73Å; L1127-I1130 PolarHBondContact O-N 2.96Å; L1127-G1131 PolarHBondContact O-N 3.41Å
1128	V	92.1	Very high	88.3	Confident	44 Å²	44	80 Å²	80	27%	0.267	41%	0.41	S	S	.	.	H	α-helix	trans	-62.9	-41.3	173.7	173.3	0	0	0	0	111.4	F1104 F1108 V1124 E1126 G1131 Q1132	F1104-V1128 HydrophobicContact CE1-CG1 4.32Å; F1104-V1128 HydrophobicContact CZ-CG1 4.35Å; F1108-V1128 HydrophobicContact CE1-CG2 3.74Å; F1108-V1128 HydrophobicContact CE2-CB 4.43Å; F1108-V1128 HydrophobicContact CE2-CG2 4.15Å; F1108-V1128 HydrophobicContact CZ-CB 4.22Å; F1108-V1128 HydrophobicContact CZ-CG2 3.48Å; F1108-V1128 VanDerWaalsContact CZ-CG2 3.48Å; V1124-V1128 WeakPolarHBondContact O-CG2 3.4Å; V1124-V1128 PolarHBondContact O-N 3Å; V1124-V1128 VanDerWaalsContact O-N 3.1Å; E1126-V1128 VanDerWaalsContact C-N 3.33Å; E1126-V1128 PolarHBondContact O-N 2.67Å; V1128-G1131 PolarHBondContact O-N 3.25Å; V1128-Q1132 WeakPolarHBondContact O-CG 3.49Å; V1128-Q1132 PolarHBondContact O-N 3.27Å
1129	R	89.2	Confident	87.9	Confident	139 Å²	139	80 Å²	80	53%	0.525	40%	0.401	S	S	.	.	H	α-helix	trans	-64.3	-41.8	176.4	-85	-170.5	-81.4	131.7	-2.3	112.2	E1125 E1126 Q1132 S1133	E1125-R1129 PolarHBondContact O-N 2.73Å; E1126-R1129 VanDerWaalsContact CD-CZ 3.49Å; E1126-R1129 WeakPolarHBondContact O-CB 3.33Å; E1126-R1129 PolarHBondContact O-N 3.32Å; E1126-R1129 VanDerWaalsContact O-N 3.13Å; E1126-R1129 IonicContact OE1-CZ 2.72Å; E1126-R1129 VanDerWaalsContact OE1-CZ 3.22Å; E1126-R1129 IonicContact OE1-NH1 3.59Å; E1126-R1129 PolarHBondContact OE1-NH1 3.38Å; E1126-R1129 IonicContact OE1-NH2 3.99Å; E1126-R1129 PolarHBondContact OE1-NH2 2.86Å; E1126-R1129 VanDerWaalsContact OE1-NH2 3.16Å; E1126-R1129 IonicContact OE2-CZ 3.28Å; E1126-R1129 IonicContact OE2-NH1 2.65Å; E1126-R1129 IonicContact OE2-NH2 3.38Å; E1126-R1129 PolarHBondContact OE2-NH2 3.25Å; R1129-Q1132 PolarHBondContact O-N 3.18Å; R1129-S1133 PolarHBondContact O-N 3.15Å; R1129-S1133 VanDerWaalsContact O-N 3.16Å
1130	I	91.1	Very high	86.7	Confident	38 Å²	38	79.5 Å²	79.5	20%	0.195	41%	0.411	C	S	.	.	H	α-helix	trans	-61.8	-46.3	174.1	-65	169.3	0	0	0	110	L1115 Y1119 V1122 E1126 L1127 Q1132 S1133 E1134	L1115-I1130 HydrophobicContact CD2-CG2 4.09Å; Y1119-I1130 HydrophobicContact CD1-CD1 4.09Å; Y1119-I1130 HydrophobicContact CD2-CD1 4.32Å; Y1119-I1130 HydrophobicContact CD2-CG2 4.15Å; Y1119-I1130 HydrophobicContact CE1-CD1 4.3Å; Y1119-I1130 HydrophobicContact CE2-CG2 3.64Å; Y1119-I1130 HydrophobicContact CG-CD1 4.09Å; V1122-I1130 HydrophobicContact CG1-CD1 4.13Å; E1126-I1130 WeakPolarHBondContact O-CG1 3.17Å; E1126-I1130 PolarHBondContact O-N 3.4Å; L1127-I1130 PolarHBondContact O-N 2.96Å; I1130-Q1132 VanDerWaalsContact C-N 3.33Å; I1130-Q1132 PolarHBondContact O-N 2.99Å; I1130-S1133 WeakPolarHBondContact O-CB 3.47Å; I1130-S1133 PolarHBondContact O-N 3.09Å; I1130-S1133 VanDerWaalsContact O-N 3.12Å; I1130-E1134 PolarHBondContact O-N 3.45Å
1131	G	94.8	Very high	85.8	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-57.9	-41.5	175.8	0	0	0	0	0	113.2	W1107 L1127 V1128 S1133 E1134 Y1135	W1107-G1131 WeakPolarHBondContact CZ3-O 3.37Å; L1127-G1131 PolarHBondContact O-N 3.41Å; V1128-G1131 PolarHBondContact O-N 3.25Å; G1131-S1133 VanDerWaalsContact C-N 3.33Å; G1131-S1133 PolarHBondContact O-N 3.14Å; G1131-E1134 PolarHBondContact O-N 2.88Å; G1131-Y1135 VanDerWaalsContact O-CB 3.26Å; G1131-Y1135 WeakPolarHBondContact O-CB 3.25Å; G1131-Y1135 PolarHBondContact O-N 3.34Å
1132	Q	92.5	Very high	84.6	Confident	70 Å²	70	80 Å²	80	33%	0.327	40%	0.401	S	S	.	.	H	α-helix	trans	-63.3	-38.1	175.9	-74.1	-178.3	-3	0	0	112.8	F1104 V1128 R1129 I1130 R1136	F1104-Q1132 HydrophobicContact CD1-CG 4.32Å; F1104-Q1132 HydrophobicContact CD2-CG 4.24Å; F1104-Q1132 HydrophobicContact CE1-CG 3.65Å; F1104-Q1132 HydrophobicContact CE2-CB 4.18Å; F1104-Q1132 HydrophobicContact CE2-CG 3.57Å; F1104-Q1132 HydrophobicContact CZ-CB 4.23Å; F1104-Q1132 HydrophobicContact CZ-CG 3.23Å; V1128-Q1132 WeakPolarHBondContact O-CG 3.49Å; V1128-Q1132 PolarHBondContact O-N 3.27Å; R1129-Q1132 PolarHBondContact O-N 3.18Å; I1130-Q1132 VanDerWaalsContact C-N 3.33Å; I1130-Q1132 PolarHBondContact O-N 2.99Å; Q1132-R1136 VanDerWaalsContact O-CG 3.27Å; Q1132-R1136 WeakPolarHBondContact O-CG 3.26Å; Q1132-R1136 PolarHBondContact O-N 3.47Å; Q1132-R1136 VanDerWaalsContact O-N 3.13Å
1133	S	85.8	Confident	82.7	Confident	80 Å²	80	83.9 Å²	83.9	56%	0.559	42%	0.42	S	S	*	.	H	α-helix	trans	-64.4	-50.7	176.5	168.7	0	0	0	0	111.4	R1129 I1130 G1131 Y1135 R1136 S1137	R1129-S1133 PolarHBondContact O-N 3.15Å; R1129-S1133 VanDerWaalsContact O-N 3.16Å; I1130-S1133 WeakPolarHBondContact O-CB 3.47Å; I1130-S1133 PolarHBondContact O-N 3.09Å; I1130-S1133 VanDerWaalsContact O-N 3.12Å; G1131-S1133 VanDerWaalsContact C-N 3.33Å; G1131-S1133 PolarHBondContact O-N 3.14Å; S1133-Y1135 PolarHBondContact O-N 3.36Å; S1133-R1136 PolarHBondContact O-N 3.09Å; S1133-S1137 PolarHBondContact O-N 3.5Å; S1133-S1137 VanDerWaalsContact O-N 3.09Å
1134	E	90.1	Very high	80.4	Confident	85 Å²	85	83.6 Å²	83.6	40%	0.397	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-43.2	178.6	-72	-145.5	146.7	0	0	112	W1107 I1130 G1131 R1136 S1137 I1138	W1107-E1134 HydrophobicContact CH2-CB 3.92Å; I1130-E1134 PolarHBondContact O-N 3.45Å; G1131-E1134 PolarHBondContact O-N 2.88Å; E1134-R1136 VanDerWaalsContact C-N 3.33Å; E1134-R1136 PolarHBondContact O-N 2.91Å; E1134-S1137 WeakPolarHBondContact O-CB 3.43Å; E1134-S1137 PolarHBondContact O-N 2.87Å; E1134-S1137 VanDerWaalsContact O-N 3.12Å; E1134-I1138 WeakPolarHBondContact O-CG1 3.37Å; E1134-I1138 PolarHBondContact O-N 3.07Å
1135	Y	93.7	Very high	78.1	Confident	29 Å²	29	85.2 Å²	85.2	11%	0.114	44%	0.437	C	S	.	.	H	α-helix	trans	-58.3	-43.8	176.9	179.7	-105.5	0	0	0	112.2	E1103 F1104 W1107 G1131 S1133 S1137 I1138 K1139	E1103-Y1135 WeakPolarHBondContact CG-OH 3.29Å; E1103-Y1135 PolarHBondContact OE2-OH 2.91Å; E1103-Y1135 VanDerWaalsContact OE2-OH 3.07Å; F1104-Y1135 HydrophobicContact CB-CD1 4.35Å; F1104-Y1135 HydrophobicContact CB-CE1 4.22Å; F1104-Y1135 AromaticContact CD2-CD1 3.87Å; F1104-Y1135 HydrophobicContact CD2-CD1 3.87Å; F1104-Y1135 AromaticContact CD2-CG 3.85Å; F1104-Y1135 HydrophobicContact CD2-CG 3.85Å; W1107-Y1135 HydrophobicContact CB-CD2 3.9Å; W1107-Y1135 HydrophobicContact CB-CE2 3.87Å; W1107-Y1135 AromaticContact CD1-CD2 3.95Å; W1107-Y1135 AromaticContact CD2-CD2 3.46Å; W1107-Y1135 HydrophobicContact CD2-CD2 3.46Å; W1107-Y1135 VanDerWaalsContact CD2-CD2 3.46Å; W1107-Y1135 HydrophobicContact CD2-CE2 4.31Å; W1107-Y1135 HydrophobicContact CD2-CG 4.21Å; W1107-Y1135 AromaticContact CE2-CD2 3.97Å; W1107-Y1135 AromaticContact CE3-CD2 3.84Å; W1107-Y1135 HydrophobicContact CE3-CD2 3.84Å; W1107-Y1135 HydrophobicContact CE3-CG 4.15Å; W1107-Y1135 AromaticContact CG-CD2 3.47Å; W1107-Y1135 HydrophobicContact CG-CD2 3.47Å; W1107-Y1135 VanDerWaalsContact CG-CD2 3.47Å; W1107-Y1135 AromaticContact CG-CE2 3.84Å; W1107-Y1135 HydrophobicContact CG-CE2 3.84Å; G1131-Y1135 VanDerWaalsContact O-CB 3.26Å; G1131-Y1135 WeakPolarHBondContact O-CB 3.25Å; G1131-Y1135 PolarHBondContact O-N 3.34Å; S1133-Y1135 PolarHBondContact O-N 3.36Å; Y1135-S1137 VanDerWaalsContact C-N 3.33Å; Y1135-S1137 PolarHBondContact O-N 3.06Å; Y1135-I1138 PolarHBondContact O-N 2.88Å; Y1135-K1139 HydrophobicContact CE1-CD 4.02Å; Y1135-K1139 WeakPolarHBondContact O-CB 3.45Å; Y1135-K1139 PolarHBondContact O-N 3.29Å; Y1135-K1139 PolarHBondContact OH-NZ 3.43Å
1136	R	85	Confident	75.5	Confident	177 Å²	177	87.5 Å²	87.5	67%	0.668	45%	0.445	S	S	*	.	H	α-helix	trans	-63.6	-38.9	176.2	-73.4	176.8	-165	-164	6.9	112	Q1132 S1133 E1134 K1139 S1140	Q1132-R1136 VanDerWaalsContact O-CG 3.27Å; Q1132-R1136 WeakPolarHBondContact O-CG 3.26Å; Q1132-R1136 PolarHBondContact O-N 3.47Å; Q1132-R1136 VanDerWaalsContact O-N 3.13Å; S1133-R1136 PolarHBondContact O-N 3.09Å; E1134-R1136 VanDerWaalsContact C-N 3.33Å; E1134-R1136 PolarHBondContact O-N 2.91Å; R1136-K1139 PolarHBondContact O-N 2.89Å; R1136-S1140 WeakPolarHBondContact O-CB 3.16Å; R1136-S1140 PolarHBondContact O-N 3.42Å
1137	S	82.1	Confident	72.8	Confident	65 Å²	65	89.6 Å²	89.6	46%	0.455	46%	0.458	S	S	.	.	H	α-helix	trans	-64.2	-46.6	176.9	-164.7	0	0	0	0	111.4	S1133 E1134 Y1135 K1139 S1140 Q1141	S1133-S1137 PolarHBondContact O-N 3.5Å; S1133-S1137 VanDerWaalsContact O-N 3.09Å; E1134-S1137 WeakPolarHBondContact O-CB 3.43Å; E1134-S1137 PolarHBondContact O-N 2.87Å; E1134-S1137 VanDerWaalsContact O-N 3.12Å; Y1135-S1137 VanDerWaalsContact C-N 3.33Å; Y1135-S1137 PolarHBondContact O-N 3.06Å; S1137-K1139 PolarHBondContact O-N 2.94Å; S1137-S1140 PolarHBondContact O-N 3.5Å; S1137-S1140 PolarHBondContact O-OG 2.83Å; S1137-Q1141 PolarHBondContact O-N 3.35Å
1138	I	84.7	Confident	69.7	Low	63 Å²	63	92.3 Å²	92.3	32%	0.323	49%	0.488	S	S	.	.	H	α-helix	trans	-63	-41.4	176.3	-66.3	163.9	0	0	0	111.3	W1107 E1134 Y1135 S1140 Q1141 K1142	W1107-I1138 HydrophobicContact CZ2-CD1 3.56Å; E1134-I1138 WeakPolarHBondContact O-CG1 3.37Å; E1134-I1138 PolarHBondContact O-N 3.07Å; Y1135-I1138 PolarHBondContact O-N 2.88Å; I1138-S1140 VanDerWaalsContact C-N 3.34Å; I1138-Q1141 PolarHBondContact O-N 3.07Å; I1138-K1142 PolarHBondContact O-N 2.9Å
1139	K	80.8	Confident	66.6	Low	70 Å²	70	98.3 Å²	98.3	30%	0.304	51%	0.51	S	S	.	.	H	α-helix	trans	-63.2	-42.2	177.4	-163.8	163.7	-171.3	155.3	0	111	E1103 Y1135 R1136 S1137 Q1141 K1142 D1143	E1103-K1139 IonicContact OE2-NZ 3.56Å; E1103-K1139 PolarHBondContact OE2-NZ 2.78Å; Y1135-K1139 HydrophobicContact CE1-CD 4.02Å; Y1135-K1139 WeakPolarHBondContact O-CB 3.45Å; Y1135-K1139 PolarHBondContact O-N 3.29Å; Y1135-K1139 PolarHBondContact OH-NZ 3.43Å; R1136-K1139 PolarHBondContact O-N 2.89Å; S1137-K1139 PolarHBondContact O-N 2.94Å; K1139-Q1141 VanDerWaalsContact C-N 3.29Å; K1139-Q1141 PolarHBondContact O-N 3.49Å; K1139-K1142 PolarHBondContact O-N 3.4Å; K1139-D1143 PolarHBondContact O-N 3.41Å
1140	S	66.7	Low	63.6	Low	79 Å²	79	99.2 Å²	99.2	55%	0.552	53%	0.526	S	S	*	.	H	α-helix	trans	-61.7	-35.2	174.7	81.4	0	0	0	0	113.1	R1136 S1137 I1138 G1144	R1136-S1140 WeakPolarHBondContact O-CB 3.16Å; R1136-S1140 PolarHBondContact O-N 3.42Å; S1137-S1140 PolarHBondContact O-N 3.5Å; S1137-S1140 PolarHBondContact O-OG 2.83Å; I1138-S1140 VanDerWaalsContact C-N 3.34Å; S1140-G1144 PolarHBondContact O-N 3.35Å
1141	Q	66.3	Low	60.5	Low	143 Å²	143	106.5 Å²	106.5	67%	0.668	56%	0.556	S	S	*	*	H	α-helix	trans	-73.8	-39.4	175.5	-74	-171.6	-6.8	0	0	112.6	S1137 I1138 K1139 G1144	S1137-Q1141 PolarHBondContact O-N 3.35Å; I1138-Q1141 PolarHBondContact O-N 3.07Å; K1139-Q1141 VanDerWaalsContact C-N 3.29Å; K1139-Q1141 PolarHBondContact O-N 3.49Å; Q1141-G1144 PolarHBondContact O-N 3.21Å
1142	K	63.1	Low	57.2	Low	164 Å²	164	115.3 Å²	115.3	71%	0.713	60%	0.597	S	S	*	*	H	α-helix	trans	-64.2	-41	176.5	-93.3	-176.3	175.9	174.3	0	112.1	I1138 K1139 G1144	I1138-K1142 PolarHBondContact O-N 2.9Å; K1139-K1142 PolarHBondContact O-N 3.4Å; K1142-G1144 PolarHBondContact O-N 2.89Å
1143	D	50.3	Low	54	Low	132 Å²	132	120 Å²	120	71%	0.706	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-9.7	178.1	-67.4	-26.6	0	0	0	112.5	K1139	K1139-D1143 PolarHBondContact O-N 3.41Å
1144	G	40.1	Very low	51.2	Low	55 Å²	55	124.1 Å²	124.1	57%	0.567	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-1.3	-177.2	0	0	0	0	0	116.7	S1140 Q1141 K1142 F1146	S1140-G1144 PolarHBondContact O-N 3.35Å; Q1141-G1144 PolarHBondContact O-N 3.21Å; K1142-G1144 PolarHBondContact O-N 2.89Å; G1144-F1146 VanDerWaalsContact C-N 3.3Å; G1144-F1146 PolarHBondContact O-N 2.94Å
1145	V	32.9	Very low	48.1	Very low	118 Å²	118	128 Å²	128	72%	0.715	66%	0.662	S	S	*	*			trans	-86	71.8	-179.2	-169	0	0	0	0	111
1146	F	27.9	Very low	44.8	Very low	202 Å²	202	135.3 Å²	135.3	89%	0.886	70%	0.697	S	S	*	*			trans	-124.2	61.6	153.2	-137.2	-90.4	0	0	0	108.3	G1144 G1148	G1144-F1146 VanDerWaalsContact C-N 3.3Å; G1144-F1146 PolarHBondContact O-N 2.94Å; F1146-G1148 PolarHBondContact O-N 3.1Å; F1146-G1148 VanDerWaalsContact O-N 3.12Å
1147	D	29.2	Very low	42.1	Very low	123 Å²	123	134.5 Å²	134.5	66%	0.658	71%	0.706	S	S	*	*			trans	-76.3	91.6	170.8	-165.2	16.5	0	0	0	108.5	K1149	D1147-K1149 IonicContact OD2-NZ 3.73Å
1148	G	26.4	Very low	39.4	Very low	62 Å²	62	139.5 Å²	139.5	64%	0.639	73%	0.728	S	S	*	*			trans	-112.3	70.9	171.9	0	0	0	0	0	110	F1146 D1150	F1146-G1148 PolarHBondContact O-N 3.1Å; F1146-G1148 VanDerWaalsContact O-N 3.12Å; G1148-D1150 VanDerWaalsContact C-N 3.3Å; G1148-D1150 PolarHBondContact O-N 3.47Å
1149	K	25.5	Very low	36.9	Very low	170 Å²	170	142.9 Å²	142.9	74%	0.739	75%	0.751	S	S	*	*			trans	-53.9	88.6	162.2	-75.3	171.1	177.7	159.9	0	110.4	D1147	D1147-K1149 IonicContact OD2-NZ 3.73Å
1150	D	27	Very low	34.2	Very low	159 Å²	159	149 Å²	149	85%	0.85	78%	0.777	S	S	*	*			trans	-156.5	35.7	167.7	-96	-25.8	0	0	0	112.7	G1148	G1148-D1150 VanDerWaalsContact C-N 3.3Å; G1148-D1150 PolarHBondContact O-N 3.47Å
1151	K	26	Very low	32.1	Very low	190 Å²	190	156.9 Å²	156.9	83%	0.826	80%	0.795	S	S	*	*			trans	-128.7	11.7	175.9	-86.9	-168.9	177.3	179	0	116.9	N1153	K1151-N1153 PolarHBondContact O-N 3.1Å
1152	E	25.5	Very low	30.2	Very low	185 Å²	185	155.9 Å²	155.9	86%	0.864	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	0.2	177.5	-75.4	-167	152.9	0	0	115.5
1153	N	25.4	Very low	28.3	Very low	168 Å²	168	156.6 Å²	156.6	90%	0.898	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	21.4	-178	-94.1	-16.3	0	0	0	116.4	K1151	K1151-N1153 PolarHBondContact O-N 3.1Å
1154	L	26.1	Very low	27.3	Very low	167 Å²	167	155.8 Å²	155.8	87%	0.874	82%	0.816	S	S	*	*	S	Bend	trans	-124.8	11.3	177.6	-99	137	0	0	0	115.7
1155	L	24.9	Very low	26.5	Very low	167 Å²	167	162 Å²	162	87%	0.874	83%	0.83	S	S	*	*			trans	-106.4	56.1	175.7	-73.6	158.7	0	0	0	111.7
1156	Q	25.7	Very low	26.3	Very low	183 Å²	183	164.1 Å²	164.1	86%	0.855	84%	0.838	S	S	*	*			trans	-150.7	69	167.8	-138.6	165.3	19.8	0	0	111.3
1157	N	28.4	Very low	26.2	Very low	160 Å²	160	161.8 Å²	161.8	86%	0.856	83%	0.834	S	S	*	*			trans	-155.3	62.5	156	-94	-25.7	0	0	0	110	V1159	N1157-V1159 PolarHBondContact O-N 3.21Å
1158	N	24.4	Very low	26.3	Very low	170 Å²	170	163.2 Å²	163.2	91%	0.909	84%	0.842	S	S	*	*			trans	-81.8	91.6	162.4	-97.5	-24.1	0	0	0	108.6
1159	V	31.6	Very low	26.1	Very low	133 Å²	133	168.5 Å²	168.5	81%	0.806	86%	0.855	S	S	*	*			trans	-109.9	105.1	162.4	-178.8	0	0	0	0	108.8	N1157	N1157-V1159 PolarHBondContact O-N 3.21Å
1160	K	24.3	Very low	26.4	Very low	199 Å²	199	167.8 Å²	167.8	87%	0.865	86%	0.857	S	S	*	*			trans	-34.4	128.7	168.8	-61.7	170.3	176.1	179.6	0	113
1161	R	23.7	Very low	26.3	Very low	245 Å²	245	168.6 Å²	168.6	93%	0.925	86%	0.856	S	S	*	*			trans	-128.5	126.4	148.7	-112.4	-179.5	-179.1	179.9	-0.2	109.2
1162	P	26.6	Very low	26.4	Very low	122 Å²	122	165.9 Å²	165.9	79%	0.792	86%	0.86	S	S	*	*			trans	-82.6	151.5	-172.2	16.6	-2	0	0	0	112.2
1163	L	23.5	Very low	26.6	Very low	178 Å²	178	163.5 Å²	163.5	93%	0.932	85%	0.853	S	S	*	*			trans	-59	129.3	169.7	-71.5	147.4	0	0	0	110.2
1164	S	27.7	Very low	26.7	Very low	115 Å²	115	161.3 Å²	161.3	80%	0.804	85%	0.851	S	S	*	*			trans	-112.6	110.2	164.9	56.9	0	0	0	0	108.3
1165	E	23.4	Very low	26.9	Very low	185 Å²	185	158.1 Å²	158.1	86%	0.864	84%	0.842	S	S	*	*			trans	-58.9	128.5	161.9	-67.8	166.2	156.4	0	0	108.8
1166	N	29.4	Very low	27.3	Very low	163 Å²	163	154 Å²	154	87%	0.872	83%	0.832	S	S	*	*			trans	-159.4	114.8	149.6	-95.1	-22.1	0	0	0	107.3
1167	D	24.9	Very low	27.6	Very low	153 Å²	153	149 Å²	149	82%	0.818	82%	0.822	S	S	*	*			trans	-48.1	137.5	163.1	-66.4	-54.6	0	0	0	110.8
1168	D	31	Very low	27.9	Very low	153 Å²	153	150.5 Å²	150.5	82%	0.818	82%	0.821	S	S	*	*			trans	-168.7	125.6	134.3	-93.8	-27.7	0	0	0	110.8	I1170	D1168-I1170 PolarHBondContact O-N 3.26Å
1169	L	24.1	Very low	28.5	Very low	174 Å²	174	152 Å²	152	91%	0.911	81%	0.814	S	S	*	*			trans	-49.3	118.2	169.7	-89.1	73.3	0	0	0	111
1170	I	30.6	Very low	28.7	Very low	154 Å²	154	155.6 Å²	155.6	79%	0.79	81%	0.813	S	S	*	*			trans	-125.3	110	157.6	-61.2	-178.7	0	0	0	109.2	D1168 C1172	D1168-I1170 PolarHBondContact O-N 3.26Å; I1170-C1172 PolarHBondContact O-N 3.28Å
1171	Q	26.1	Very low	29.2	Very low	176 Å²	176	152.2 Å²	152.2	82%	0.822	80%	0.804	S	S	*	*			trans	-23.4	114.4	162.4	-86.7	166	-32.9	0	0	114.2	N1173	Q1171-N1173 PolarHBondContact O-N 2.96Å
1172	C	27.7	Very low	30	Very low	134 Å²	134	143.2 Å²	143.2	91%	0.905	78%	0.778	S	S	*	*			trans	-67.5	89.8	168.4	-65.1	0	0	0	0	110.2	I1170	I1170-C1172 PolarHBondContact O-N 3.28Å
1173	N	28.5	Very low	30.7	Very low	135 Å²	135	143.9 Å²	143.9	72%	0.722	77%	0.771	S	S	*	*			trans	-73.4	127.3	170.4	-103.1	-25	0	0	0	110.7	Q1171 S1175	Q1171-N1173 PolarHBondContact O-N 2.96Å; N1173-S1175 PolarHBondContact O-N 3.01Å
1174	S	28.2	Very low	31.4	Very low	121 Å²	121	142.9 Å²	142.9	85%	0.846	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	36	-166.1	51.7	0	0	0	0	117.2
1175	S	31.2	Very low	32.1	Very low	100 Å²	100	144 Å²	144	70%	0.699	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	-3	-178.4	60.5	0	0	0	0	115.6	N1173	N1173-S1175 PolarHBondContact O-N 3.01Å
1176	A	31.4	Very low	33	Very low	80 Å²	80	139.9 Å²	139.9	66%	0.661	74%	0.736	S	S	*	*	S	Bend	trans	-87.2	-17.5	-179.5	0	0	0	0	0	114.8	K1178	A1176-K1178 PolarHBondContact O-N 3.4Å
1177	A	33.8	Very low	33.5	Very low	78 Å²	78	137.1 Å²	137.1	65%	0.645	72%	0.721	S	S	*	*	H	α-helix	trans	-73.2	-24.7	-178.6	0	0	0	0	0	113.5	R1179	A1177-R1179 VanDerWaalsContact C-N 3.35Å; A1177-R1179 PolarHBondContact O-N 3.04Å
1178	K	34.7	Very low	34.1	Very low	192 Å²	192	133 Å²	133	84%	0.835	70%	0.701	S	S	*	*	H	α-helix	trans	-78.2	-10.7	-179.8	-80.2	-173.1	175.2	-178	0	115	A1176	A1176-K1178 PolarHBondContact O-N 3.4Å
1179	R	36.6	Very low	34.6	Very low	202 Å²	202	128.7 Å²	128.7	76%	0.762	68%	0.683	S	S	*	*	H	α-helix	trans	-93	-19.1	177	-81.3	-173.8	-174.2	160.8	3.2	114.9	A1177 S1182	A1177-R1179 VanDerWaalsContact C-N 3.35Å; A1177-R1179 PolarHBondContact O-N 3.04Å; R1179-S1182 PolarHBondContact O-OG 2.95Å
1180	R	34.7	Very low	35.4	Very low	208 Å²	208	127.5 Å²	127.5	79%	0.785	67%	0.671	S	S	*	*	H	α-helix	trans	-80.9	-25.2	177.8	-80.6	-171.7	174.7	-177	-0.4	113.9	F1184	R1180-F1184 PolarHBondContact O-N 3.05Å
1181	L	35	Very low	35.5	Very low	128 Å²	128	130.2 Å²	130.2	67%	0.67	67%	0.671	S	S	*	*	H	α-helix	trans	-71	-35	173.5	-92.4	145.8	0	0	0	112.5	E1183 F1184 E1185	L1181-E1183 VanDerWaalsContact C-N 3.33Å; L1181-E1183 PolarHBondContact O-N 3.3Å; L1181-F1184 PolarHBondContact O-N 3.5Å; L1181-E1185 PolarHBondContact O-N 2.83Å
1182	S	40.9	Very low	35.8	Very low	56 Å²	56	127.8 Å²	127.8	39%	0.392	66%	0.662	S	S	.	*	H	α-helix	trans	-73.2	-20.6	177.7	55.1	0	0	0	0	114.4	R1179 N1186	R1179-S1182 PolarHBondContact O-OG 2.95Å; S1182-N1186 PolarHBondContact O-ND2 2.86Å
1183	E	41.5	Very low	36.1	Very low	137 Å²	137	125.9 Å²	125.9	64%	0.64	65%	0.651	S	S	*	*	H	α-helix	trans	-78.9	-33.2	171.4	-81.3	179.9	162.5	0	0	111.4	L1181 N1186 D1187	L1181-E1183 VanDerWaalsContact C-N 3.33Å; L1181-E1183 PolarHBondContact O-N 3.3Å; E1183-N1186 PolarHBondContact O-N 3.26Å; E1183-D1187 PolarHBondContact O-N 3.34Å; E1183-D1187 VanDerWaalsContact O-N 3.12Å
1184	F	39.1	Very low	36.3	Very low	156 Å²	156	123.9 Å²	123.9	68%	0.684	65%	0.647	S	S	*	*	H	α-helix	trans	-69.7	-41	177.7	-158.7	-97.2	0	0	0	112.5	R1180 L1181 N1186 D1187 V1188	R1180-F1184 PolarHBondContact O-N 3.05Å; L1181-F1184 PolarHBondContact O-N 3.5Å; F1184-N1186 VanDerWaalsContact C-N 3.3Å; F1184-N1186 PolarHBondContact O-N 3.44Å; F1184-D1187 PolarHBondContact O-N 3.39Å; F1184-V1188 HydrophobicContact CD1-CG2 4.32Å; F1184-V1188 HydrophobicContact CE1-CG2 4.15Å; F1184-V1188 WeakPolarHBondContact O-CG2 3.47Å; F1184-V1188 PolarHBondContact O-N 3.2Å; F1184-V1188 VanDerWaalsContact O-N 3.16Å
1185	E	41.4	Very low	36.4	Very low	138 Å²	138	127 Å²	127	65%	0.645	65%	0.646	S	S	*	*	H	α-helix	trans	-65.6	-31.6	174.3	-79.6	-176.3	154.8	0	0	112.9	L1181 S1189	L1181-E1185 PolarHBondContact O-N 2.83Å; E1185-S1189 VanDerWaalsContact O-CB 3.32Å; E1185-S1189 WeakPolarHBondContact O-CB 3.36Å; E1185-S1189 PolarHBondContact O-N 3.36Å; E1185-S1189 PolarHBondContact O-OG 2.87Å
1186	N	42.2	Very low	36.4	Very low	99 Å²	99	126.3 Å²	126.3	53%	0.529	65%	0.646	S	S	.	*	H	α-helix	trans	-74.8	-33.2	177.7	-84.5	-44.9	0	0	0	113.1	S1182 E1183 F1184 K1190	S1182-N1186 PolarHBondContact O-ND2 2.86Å; E1183-N1186 PolarHBondContact O-N 3.26Å; F1184-N1186 VanDerWaalsContact C-N 3.3Å; F1184-N1186 PolarHBondContact O-N 3.44Å; N1186-K1190 WeakPolarHBondContact O-CG 3.35Å; N1186-K1190 PolarHBondContact O-N 3.49Å
1187	D	40.6	Very low	36.3	Very low	105 Å²	105	131.7 Å²	131.7	56%	0.561	66%	0.655	S	S	*	*	H	α-helix	trans	-76.7	-31.8	176.8	-91.6	-5.5	0	0	0	112.9	E1183 F1184 K1190 R1191	E1183-D1187 PolarHBondContact O-N 3.34Å; E1183-D1187 VanDerWaalsContact O-N 3.12Å; F1184-D1187 PolarHBondContact O-N 3.39Å; D1187-K1190 PolarHBondContact O-N 2.87Å; D1187-R1191 PolarHBondContact O-N 2.91Å; D1187-R1191 VanDerWaalsContact O-N 3.16Å
1188	V	36.3	Very low	36.2	Very low	67 Å²	67	133.4 Å²	133.4	41%	0.406	66%	0.661	S	S	.	*	H	α-helix	trans	-68.1	-41.9	170.4	177.5	0	0	0	0	110.5	F1184 K1190 R1191 I1192	F1184-V1188 HydrophobicContact CD1-CG2 4.32Å; F1184-V1188 HydrophobicContact CE1-CG2 4.15Å; F1184-V1188 WeakPolarHBondContact O-CG2 3.47Å; F1184-V1188 PolarHBondContact O-N 3.2Å; F1184-V1188 VanDerWaalsContact O-N 3.16Å; V1188-K1190 VanDerWaalsContact C-N 3.3Å; V1188-K1190 PolarHBondContact O-N 3.24Å; V1188-R1191 PolarHBondContact O-N 2.63Å; V1188-R1191 VanDerWaalsContact O-N 3.16Å; V1188-I1192 HydrophobicContact CG1-CD1 4.02Å; V1188-I1192 PolarHBondContact O-N 3.05Å; V1188-I1192 VanDerWaalsContact O-N 3.1Å
1189	S	41.5	Very low	35.9	Very low	63 Å²	63	133.1 Å²	133.1	44%	0.441	66%	0.662	S	S	.	*	H	α-helix	trans	-64	-33.7	176.4	-60.5	0	0	0	0	112.7	E1185 S1193	E1185-S1189 VanDerWaalsContact O-CB 3.32Å; E1185-S1189 WeakPolarHBondContact O-CB 3.36Å; E1185-S1189 PolarHBondContact O-N 3.36Å; E1185-S1189 PolarHBondContact O-OG 2.87Å; S1189-S1193 WeakPolarHBondContact O-CB 3.32Å; S1189-S1193 PolarHBondContact O-N 2.99Å; S1189-S1193 PolarHBondContact O-OG 2.78Å
1190	K	40.5	Very low	35.6	Very low	149 Å²	149	130.9 Å²	130.9	65%	0.648	67%	0.666	S	S	*	*	H	α-helix	trans	-70.1	-33.5	173.4	-82.1	179.5	-178.7	170.6	0	113.4	N1186 D1187 V1188	N1186-K1190 WeakPolarHBondContact O-CG 3.35Å; N1186-K1190 PolarHBondContact O-N 3.49Å; D1187-K1190 PolarHBondContact O-N 2.87Å; V1188-K1190 VanDerWaalsContact C-N 3.3Å; V1188-K1190 PolarHBondContact O-N 3.24Å
1191	R	33.7	Very low	35.3	Very low	211 Å²	211	126.7 Å²	126.7	80%	0.796	67%	0.668	S	S	*	*	H	α-helix	trans	-73.7	-29.5	175.7	-79.6	-174.4	176	179.8	0.3	113.2	D1187 V1188 S1194	D1187-R1191 PolarHBondContact O-N 2.91Å; D1187-R1191 VanDerWaalsContact O-N 3.16Å; V1188-R1191 PolarHBondContact O-N 2.63Å; V1188-R1191 VanDerWaalsContact O-N 3.16Å; R1191-S1194 PolarHBondContact O-OG 3.47Å
1192	I	33.2	Very low	35.1	Very low	124 Å²	124	125.9 Å²	125.9	64%	0.636	67%	0.674	S	S	*	*	H	α-helix	trans	-79.1	-30.8	175.5	-64.5	169.5	0	0	0	111	V1188 S1194 F1195	V1188-I1192 HydrophobicContact CG1-CD1 4.02Å; V1188-I1192 PolarHBondContact O-N 3.05Å; V1188-I1192 VanDerWaalsContact O-N 3.1Å; I1192-S1194 VanDerWaalsContact C-N 3.25Å; I1192-S1194 PolarHBondContact O-N 3.09Å; I1192-F1195 PolarHBondContact O-N 2.87Å
1193	S	32.8	Very low	34.7	Very low	95 Å²	95	136.4 Å²	136.4	66%	0.664	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-7	179.8	-58.8	0	0	0	0	115	S1189 F1195	S1189-S1193 WeakPolarHBondContact O-CB 3.32Å; S1189-S1193 PolarHBondContact O-N 2.99Å; S1189-S1193 PolarHBondContact O-OG 2.78Å; S1193-F1195 VanDerWaalsContact C-N 3.3Å; S1193-F1195 PolarHBondContact O-N 3.36Å
1194	S	33.3	Very low	34.3	Very low	93 Å²	93	136.4 Å²	136.4	65%	0.65	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-3.8	175.5	45.6	0	0	0	0	114.8	R1191 I1192 A1196	R1191-S1194 PolarHBondContact O-OG 3.47Å; I1192-S1194 VanDerWaalsContact C-N 3.25Å; I1192-S1194 PolarHBondContact O-N 3.09Å; S1194-A1196 VanDerWaalsContact C-N 3.34Å; S1194-A1196 PolarHBondContact O-N 3.38Å
1195	F	29.5	Very low	34.1	Very low	186 Å²	186	135.4 Å²	135.4	82%	0.816	72%	0.718	S	S	*	*			trans	-91.4	66.7	169.2	-90.5	-88.8	0	0	0	111.1	I1192 S1193 F1197	I1192-F1195 PolarHBondContact O-N 2.87Å; S1193-F1195 VanDerWaalsContact C-N 3.3Å; S1193-F1195 PolarHBondContact O-N 3.36Å; F1195-F1197 PolarHBondContact O-N 3.05Å
1196	A	30.8	Very low	33.7	Very low	85 Å²	85	135.2 Å²	135.2	70%	0.702	72%	0.722	S	S	*	*			trans	-75.4	101.8	168.4	0	0	0	0	0	109.4	S1194 C1198	S1194-A1196 VanDerWaalsContact C-N 3.34Å; S1194-A1196 PolarHBondContact O-N 3.38Å; A1196-C1198 PolarHBondContact O-N 3.22Å; A1196-C1198 VanDerWaalsContact O-N 3.14Å
1197	F	29.5	Very low	33.2	Very low	194 Å²	194	137.4 Å²	137.4	85%	0.851	73%	0.733	S	S	*	*			trans	-62.2	108.9	165	-110.9	-95.5	0	0	0	108.5	F1195 Q1199	F1195-F1197 PolarHBondContact O-N 3.05Å; F1197-Q1199 PolarHBondContact O-N 3.4Å
1198	C	31.9	Very low	32.7	Very low	113 Å²	113	139.4 Å²	139.4	76%	0.764	74%	0.744	S	S	*	*			trans	-64.5	99.7	168.5	-73.7	0	0	0	0	108.8	A1196 N1200	A1196-C1198 PolarHBondContact O-N 3.22Å; A1196-C1198 VanDerWaalsContact O-N 3.14Å; C1198-N1200 PolarHBondContact O-N 2.94Å
1199	Q	29.2	Very low	32.5	Very low	186 Å²	186	144.2 Å²	144.2	87%	0.869	77%	0.766	S	S	*	*			trans	-57.8	105	165.7	-87	-179.4	-19.4	0	0	109	F1197 S1201	F1197-Q1199 PolarHBondContact O-N 3.4Å; Q1199-S1201 PolarHBondContact O-N 3.31Å
1200	N	30.4	Very low	31.8	Very low	156 Å²	156	150 Å²	150	83%	0.834	79%	0.789	S	S	*	*			trans	-71	95.5	164.3	-90.7	-21	0	0	0	108.1	C1198 S1202	C1198-N1200 PolarHBondContact O-N 2.94Å; N1200-S1202 VanDerWaalsContact C-N 3.35Å; N1200-S1202 PolarHBondContact O-N 3.06Å; N1200-S1202 VanDerWaalsContact O-N 3.07Å
1201	S	27.3	Very low	31.2	Very low	120 Å²	120	150.1 Å²	150.1	84%	0.839	80%	0.8	S	S	*	*			trans	-72.6	89.9	163.5	63.7	0	0	0	0	109.1	Q1199	Q1199-S1201 PolarHBondContact O-N 3.31Å
1202	S	31.7	Very low	30.9	Very low	111 Å²	111	145 Å²	145	78%	0.776	80%	0.801	S	S	*	*			trans	-89.5	110.1	155.4	54.4	0	0	0	0	108.1	N1200	N1200-S1202 VanDerWaalsContact C-N 3.35Å; N1200-S1202 PolarHBondContact O-N 3.06Å; N1200-S1202 VanDerWaalsContact O-N 3.07Å
1203	K	31.7	Very low	30.7	Very low	277 Å²	277	146.9 Å²	146.9	100%	1.204	82%	0.815	S	S	*	*			trans	-65.1	0	150	-83.1	-177.1	173.7	-179.9	0	110.3

Retrieved 1,203 of 1,203 residues in 726.2 ms (Link to these results)

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