A0A087XAQ3_POEFO Loading...

Trafficking protein particle complex subunit 8

AlphaFold DB , UniProt , Accession A0A087XAQ3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,032 aa.

						>A0A087XAQ3_POEFO|A0A087XAQ3
MVYEDMKQRYGPQGCYLLKINSRASSPEEEEQIPDPWSQYLHKQNLRNQEVLQLAPAANVASAQDGVVAPEADSGDSTEKGAGGSGCLDTHPLQLDTDSCTASLLTLSPVDADGKKSTGDTDSLAAATGNHGTCLTLNDHDRIRQFIQEFTFRGLLPHIEKNIRQLNDQLVSRKGLSRSLFTATKKFFGGGKVPEKSINEPKSTYGLQYPPEAPELQIRKMADLCFLVQHYELAYSCYHTAKKDFLSDQAMLYAAGALEMAAVSAFLQGGASRPYPSHYMDTAIQTYRDVCKNMMLAERCALLSAEILKSQAKYSEAATLLIKMTSEDSDLRSALLLEQAAHCFINMRNPMVRKFAFHMILAGHRFSKAGQRRHALRCYSQAMQVYKDRGWSLAEDHINFTIGRQSFTLGQPENALQAFRQILINDSRQTATQQAAFLREYLYVVKSVLGENESCLPQLPLPHIHSSATRVYFGHERRLAEGDKQAATHVSLDQEYDQDLSVLWCQLEEQLAASANRGILPSNFQATQCCLNSQTNNLHHPLAVIEEPIIVEVTFRNPLKVSLLLSNLSLLWRFSTGTPLGGKESSEQISEEMITNEDTSAGEKEEIVTTEIIKEFYLGSEETKTARLKLLPHRTGQLNIVGVIYNLTSSHLGEASSNTDGQQMLDSMIIRGRQDLKIQGPRLNLTKEDKMQVRYGADRRLEPIITPPMPLMEVFFLQFPTALLCGEIRKAYVEFCNVSAVALCGLRVASTHPDFFTFGSQSTAPFTPPSPGSAENCSAYVTFPSPLQPGSMSSETLVSAPACSQPSRVTEIPIHGGTLQPGQSVRLPLWLRGPDQEGVHEINFLFYYENTEKGLKISHRVLRHTVFICASRSLSVQASACRSSASPHHSLDDKGSGGTLVFIDVENVNASESGVREFHIVQVSSSSQHWRLHKYINPCNNYGKSILKGTVSLLKCFFFLSLSFFSAYFLVPKGSTKVLQFNSNYYKHNTSYCMDHGLFFNHKHNSEHTRNDGRLNGLLVFDQSSLLKQSCF
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.8	Very low	59	Low	212 Å²	212	110.5 Å²	110.5	100%	1.044	52%	0.522	S	S	*	.				0	-68.5	0	-144.1	159.8	69.3	0	0	111.2	Y3 E4 D5	M1-Y3 VanDerWaalsContact C-N 3.3Å; M1-Y3 PolarHBondContact O-N 3.5Å; M1-E4 PolarHBondContact O-N 3.46Å; M1-E4 VanDerWaalsContact O-N 3.1Å; M1-D5 PolarHBondContact O-N 2.88Å
2	V	50.3	Low	59.1	Low	110 Å²	110	109.5 Å²	109.5	67%	0.667	53%	0.531	S	S	*	.	H	α-helix	trans	-51.5	-42.2	179.8	-177.8	0	0	0	0	113.8	E4 D5 M6	V2-E4 VanDerWaalsContact C-N 3.33Å; V2-E4 PolarHBondContact O-N 3.26Å; V2-D5 PolarHBondContact O-N 2.81Å; V2-M6 HydrophobicContact CG1-CG 4.28Å; V2-M6 HydrophobicContact CG1-SD 4.06Å; V2-M6 WeakPolarHBondContact O-CG 3.37Å; V2-M6 PolarHBondContact O-N 3.31Å
3	Y	53.8	Low	59.1	Low	88 Å²	88	114.5 Å²	114.5	35%	0.345	55%	0.553	S	S	.	*	H	α-helix	trans	-57.7	-37.6	178.9	179.9	-129.3	0	0	0	114.4	M1 K7 L18	M1-Y3 VanDerWaalsContact C-N 3.3Å; M1-Y3 PolarHBondContact O-N 3.5Å; Y3-K7 HydrophobicContact CE1-CD 4.49Å; Y3-K7 WeakPolarHBondContact O-CG 3.27Å; Y3-K7 PolarHBondContact O-N 3.01Å; Y3-K7 WeakPolarHBondContact OH-CE 3.45Å; Y3-L18 HydrophobicContact CD2-CB 3.69Å; Y3-L18 HydrophobicContact CD2-CD1 3.7Å; Y3-L18 HydrophobicContact CD2-CG 4.3Å; Y3-L18 HydrophobicContact CE2-CB 3.65Å; Y3-L18 HydrophobicContact CE2-CD1 4.12Å
4	E	60.7	Low	59	Low	100 Å²	100	109.1 Å²	109.1	47%	0.467	54%	0.543	S	S	.	.	H	α-helix	trans	-77.9	-35.5	178.9	-64	-54.4	133.9	0	0	111.8	M1 V2 M6 K7 Q8	M1-E4 PolarHBondContact O-N 3.46Å; M1-E4 VanDerWaalsContact O-N 3.1Å; V2-E4 VanDerWaalsContact C-N 3.33Å; V2-E4 PolarHBondContact O-N 3.26Å; E4-M6 VanDerWaalsContact C-N 3.33Å; E4-M6 PolarHBondContact O-N 3.39Å; E4-K7 PolarHBondContact O-N 2.85Å; E4-K7 IonicContact OE1-NZ 2.67Å; E4-K7 PolarHBondContact OE1-NZ 3.01Å; E4-K7 WeakPolarHBondContact OE2-CD 3.37Å; E4-K7 IonicContact OE2-NZ 3.35Å; E4-K7 PolarHBondContact OE2-NZ 2.58Å; E4-Q8 PolarHBondContact O-N 3.32Å
5	D	61.8	Low	58.9	Low	67 Å²	67	102.3 Å²	102.3	36%	0.358	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-39	172.8	-166.2	69.5	0	0	0	111.2	M1 V2 Q8 R9	M1-D5 PolarHBondContact O-N 2.88Å; V2-D5 PolarHBondContact O-N 2.81Å; D5-Q8 PolarHBondContact O-N 3.4Å; D5-R9 WeakPolarHBondContact O-CG 3.42Å; D5-R9 PolarHBondContact O-N 3.03Å; D5-R9 IonicContact OD1-NH2 3.45Å; D5-R9 IonicContact OD2-CZ 3.55Å; D5-R9 IonicContact OD2-NE 3.2Å; D5-R9 PolarHBondContact OD2-NE 3.23Å; D5-R9 IonicContact OD2-NH2 3.78Å; D5-R9 PolarHBondContact OD2-NH2 2.87Å
6	M	53.8	Low	58.8	Low	65 Å²	65	101.6 Å²	101.6	32%	0.32	50%	0.5	S	S	.	.	H	α-helix	trans	-67.2	-41.7	173.5	-67.4	-174.1	91	0	0	112.5	V2 E4 Q8 R9 Y10 C15 L18	V2-M6 HydrophobicContact CG1-CG 4.28Å; V2-M6 HydrophobicContact CG1-SD 4.06Å; V2-M6 WeakPolarHBondContact O-CG 3.37Å; V2-M6 PolarHBondContact O-N 3.31Å; E4-M6 VanDerWaalsContact C-N 3.33Å; E4-M6 PolarHBondContact O-N 3.39Å; M6-Q8 VanDerWaalsContact C-N 3.29Å; M6-Q8 PolarHBondContact O-N 2.81Å; M6-R9 PolarHBondContact O-N 2.78Å; M6-Y10 HydrophobicContact CB-CD2 4.4Å; M6-Y10 HydrophobicContact CE-CE2 4.34Å; M6-Y10 WeakPolarHBondContact O-CD2 3.13Å; M6-Y10 PolarHBondContact O-N 2.99Å; M6-C15 VanDerWaalsContact C-SG 3.52Å; M6-C15 PolarHBondContact O-SG 3.27Å; M6-C15 VanDerWaalsContact O-SG 3.34Å; M6-L18 HydrophobicContact CB-CD1 3.83Å; M6-L18 HydrophobicContact CE-CD1 4.47Å; M6-L18 HydrophobicContact CE-CD2 4.45Å; M6-L18 HydrophobicContact CG-CD1 4.44Å; M6-L18 HydrophobicContact SD-CD1 3.81Å; M6-L18 HydrophobicContact SD-CD2 3.94Å
7	K	64.3	Low	58.6	Low	54 Å²	54	98.4 Å²	98.4	24%	0.235	49%	0.485	C	S	.	.	H	α-helix	trans	-59.2	-37.9	171.1	-78.7	174.6	-180	169.2	0	112.8	Y3 E4 G11 C15	Y3-K7 HydrophobicContact CE1-CD 4.49Å; Y3-K7 WeakPolarHBondContact O-CG 3.27Å; Y3-K7 PolarHBondContact O-N 3.01Å; Y3-K7 WeakPolarHBondContact OH-CE 3.45Å; E4-K7 PolarHBondContact O-N 2.85Å; E4-K7 IonicContact OE1-NZ 2.67Å; E4-K7 PolarHBondContact OE1-NZ 3.01Å; E4-K7 WeakPolarHBondContact OE2-CD 3.37Å; E4-K7 IonicContact OE2-NZ 3.35Å; E4-K7 PolarHBondContact OE2-NZ 2.58Å; K7-G11 CarbonylContact O-C 3.4Å; K7-G11 WeakPolarHBondContact O-CA 3.37Å; K7-G11 PolarHBondContact O-N 2.95Å; K7-C15 HydrophobicContact CG-CB 3.97Å
8	Q	67.4	Low	58.4	Low	164 Å²	164	97.2 Å²	97.2	77%	0.766	48%	0.48	S	S	*	.	H	α-helix	trans	-65.7	-41.5	174.8	-92.8	-173.9	-23.6	0	0	112.1	E4 D5 M6	E4-Q8 PolarHBondContact O-N 3.32Å; D5-Q8 PolarHBondContact O-N 3.4Å; M6-Q8 VanDerWaalsContact C-N 3.29Å; M6-Q8 PolarHBondContact O-N 2.81Å
9	R	65.4	Low	58.6	Low	175 Å²	175	97.9 Å²	97.9	66%	0.66	48%	0.48	S	S	*	.	H	α-helix	trans	-75.8	-38.8	-178.2	-68.4	-179	-157.3	-133.7	4.1	114.6	D5 M6	D5-R9 WeakPolarHBondContact O-CG 3.42Å; D5-R9 PolarHBondContact O-N 3.03Å; D5-R9 IonicContact OD1-NH2 3.45Å; D5-R9 IonicContact OD2-CZ 3.55Å; D5-R9 IonicContact OD2-NE 3.2Å; D5-R9 PolarHBondContact OD2-NE 3.23Å; D5-R9 IonicContact OD2-NH2 3.78Å; D5-R9 PolarHBondContact OD2-NH2 2.87Å; M6-R9 PolarHBondContact O-N 2.78Å
10	Y	60.3	Low	58.8	Low	155 Å²	155	96.5 Å²	96.5	61%	0.608	47%	0.474	S	S	*	.	H	α-helix	trans	-113.5	-0.3	-171	-56.3	-70.3	0	0	0	114	M6	M6-Y10 HydrophobicContact CB-CD2 4.4Å; M6-Y10 HydrophobicContact CE-CE2 4.34Å; M6-Y10 WeakPolarHBondContact O-CD2 3.13Å; M6-Y10 PolarHBondContact O-N 2.99Å
11	G	65.5	Low	59	Low	26 Å²	26	96.5 Å²	96.5	27%	0.268	48%	0.476	S	S	.	.			trans	75.6	152	-174.9	0	0	0	0	0	112.8	K7 Q13 G14 C15	K7-G11 CarbonylContact O-C 3.4Å; K7-G11 WeakPolarHBondContact O-CA 3.37Å; K7-G11 PolarHBondContact O-N 2.95Å; G11-Q13 PolarHBondContact O-N 2.81Å; G11-G14 PolarHBondContact O-N 2.95Å; G11-C15 PolarHBondContact O-N 2.98Å; G11-C15 PolarHBondContact O-SG 2.88Å
12	P	60.7	Low	60.2	Low	98 Å²	98	89.2 Å²	89.2	64%	0.636	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-61.3	-29.9	-179.9	24.1	-33.5	0	0	0	112.9	G14 C15	P12-G14 VanDerWaalsContact C-N 3.33Å; P12-C15 PolarHBondContact O-N 2.85Å
13	Q	58.6	Low	61	Low	174 Å²	174	88.7 Å²	88.7	81%	0.813	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-67.4	-30.8	175	-53.5	-67.1	4.1	0	0	112.6	G11 Y16	G11-Q13 PolarHBondContact O-N 2.81Å; Q13-Y16 WeakPolarHBondContact O-CD1 3.28Å
14	G	56.9	Low	61.4	Low	40 Å²	40	88 Å²	88	41%	0.412	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-83.5	-10	177.7	0	0	0	0	0	114.3	G11 P12	G11-G14 PolarHBondContact O-N 2.95Å; P12-G14 VanDerWaalsContact C-N 3.33Å
15	C	57.8	Low	61	Low	6 Å²	6	89.6 Å²	89.6	4%	0.041	47%	0.467	C	S	.	.			trans	-105.6	10.8	-171.2	-71.8	0	0	0	0	114.8	M6 K7 G11 P12 L17 L18	M6-C15 VanDerWaalsContact C-SG 3.52Å; M6-C15 PolarHBondContact O-SG 3.27Å; M6-C15 VanDerWaalsContact O-SG 3.34Å; K7-C15 HydrophobicContact CG-CB 3.97Å; G11-C15 PolarHBondContact O-N 2.98Å; G11-C15 PolarHBondContact O-SG 2.88Å; P12-C15 PolarHBondContact O-N 2.85Å; C15-L17 PolarHBondContact O-N 2.99Å; C15-L17 VanDerWaalsContact O-N 3.1Å; C15-L18 HydrophobicContact CB-CD1 4.08Å; C15-L18 PolarHBondContact O-N 2.84Å
16	Y	57	Low	60.5	Low	92 Å²	92	90.2 Å²	90.2	36%	0.361	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-57.8	-24.1	179	70.2	-73.4	0	0	0	114.1	Q13 L18 E149	Q13-Y16 WeakPolarHBondContact O-CD1 3.28Å; Y16-L18 VanDerWaalsContact C-N 3.34Å; Y16-E149 PolarHBondContact OH-OE2 2.85Å
17	L	55.6	Low	60.3	Low	47 Å²	47	93.6 Å²	93.6	25%	0.246	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-79.1	-10.6	-177.8	-56.9	171.7	0	0	0	114.5	C15 K19 I20 F146	C15-L17 PolarHBondContact O-N 2.99Å; C15-L17 VanDerWaalsContact O-N 3.1Å; L17-K19 PolarHBondContact O-N 3.3Å; L17-I20 VanDerWaalsContact O-CD1 3.31Å; L17-I20 WeakPolarHBondContact O-CD1 3.17Å; L17-I20 WeakPolarHBondContact O-CG1 3.31Å; L17-F146 HydrophobicContact CD1-CD2 3.33Å; L17-F146 HydrophobicContact CD1-CE2 3.35Å; L17-F146 HydrophobicContact CD1-CG 4.09Å; L17-F146 HydrophobicContact CD1-CZ 4.13Å; L17-F146 HydrophobicContact CD2-CB 3.5Å; L17-F146 HydrophobicContact CD2-CD1 4.47Å; L17-F146 HydrophobicContact CD2-CD2 3.45Å; L17-F146 VanDerWaalsContact CD2-CD2 3.45Å; L17-F146 HydrophobicContact CD2-CE2 4.33Å; L17-F146 HydrophobicContact CD2-CG 3.52Å; L17-F146 HydrophobicContact CG-CD2 4.02Å; L17-F146 HydrophobicContact CG-CE2 4.48Å; L17-F146 HydrophobicContact CG-CG 4.45Å
18	L	55.9	Low	59.5	Low	76 Å²	76	99 Å²	99	40%	0.398	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-80.7	5.2	176.5	-68.3	164.8	0	0	0	112.4	Y3 M6 C15 Y16	Y3-L18 HydrophobicContact CD2-CB 3.69Å; Y3-L18 HydrophobicContact CD2-CD1 3.7Å; Y3-L18 HydrophobicContact CD2-CG 4.3Å; Y3-L18 HydrophobicContact CE2-CB 3.65Å; Y3-L18 HydrophobicContact CE2-CD1 4.12Å; M6-L18 HydrophobicContact CB-CD1 3.83Å; M6-L18 HydrophobicContact CE-CD1 4.47Å; M6-L18 HydrophobicContact CE-CD2 4.45Å; M6-L18 HydrophobicContact CG-CD1 4.44Å; M6-L18 HydrophobicContact SD-CD1 3.81Å; M6-L18 HydrophobicContact SD-CD2 3.94Å; C15-L18 HydrophobicContact CB-CD1 4.08Å; C15-L18 PolarHBondContact O-N 2.84Å; Y16-L18 VanDerWaalsContact C-N 3.34Å
19	K	60.8	Low	58.7	Low	111 Å²	111	100 Å²	100	48%	0.483	54%	0.535	S	S	.	.			trans	-100.1	64	167.6	-58.5	-175.3	-179.3	-177	0	110.5	L17 R142	L17-K19 PolarHBondContact O-N 3.3Å; K19-R142 PolarHBondContact O-NH1 2.88Å; K19-R142 VanDerWaalsContact O-NH1 3.08Å
20	I	62.7	Low	58.1	Low	69 Å²	69	100.2 Å²	100.2	35%	0.354	54%	0.543	S	S	.	.			trans	-119.5	150.1	169.1	-66.5	169.9	0	0	0	106	L17 L135 I143	L17-I20 VanDerWaalsContact O-CD1 3.31Å; L17-I20 WeakPolarHBondContact O-CD1 3.17Å; L17-I20 WeakPolarHBondContact O-CG1 3.31Å; I20-L135 HydrophobicContact CG2-CD2 3.64Å; I20-I143 HydrophobicContact CD1-CD1 4.38Å; I20-I143 HydrophobicContact CD1-CG1 3.98Å; I20-I143 HydrophobicContact CG1-CD1 4.4Å; I20-I143 HydrophobicContact CG1-CG1 4.19Å; I20-I143 HydrophobicContact CG2-CD1 4.2Å
21	N	63.5	Low	57.9	Low	97 Å²	97	97.6 Å²	97.6	52%	0.519	54%	0.536	S	S	.	.	S	Bend	trans	64.2	45.6	-170.5	-55.8	-35.9	0	0	0	112.4	R23 C134 L135	N21-R23 VanDerWaalsContact C-N 3.28Å; N21-R23 PolarHBondContact O-N 3.37Å; N21-C134 CarbonylContact C-O 3.58Å; N21-C134 WeakPolarHBondContact CA-O 3.3Å; N21-C134 HydrophobicContact CB-CB 3.7Å; N21-L135 WeakPolarHBondContact OD1-CD2 3.47Å
22	S	70.7	Confident	57.4	Low	60 Å²	60	104.4 Å²	104.4	42%	0.42	56%	0.561	S	S	.	*			trans	-77.8	-4.4	-173.7	-56.4	0	0	0	0	114.5	C134 D139 R142	S22-C134 PolarHBondContact N-O 3.09Å; S22-D139 WeakPolarHBondContact CB-OD1 3.34Å; S22-D139 VanDerWaalsContact CB-OD2 3.29Å; S22-D139 WeakPolarHBondContact CB-OD2 3.27Å; S22-D139 PolarHBondContact N-OD2 3.2Å; S22-D139 PolarHBondContact OG-OD1 2.89Å; S22-D139 PolarHBondContact OG-OD2 2.89Å; S22-R142 PolarHBondContact OG-NH1 3.16Å
23	R	68.3	Low	57.2	Low	98 Å²	98	101.7 Å²	101.7	37%	0.37	54%	0.541	S	S	.	.			trans	-77.1	125.9	-179.5	-164.8	-172.9	-166.3	152	11.1	110.8	N21 E31 T133 C134 T136	N21-R23 VanDerWaalsContact C-N 3.28Å; N21-R23 PolarHBondContact O-N 3.37Å; R23-E31 PolarHBondContact NH2-O 2.69Å; R23-T133 WeakPolarHBondContact CD-O 3.43Å; R23-T133 PolarHBondContact NH1-O 3.46Å; R23-C134 WeakPolarHBondContact CB-O 3.35Å; R23-C134 PolarHBondContact N-O 2.72Å; R23-T136 HydrophobicContact CB-CG2 3.91Å
24	A	61.2	Low	57.2	Low	73 Å²	73	98.4 Å²	98.4	60%	0.603	53%	0.534	S	S	*	.			trans	-74.2	150.3	173.5	0	0	0	0	0	111.7	S26	A24-S26 PolarHBondContact O-N 3.45Å
25	S	53.8	Low	57.5	Low	134 Å²	134	97.9 Å²	97.9	94%	0.937	52%	0.522	S	S	*	.	S	Bend	trans	-83.3	54	179.2	61.9	0	0	0	0	112.5
26	S	50.7	Low	57.6	Low	80 Å²	80	99.2 Å²	99.2	56%	0.559	53%	0.531	S	S	*	.			trans	-119.7	133.2	176.2	49.5	0	0	0	0	110.4	A24 E28	A24-S26 PolarHBondContact O-N 3.45Å; S26-E28 VanDerWaalsContact C-N 3.27Å; S26-E28 PolarHBondContact O-N 2.75Å; S26-E28 VanDerWaalsContact O-N 3.14Å
27	P	49.9	Very low	58	Low	136 Å²	136	101 Å²	101	88%	0.883	54%	0.537	S	S	*	.			trans	-89.5	38.5	-167.7	39.2	-39.3	0	0	0	113.6
28	E	47.1	Very low	58.4	Low	168 Å²	168	101.3 Å²	101.3	79%	0.785	54%	0.543	S	S	*	.			trans	-127.8	137.8	179.1	-67	-175.8	165.5	0	0	109.7	S26	S26-E28 VanDerWaalsContact C-N 3.27Å; S26-E28 PolarHBondContact O-N 2.75Å; S26-E28 VanDerWaalsContact O-N 3.14Å
29	E	50	Low	58.6	Low	186 Å²	186	104.2 Å²	104.2	87%	0.869	56%	0.555	S	S	*	*	S	Bend	trans	75.1	102.7	-171.8	-55.6	-169.7	168.2	0	0	116.6	E31	E29-E31 PolarHBondContact O-N 3.33Å
30	E	53.8	Low	58.4	Low	178 Å²	178	106.5 Å²	106.5	83%	0.832	56%	0.561	S	S	*	*			trans	-76.6	79.2	-179.6	-65.6	-177	120.5	0	0	113.2	Q32	E30-Q32 PolarHBondContact O-N 2.92Å
31	E	55.3	Low	58.3	Low	101 Å²	101	107 Å²	107	47%	0.472	56%	0.564	S	S	.	*			trans	-73	88.1	146.1	-81.8	-161.6	162.4	0	0	108.4	R23 E29 I33	R23-E31 PolarHBondContact NH2-O 2.69Å; E29-E31 PolarHBondContact O-N 3.33Å; E31-I33 HydrophobicContact CB-CD1 4.32Å; E31-I33 HydrophobicContact CB-CG1 4.21Å; E31-I33 PolarHBondContact O-N 3.38Å
32	Q	55.5	Low	57.5	Low	168 Å²	168	111 Å²	111	79%	0.785	58%	0.579	S	S	*	*			trans	-77.7	60.6	177.5	-158.2	177	53.2	0	0	111	E30 P34	E30-Q32 PolarHBondContact O-N 2.92Å; Q32-P34 WeakPolarHBondContact O-CD 3.32Å
33	I	56.4	Low	56.3	Low	41 Å²	41	115.3 Å²	115.3	21%	0.21	59%	0.591	C	S	.	*			trans	-71	120.8	175.1	-52.9	165.3	0	0	0	107.8	E31 L137	E31-I33 HydrophobicContact CB-CD1 4.32Å; E31-I33 HydrophobicContact CB-CG1 4.21Å; E31-I33 PolarHBondContact O-N 3.38Å; I33-L137 HydrophobicContact CD1-CD2 3.95Å; I33-L137 HydrophobicContact CD1-CG 3.74Å; I33-L137 HydrophobicContact CG1-CD2 4.1Å; I33-L137 HydrophobicContact CG1-CG 4.17Å; I33-L137 HydrophobicContact CG2-CD2 4.28Å
34	P	58.9	Low	55	Low	105 Å²	105	119 Å²	119	68%	0.682	61%	0.612	S	S	*	*			trans	-63.6	141.5	175.2	26.3	-33.5	0	0	0	110.3	Q32 P36	Q32-P34 WeakPolarHBondContact O-CD 3.32Å; P34-P36 WeakPolarHBondContact O-CD 3.32Å
35	D	63.3	Low	53.9	Low	30 Å²	30	122.7 Å²	122.7	16%	0.16	62%	0.622	C	S	.	*			trans	-51.5	114.6	179.3	172.9	-12.6	0	0	0	109.7	W37 S38 H131	D35-W37 PolarHBondContact O-N 3Å; D35-W37 VanDerWaalsContact O-N 3.16Å; D35-W37 WeakPolarHBondContact OD1-CA 3.44Å; D35-W37 VanDerWaalsContact OD1-CB 3.25Å; D35-W37 WeakPolarHBondContact OD1-CB 3.41Å; D35-W37 PolarHBondContact OD1-N 3.16Å; D35-S38 WeakPolarHBondContact O-CB 3.48Å; D35-S38 PolarHBondContact O-N 3.27Å; D35-S38 VanDerWaalsContact O-N 3.09Å; D35-S38 PolarHBondContact O-OG 3.33Å; D35-S38 PolarHBondContact OD1-N 3.01Å; D35-H131 VanDerWaalsContact OD1-O 3.05Å; D35-H131 PolarHBondContact OD2-N 3.09Å
36	P	60.2	Low	53	Low	34 Å²	34	121.1 Å²	121.1	22%	0.221	60%	0.602	C	S	.	*	T	Hydrogen-bonded Turn	trans	-67.1	-18.1	-174.3	28.2	-35.6	0	0	0	112.8	P34 Q39 L135	P34-P36 WeakPolarHBondContact O-CD 3.32Å; P36-Q39 PolarHBondContact O-NE2 2.97Å; P36-L135 HydrophobicContact CG-CD1 4.44Å
37	W	63.6	Low	52	Low	129 Å²	129	128.2 Å²	128.2	49%	0.489	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.6	-18.7	177	-53.6	98.2	0	0	0	113	D35 Q39 Y40 L41 H131	D35-W37 PolarHBondContact O-N 3Å; D35-W37 VanDerWaalsContact O-N 3.16Å; D35-W37 WeakPolarHBondContact OD1-CA 3.44Å; D35-W37 VanDerWaalsContact OD1-CB 3.25Å; D35-W37 WeakPolarHBondContact OD1-CB 3.41Å; D35-W37 PolarHBondContact OD1-N 3.16Å; W37-Q39 PolarHBondContact O-N 3.49Å; W37-Y40 PolarHBondContact O-N 3.27Å; W37-L41 HydrophobicContact CB-CD1 3.65Å; W37-L41 HydrophobicContact CB-CG 4.04Å; W37-L41 WeakPolarHBondContact O-CG 3.21Å; W37-L41 PolarHBondContact O-N 2.68Å; W37-H131 HydrophobicContact CB-CB 4.1Å; W37-H131 HydrophobicContact CG-CB 4.09Å
38	S	65.6	Low	51.2	Low	54 Å²	54	128.6 Å²	128.6	38%	0.378	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.8	-22.1	-178.6	67	0	0	0	0	115	D35	D35-S38 WeakPolarHBondContact O-CB 3.48Å; D35-S38 PolarHBondContact O-N 3.27Å; D35-S38 VanDerWaalsContact O-N 3.09Å; D35-S38 PolarHBondContact O-OG 3.33Å; D35-S38 PolarHBondContact OD1-N 3.01Å
39	Q	59.3	Low	50.5	Low	136 Å²	136	127.9 Å²	127.9	64%	0.636	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-17.7	174.8	71.8	-167	-50.5	0	0	114	P36 W37	P36-Q39 PolarHBondContact O-NE2 2.97Å; W37-Q39 PolarHBondContact O-N 3.49Å
40	Y	57.5	Low	49.5	Very low	159 Å²	159	127.6 Å²	127.6	62%	0.624	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-29.2	-176.9	-57.5	-62.9	0	0	0	112.8	W37 H42	W37-Y40 PolarHBondContact O-N 3.27Å; Y40-H42 PolarHBondContact O-N 3.22Å
41	L	59	Low	48.6	Very low	80 Å²	80	125.6 Å²	125.6	42%	0.419	61%	0.607	S	S	.	*	S	Bend	trans	-74.5	111.5	172.1	-64.2	170.9	0	0	0	108.7	W37 K43 H131	W37-L41 HydrophobicContact CB-CD1 3.65Å; W37-L41 HydrophobicContact CB-CG 4.04Å; W37-L41 WeakPolarHBondContact O-CG 3.21Å; W37-L41 PolarHBondContact O-N 2.68Å; L41-K43 PolarHBondContact O-N 2.85Å; L41-H131 HydrophobicContact CD1-CB 4.21Å; L41-H131 WeakPolarHBondContact CD1-CD2 3.37Å
42	H	47.3	Very low	47.5	Very low	180 Å²	180	128 Å²	128	83%	0.833	62%	0.622	S	S	*	*			trans	-60.3	111.1	-178.6	-77.7	-42.7	0	0	0	111.5	Y40 Q44	Y40-H42 PolarHBondContact O-N 3.22Å; H42-Q44 VanDerWaalsContact C-N 3.27Å; H42-Q44 PolarHBondContact O-N 2.89Å
43	K	45.4	Very low	46.3	Very low	151 Å²	151	128.9 Å²	128.9	66%	0.657	63%	0.626	S	S	*	*			trans	-60	85.7	163.1	-72.8	176.5	167.3	-173	0	109.9	L41 N45 L46	L41-K43 PolarHBondContact O-N 2.85Å; K43-N45 PolarHBondContact O-N 3.12Å; K43-L46 HydrophobicContact CD-CD1 3.84Å
44	Q	41.3	Very low	45	Very low	176 Å²	176	135.8 Å²	135.8	82%	0.822	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-13.1	-176	-97.9	-175.8	-23.5	0	0	114.6	H42	H42-Q44 VanDerWaalsContact C-N 3.27Å; H42-Q44 PolarHBondContact O-N 2.89Å
45	N	38.1	Very low	43.5	Very low	151 Å²	151	135.2 Å²	135.2	81%	0.807	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	1.7	-171.1	-73.7	-34.5	0	0	0	117.1	K43	K43-N45 PolarHBondContact O-N 3.12Å
46	L	34.4	Very low	41.8	Very low	101 Å²	101	140.2 Å²	140.2	53%	0.529	70%	0.7	S	S	.	*	S	Bend	trans	-103.6	-9.1	-175.8	-89.5	153.8	0	0	0	115.7	K43 N48	K43-L46 HydrophobicContact CD-CD1 3.84Å; L46-N48 VanDerWaalsContact C-N 3.29Å; L46-N48 PolarHBondContact O-N 3.4Å
47	R	29.2	Very low	40.1	Very low	229 Å²	229	143.5 Å²	143.5	86%	0.864	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	1.8	-178.1	-134.9	177.3	-169.6	176.5	3.4	115.2
48	N	34.8	Very low	38.3	Very low	143 Å²	143	142.2 Å²	142.2	77%	0.765	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-0.9	-178	-76.9	-22.8	0	0	0	114.4	L46	L46-N48 VanDerWaalsContact C-N 3.29Å; L46-N48 PolarHBondContact O-N 3.4Å
49	Q	31.8	Very low	36.4	Very low	154 Å²	154	147.1 Å²	147.1	72%	0.72	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	-28.2	-175.2	-120.7	172.9	2.2	0	0	115.3	V51	Q49-V51 VanDerWaalsContact C-N 3.27Å; Q49-V51 PolarHBondContact O-N 3.18Å
50	E	29	Very low	34.7	Very low	180 Å²	180	147 Å²	147	84%	0.841	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	6.5	-173.7	-67.5	-174	146	0	0	115.7
51	V	33.9	Very low	33.1	Very low	136 Å²	136	143.4 Å²	143.4	82%	0.824	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-0.7	177.2	-174.9	0	0	0	0	112.3	Q49	Q49-V51 VanDerWaalsContact C-N 3.27Å; Q49-V51 PolarHBondContact O-N 3.18Å
52	L	32.4	Very low	31.4	Very low	152 Å²	152	145.2 Å²	145.2	80%	0.796	80%	0.8	S	S	*	*	S	Bend	trans	-102.6	6.7	-174	-84.4	167.4	0	0	0	116.3
53	Q	30.5	Very low	30.4	Very low	186 Å²	186	141.7 Å²	141.7	87%	0.869	80%	0.802	S	S	*	*			trans	-126.2	79.1	177.1	-76.8	-172.5	-17.9	0	0	113.8
54	L	28.6	Very low	29.3	Very low	186 Å²	186	143 Å²	143	97%	0.974	81%	0.81	S	S	*	*			trans	-138.8	79.4	155.7	-82.4	177.4	0	0	0	110.1
55	A	27.6	Very low	28.5	Very low	93 Å²	93	142.5 Å²	142.5	77%	0.769	81%	0.813	S	S	*	*	S	Bend	trans	-139.4	146.8	164	0	0	0	0	0	108.5
56	P	28.6	Very low	27.8	Very low	134 Å²	134	139 Å²	139	87%	0.87	81%	0.813	S	S	*	*			trans	-76.5	149.4	-166.2	30.4	-35.4	0	0	0	113.4
57	A	25.1	Very low	27.3	Very low	104 Å²	104	140.9 Å²	140.9	86%	0.86	83%	0.828	S	S	*	*			trans	-73.7	142.6	-174	0	0	0	0	0	114.2
58	A	25.6	Very low	27	Very low	101 Å²	101	136.1 Å²	136.1	84%	0.835	82%	0.824	S	S	*	*			trans	-133.5	140.3	158.4	0	0	0	0	0	108.7
59	N	24.6	Very low	26.6	Very low	157 Å²	157	133.7 Å²	133.7	84%	0.84	82%	0.824	S	S	*	*			trans	-77.7	151.1	-174.2	-63	-42.5	0	0	0	112.4
60	V	24.8	Very low	26.5	Very low	135 Å²	135	131 Å²	131	82%	0.818	82%	0.82	S	S	*	*				166.6	131.1	112.9	158.2	0	0	0	0	112.4
61	A	23.8	Very low	26.1	Very low	83 Å²	83	131.3 Å²	131.3	69%	0.686	82%	0.821	S	S	*	*			trans	33.3	114.9	152.3	0	0	0	0	0	123.5
62	S	23.8	Very low	25.7	Very low	118 Å²	118	129 Å²	129	83%	0.825	82%	0.817	S	S	*	*				12.9	128.9	129.2	59.7	0	0	0	0	122.1
63	A	24.2	Very low	25.2	Very low	105 Å²	105	129.5 Å²	129.5	87%	0.868	82%	0.82	S	S	*	*				-160.7	156.4	121.3	0	0	0	0	0	110.5
64	Q	23.3	Very low	24.9	Very low	179 Å²	179	126 Å²	126	84%	0.836	82%	0.816	S	S	*	*			trans	-105.8	170.9	-179.7	-70.8	173	-49	0	0	112.3
65	D	24.5	Very low	24.7	Very low	165 Å²	165	120.5 Å²	120.5	88%	0.882	81%	0.805	S	S	*	*			trans	95.8	145.8	155	-63	-23.3	0	0	0	120.1
66	G	23.8	Very low	24.5	Very low	77 Å²	77	123.7 Å²	123.7	79%	0.794	81%	0.809	S	S	*	*			trans	134.3	66.1	165	0	0	0	0	0	116.1
67	V	23.7	Very low	24.3	Very low	142 Å²	142	121 Å²	121	86%	0.861	79%	0.793	S	S	*	*			trans	-67.4	145.2	165.7	172.3	0	0	0	0	110.3
68	V	23.7	Very low	24.4	Very low	129 Å²	129	121.8 Å²	121.8	78%	0.782	79%	0.788	S	S	*	*				172.3	123.2	129	154.1	0	0	0	0	110.3
69	A	24.7	Very low	24.3	Very low	91 Å²	91	124 Å²	124	75%	0.752	78%	0.781	S	S	*	*			trans	-109	156.1	147.9	0	0	0	0	0	107.1
70	P	29.5	Very low	24.4	Very low	97 Å²	97	125 Å²	125	63%	0.63	78%	0.777	S	S	*	*				-145	153.9	110.6	36	-20.8	0	0	0	114.6
71	E	22.2	Very low	24.3	Very low	188 Å²	188	122.3 Å²	122.3	88%	0.879	78%	0.777	S	S	*	*			trans	52.2	152.5	131.7	-63.4	171.9	-174	0	0	119.9
72	A	24	Very low	24.3	Very low	88 Å²	88	123.8 Å²	123.8	73%	0.727	79%	0.789	S	S	*	*			cis	174.5	146.1	-16.1	0	0	0	0	0	103.1
73	D	23.2	Very low	24.3	Very low	161 Å²	161	122 Å²	122	86%	0.861	79%	0.789	S	S	*	*				-170.7	169	124.5	-139.5	-21.5	0	0	0	111.8
74	S	23.2	Very low	24.3	Very low	112 Å²	112	121 Å²	121	78%	0.783	79%	0.789	S	S	*	*			trans	-146.1	155.9	-169	57.8	0	0	0	0	113.2
75	G	24.5	Very low	24.3	Very low	72 Å²	72	118.5 Å²	118.5	74%	0.742	79%	0.792	S	S	*	*			trans	146.3	105.4	176.6	0	0	0	0	0	111
76	D	23.4	Very low	24.3	Very low	159 Å²	159	113.8 Å²	113.8	85%	0.85	78%	0.782	S	S	*	*				73	133.6	57	-156.4	70	0	0	0	112
77	S	25.3	Very low	24.4	Very low	78 Å²	78	115.8 Å²	115.8	55%	0.545	78%	0.783	S	S	.	*			cis	-157.1	165	-2.8	31.9	0	0	0	0	108.9
78	T	25.6	Very low	24.6	Very low	121 Å²	121	116.7 Å²	116.7	74%	0.742	78%	0.782	S	S	*	*				177.8	138	78.4	28.4	0	0	0	0	113.4
79	E	25	Very low	24.9	Very low	148 Å²	148	118.1 Å²	118.1	69%	0.692	79%	0.785	S	S	*	*			trans	21.5	152.3	142.2	-59.1	-162.9	125.1	0	0	123.1
80	K	25.8	Very low	25.1	Very low	177 Å²	177	118.3 Å²	118.3	77%	0.77	78%	0.777	S	S	*	*			cis	-166.5	150.6	24.6	-138.4	155.7	-170.5	138.6	0	113
81	G	23.5	Very low	25.2	Very low	79 Å²	79	119.5 Å²	119.5	81%	0.814	77%	0.774	S	S	*	*			trans	164.6	114.4	164.8	0	0	0	0	0	115.6
82	A	23.7	Very low	25.7	Very low	114 Å²	114	114.5 Å²	114.5	94%	0.942	76%	0.758	S	S	*	*			trans	-85.8	163.4	-173.3	0	0	0	0	0	114.2
83	G	23.2	Very low	26.1	Very low	80 Å²	80	116.3 Å²	116.3	83%	0.825	75%	0.754	S	S	*	*			cis	171.3	167.2	-3.3	0	0	0	0	0	111.8
84	G	23.8	Very low	26.5	Very low	84 Å²	84	114.7 Å²	114.7	87%	0.866	74%	0.742	S	S	*	*			trans	141.7	67.1	176.9	0	0	0	0	0	114.9
85	S	24	Very low	26.8	Very low	127 Å²	127	115.8 Å²	115.8	89%	0.888	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-86.2	117.4	175.6	-173.9	0	0	0	0	111.2
86	G	25.1	Very low	26.8	Very low	66 Å²	66	119.1 Å²	119.1	68%	0.68	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-99.4	117.8	170.8	0	0	0	0	0	110.7	L88	G86-L88 PolarHBondContact O-N 3.42Å
87	C	24.9	Very low	27.2	Very low	119 Å²	119	117.2 Å²	117.2	80%	0.804	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-63.6	127.9	175	-176	0	0	0	0	110.8
88	L	28.1	Very low	27.3	Very low	161 Å²	161	120.8 Å²	120.8	84%	0.843	75%	0.746	S	S	*	*			trans	-139.6	63.2	175.4	-79.2	178.6	0	0	0	111.3	G86	G86-L88 PolarHBondContact O-N 3.42Å
89	D	30.9	Very low	27.6	Very low	158 Å²	158	120.3 Å²	120.3	85%	0.845	75%	0.748	S	S	*	*			trans	-121.6	84.2	158.4	-90.3	-48	0	0	0	109
90	T	27.7	Very low	27.7	Very low	96 Å²	96	119.2 Å²	119.2	59%	0.589	76%	0.755	S	S	*	*			trans	-143.8	122.9	170.2	-35.2	0	0	0	0	108
91	H	32.7	Very low	27.8	Very low	121 Å²	121	116.7 Å²	116.7	56%	0.56	76%	0.755	S	S	*	*			trans	-72.7	133.5	-170.5	-175.4	-82.3	0	0	0	110.2	L93 Q94	H91-L93 PolarHBondContact ND1-N 2.66Å; H91-L93 PolarHBondContact O-N 2.9Å; H91-Q94 VanDerWaalsContact O-CB 3.25Å; H91-Q94 WeakPolarHBondContact O-CB 3.38Å; H91-Q94 PolarHBondContact O-N 3.44Å
92	P	32.3	Very low	28	Very low	84 Å²	84	117.4 Å²	117.4	55%	0.545	75%	0.753	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.1	22.7	-172.8	30	-37.1	0	0	0	115.5
93	L	31.8	Very low	28.4	Very low	125 Å²	125	117.3 Å²	117.3	65%	0.654	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	6.1	167.8	-65.8	178.4	0	0	0	112.1	H91 L95 L331	H91-L93 PolarHBondContact ND1-N 2.66Å; H91-L93 PolarHBondContact O-N 2.9Å; L93-L95 PolarHBondContact O-N 3.3Å; L93-L331 HydrophobicContact CD2-CD2 4.13Å
94	Q	31.2	Very low	28.8	Very low	128 Å²	128	121.3 Å²	121.3	60%	0.598	75%	0.747	S	S	*	*			trans	-79.5	100.2	173.7	-163.1	162.8	-0.6	0	0	106.9	H91 D96	H91-Q94 VanDerWaalsContact O-CB 3.25Å; H91-Q94 WeakPolarHBondContact O-CB 3.38Å; H91-Q94 PolarHBondContact O-N 3.44Å; Q94-D96 PolarHBondContact O-N 3.49Å
95	L	29.3	Very low	29	Very low	135 Å²	135	125.2 Å²	125.2	71%	0.707	75%	0.747	S	S	*	*			trans	-68.2	113.3	174.6	-78.5	161.1	0	0	0	108.5	L93 T97	L93-L95 PolarHBondContact O-N 3.3Å; L95-T97 PolarHBondContact O-N 3.04Å; L95-T97 PolarHBondContact O-OG1 3.19Å; L95-T97 VanDerWaalsContact O-OG1 3.11Å
96	D	26.3	Very low	29.1	Very low	141 Å²	141	125.2 Å²	125.2	75%	0.754	74%	0.742	S	S	*	*			trans	-52.9	112.6	164.1	-68.9	-41.5	0	0	0	108	Q94 D98	Q94-D96 PolarHBondContact O-N 3.49Å; D96-D98 PolarHBondContact O-N 3.3Å
97	T	30.8	Very low	29.1	Very low	120 Å²	120	130.3 Å²	130.3	74%	0.736	75%	0.752	S	S	*	*			trans	-86.6	57.7	-173.1	-52.8	0	0	0	0	109.7	L95	L95-T97 PolarHBondContact O-N 3.04Å; L95-T97 PolarHBondContact O-OG1 3.19Å; L95-T97 VanDerWaalsContact O-OG1 3.11Å
98	D	27.2	Very low	29.3	Very low	152 Å²	152	129.4 Å²	129.4	81%	0.813	75%	0.748	S	S	*	*			trans	-100.6	118.5	175.9	-95.4	-25.6	0	0	0	111.9	D96	D96-D98 PolarHBondContact O-N 3.3Å
99	S	32.1	Very low	29.4	Very low	112 Å²	112	127.8 Å²	127.8	78%	0.783	75%	0.747	S	S	*	*	S	Bend	trans	62.8	73.7	162.5	-152.9	0	0	0	0	118
100	C	28	Very low	29.3	Very low	125 Å²	125	126.7 Å²	126.7	85%	0.845	75%	0.746	S	S	*	*				-177.8	54.3	125.2	-93.9	0	0	0	0	114.1
101	T	26.8	Very low	29.4	Very low	124 Å²	124	129.7 Å²	129.7	76%	0.761	76%	0.758	S	S	*	*			trans	-124.7	56.2	165.5	41.7	0	0	0	0	110.7	S103	T101-S103 PolarHBondContact O-N 3.11Å
102	A	27	Very low	29.3	Very low	94 Å²	94	128.9 Å²	128.9	78%	0.777	77%	0.772	S	S	*	*			trans	-62.1	130.8	168.3	0	0	0	0	0	110.1
103	S	33.9	Very low	29.2	Very low	111 Å²	111	133.3 Å²	133.3	78%	0.776	79%	0.791	S	S	*	*	S	Bend	trans	69.1	87.1	167.8	-52.1	0	0	0	0	117	T101	T101-S103 PolarHBondContact O-N 3.11Å
104	L	30.6	Very low	29.2	Very low	164 Å²	164	130.3 Å²	130.3	86%	0.859	79%	0.79	S	S	*	*	S	Bend		-174	158.5	99.9	-92.7	162.1	0	0	0	110.7
105	L	28	Very low	29.2	Very low	167 Å²	167	134.3 Å²	134.3	87%	0.874	81%	0.806	S	S	*	*			trans	78	67.5	-178.1	-49.6	-178.5	0	0	0	116.4
106	T	25.4	Very low	29.5	Very low	126 Å²	126	138 Å²	138	77%	0.773	82%	0.816	S	S	*	*			trans	-115.7	109	152.9	-15.3	0	0	0	0	108.3
107	L	27	Very low	29.6	Very low	173 Å²	173	137 Å²	137	91%	0.906	82%	0.82	S	S	*	*			trans	-130.3	88.6	166.3	-83.4	174.5	0	0	0	107.7
108	S	27.3	Very low	29.8	Very low	100 Å²	100	138.4 Å²	138.4	70%	0.699	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-77	134	174.8	-45.1	0	0	0	0	110.4
109	P	30.1	Very low	29.9	Very low	127 Å²	127	134.3 Å²	134.3	83%	0.825	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-80.1	156.3	157.8	-0.1	18.7	0	0	0	110.8
110	V	29.2	Very low	30	Very low	136 Å²	136	137 Å²	137	82%	0.824	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-89.3	157.6	-169.1	174.5	0	0	0	0	112.4
111	D	31.1	Very low	30.1	Very low	159 Å²	159	137.5 Å²	137.5	85%	0.85	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-50.3	151.6	179.8	-55.5	-76.4	0	0	0	116.3
112	A	28.9	Very low	30.3	Very low	104 Å²	104	138.3 Å²	138.3	86%	0.86	83%	0.827	S	S	*	*			trans	-143.5	146.9	153.4	0	0	0	0	0	110.2
113	D	30.7	Very low	30.6	Very low	177 Å²	177	139.7 Å²	139.7	95%	0.947	83%	0.831	S	S	*	*			trans	-76.8	162.5	-157.1	-143.2	-24.5	0	0	0	115.6
114	G	32.5	Very low	30.5	Very low	61 Å²	61	142.1 Å²	142.1	63%	0.629	83%	0.834	S	S	*	*			trans	-88.5	168.8	-161	0	0	0	0	0	117.8
115	K	30	Very low	30.4	Very low	213 Å²	213	138.4 Å²	138.4	93%	0.926	83%	0.828	S	S	*	*			trans	-162.3	150.9	142.2	-116.7	169.9	-174.6	173.4	0	113.1
116	K	36.6	Very low	30.6	Very low	212 Å²	212	135.3 Å²	135.3	92%	0.922	83%	0.826	S	S	*	*			trans	-72.4	140.2	174.1	-66.4	176.2	174	-179.5	0	111.5
117	S	29.2	Very low	31	Very low	119 Å²	119	133.6 Å²	133.6	83%	0.832	83%	0.825	S	S	*	*			trans	-152.8	123.2	145.6	53.8	0	0	0	0	110.7
118	T	34.8	Very low	31.9	Very low	150 Å²	150	131.6 Å²	131.6	92%	0.92	82%	0.82	S	S	*	*			trans	-74.7	139.6	163.7	43.8	0	0	0	0	110
119	G	29.4	Very low	32.9	Very low	67 Å²	67	129 Å²	129	69%	0.691	81%	0.809	S	S	*	*			trans	170.4	138.9	172.3	0	0	0	0	0	111
120	D	33.6	Very low	34.3	Very low	167 Å²	167	128.3 Å²	128.3	89%	0.893	80%	0.798	S	S	*	*			trans	-61.8	151.7	-175.1	-53.2	-76.4	0	0	0	113.2
121	T	30.4	Very low	35.9	Very low	136 Å²	136	126.6 Å²	126.6	83%	0.834	78%	0.781	S	S	*	*			trans	-152.7	141.1	156	-32	0	0	0	0	110.4
122	D	30.8	Very low	37.6	Very low	142 Å²	142	120.1 Å²	120.1	76%	0.759	75%	0.752	S	S	*	*			trans	-51.4	158.3	-177.8	-66.8	-70.4	0	0	0	115	L124	D122-L124 PolarHBondContact O-N 2.73Å
123	S	33.8	Very low	39.4	Very low	122 Å²	122	118.5 Å²	118.5	85%	0.853	73%	0.732	S	S	*	*			trans	-63.2	78.5	161.8	57.9	0	0	0	0	110.9	A125	S123-A125 PolarHBondContact O-N 3.13Å
124	L	30.4	Very low	41.3	Very low	162 Å²	162	112.9 Å²	112.9	85%	0.848	71%	0.705	S	S	*	*			trans	-65.5	108.7	164.7	-140.5	81.2	0	0	0	107.1	D122 A126	D122-L124 PolarHBondContact O-N 2.73Å; L124-A126 PolarHBondContact O-N 2.63Å
125	A	29.4	Very low	43.1	Very low	87 Å²	87	110.5 Å²	110.5	72%	0.719	68%	0.678	S	S	*	*			trans	-49.9	129.4	170.5	0	0	0	0	0	108.4	S123 A127	S123-A125 PolarHBondContact O-N 3.13Å; A125-A127 PolarHBondContact O-N 3.31Å
126	A	32.4	Very low	45.4	Very low	102 Å²	102	101.5 Å²	101.5	84%	0.843	64%	0.641	S	S	*	*			trans	-58.7	100	-179	0	0	0	0	0	109	L124 T128	L124-A126 PolarHBondContact O-N 2.63Å; A126-T128 PolarHBondContact O-N 3.21Å
127	A	34.1	Very low	47.2	Very low	90 Å²	90	95.4 Å²	95.4	74%	0.744	62%	0.618	S	S	*	*			trans	-56.6	127.7	179.6	0	0	0	0	0	107.7	A125 G129	A125-A127 PolarHBondContact O-N 3.31Å; A127-G129 VanDerWaalsContact C-N 3.34Å; A127-G129 PolarHBondContact O-N 2.91Å
128	T	46.4	Very low	49.5	Very low	130 Å²	130	94.7 Å²	94.7	80%	0.798	61%	0.605	S	S	*	*			trans	-56.3	102.8	167.2	42.6	0	0	0	0	107.2	A126 N130	A126-T128 PolarHBondContact O-N 3.21Å; T128-N130 PolarHBondContact O-N 3.04Å; T128-N130 VanDerWaalsContact O-N 3.08Å
129	G	48	Very low	51.6	Low	46 Å²	46	87.5 Å²	87.5	47%	0.474	56%	0.561	S	S	.	*			trans	-60.8	115.6	-177.3	0	0	0	0	0	109.1	A127 H131	A127-G129 VanDerWaalsContact C-N 3.34Å; A127-G129 PolarHBondContact O-N 2.91Å; G129-H131 PolarHBondContact O-CD2 2.7Å; G129-H131 PolarHBondContact O-N 3.23Å; G129-H131 PolarHBondContact O-NE2 3.44Å
130	N	59.2	Low	53.8	Low	112 Å²	112	86.2 Å²	86.2	60%	0.599	54%	0.537	S	S	*	.			trans	-68	114.5	170.7	-70.2	-20.3	0	0	0	107.2	T128 T133	T128-N130 PolarHBondContact O-N 3.04Å; T128-N130 VanDerWaalsContact O-N 3.08Å; N130-T133 HydrophobicContact CB-CG2 3.4Å; N130-T133 WeakPolarHBondContact O-CG2 3.42Å
131	H	63.3	Low	56	Low	100 Å²	100	82.1 Å²	82.1	46%	0.463	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	150.9	-177.6	-68.9	-86.4	0	0	0	110.1	D35 W37 L41 G129 T133	D35-H131 VanDerWaalsContact OD1-O 3.05Å; D35-H131 PolarHBondContact OD2-N 3.09Å; W37-H131 HydrophobicContact CB-CB 4.1Å; W37-H131 HydrophobicContact CG-CB 4.09Å; L41-H131 HydrophobicContact CD1-CB 4.21Å; L41-H131 WeakPolarHBondContact CD1-CD2 3.37Å; G129-H131 PolarHBondContact O-CD2 2.7Å; G129-H131 PolarHBondContact O-N 3.23Å; G129-H131 PolarHBondContact O-NE2 3.44Å; H131-T133 PolarHBondContact O-N 3.01Å; H131-T133 VanDerWaalsContact O-N 3.13Å
132	G	65.4	Low	58.2	Low	23 Å²	23	79.3 Å²	79.3	24%	0.237	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	14.2	178.9	0	0	0	0	0	115.6	C134 L135	G132-C134 PolarHBondContact O-N 3.04Å; G132-C134 VanDerWaalsContact O-N 3.09Å; G132-L135 VanDerWaalsContact O-CB 3.27Å; G132-L135 WeakPolarHBondContact O-CB 3.26Å; G132-L135 WeakPolarHBondContact O-CG 3.45Å; G132-L135 PolarHBondContact O-N 3.44Å
133	T	68	Low	60.5	Low	71 Å²	71	74.9 Å²	74.9	44%	0.436	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-27.5	178.6	44.1	0	0	0	0	114.3	R23 N130 H131 L135	R23-T133 WeakPolarHBondContact CD-O 3.43Å; R23-T133 PolarHBondContact NH1-O 3.46Å; N130-T133 HydrophobicContact CB-CG2 3.4Å; N130-T133 WeakPolarHBondContact O-CG2 3.42Å; H131-T133 PolarHBondContact O-N 3.01Å; H131-T133 VanDerWaalsContact O-N 3.13Å; T133-L135 VanDerWaalsContact C-N 3.33Å
134	C	69.1	Low	62.7	Low	58 Å²	58	76.3 Å²	76.3	39%	0.392	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-8.3	176.6	-54.7	0	0	0	0	114.3	N21 S22 R23 G132	N21-C134 CarbonylContact C-O 3.58Å; N21-C134 WeakPolarHBondContact CA-O 3.3Å; N21-C134 HydrophobicContact CB-CB 3.7Å; S22-C134 PolarHBondContact N-O 3.09Å; R23-C134 WeakPolarHBondContact CB-O 3.35Å; R23-C134 PolarHBondContact N-O 2.72Å; G132-C134 PolarHBondContact O-N 3.04Å; G132-C134 VanDerWaalsContact O-N 3.09Å
135	L	71.9	Confident	65.2	Low	12 Å²	12	73.2 Å²	73.2	6%	0.063	43%	0.433	C	S	.	.			trans	-79.5	132.9	178.9	-61.4	171.5	0	0	0	110.8	I20 N21 P36 G132 T133 D139 I143	I20-L135 HydrophobicContact CG2-CD2 3.64Å; N21-L135 WeakPolarHBondContact OD1-CD2 3.47Å; P36-L135 HydrophobicContact CG-CD1 4.44Å; G132-L135 VanDerWaalsContact O-CB 3.27Å; G132-L135 WeakPolarHBondContact O-CB 3.26Å; G132-L135 WeakPolarHBondContact O-CG 3.45Å; G132-L135 PolarHBondContact O-N 3.44Å; T133-L135 VanDerWaalsContact C-N 3.33Å; L135-D139 HydrophobicContact CD2-CB 4.06Å; L135-I143 HydrophobicContact CD2-CD1 4.15Å
136	T	77.6	Confident	67.6	Low	24 Å²	24	72.3 Å²	72.3	15%	0.147	41%	0.413	C	S	.	.			trans	-93.9	164.2	168	62.5	0	0	0	0	110.7	R23 N138 D139 H140	R23-T136 HydrophobicContact CB-CG2 3.91Å; T136-N138 PolarHBondContact O-N 2.89Å; T136-D139 PolarHBondContact N-OD2 3.32Å; T136-D139 WeakPolarHBondContact O-CA 3.31Å; T136-D139 WeakPolarHBondContact O-CB 3.32Å; T136-D139 PolarHBondContact O-N 2.92Å; T136-D139 PolarHBondContact OG1-N 2.92Å; T136-D139 PolarHBondContact OG1-OD2 2.78Å; T136-H140 PolarHBondContact O-N 2.81Å; T136-H140 VanDerWaalsContact O-N 3.09Å
137	L	74.9	Confident	70	Confident	83 Å²	83	72 Å²	72	44%	0.435	40%	0.396	S	S	.	.	H	α-helix	trans	-55.4	-37.4	172	-67.7	177.5	0	0	0	112.1	I33 D139 H140 D141	I33-L137 HydrophobicContact CD1-CD2 3.95Å; I33-L137 HydrophobicContact CD1-CG 3.74Å; I33-L137 HydrophobicContact CG1-CD2 4.1Å; I33-L137 HydrophobicContact CG1-CG 4.17Å; I33-L137 HydrophobicContact CG2-CD2 4.28Å; L137-D139 VanDerWaalsContact C-N 3.29Å; L137-D139 PolarHBondContact O-N 2.96Å; L137-H140 WeakPolarHBondContact O-CB 3.44Å; L137-H140 PolarHBondContact O-N 3.33Å; L137-D141 PolarHBondContact O-N 2.9Å
138	N	77.9	Confident	72.3	Confident	104 Å²	104	73.2 Å²	73.2	56%	0.556	39%	0.386	S	S	*	.	H	α-helix	trans	-63.1	-32.2	173.9	-78.3	-61.1	0	0	0	113.2	T136 R142	T136-N138 PolarHBondContact O-N 2.89Å; N138-R142 VanDerWaalsContact O-CG 3.22Å; N138-R142 WeakPolarHBondContact O-CG 3.43Å; N138-R142 PolarHBondContact O-N 3.25Å; N138-R142 VanDerWaalsContact O-N 3.11Å
139	D	76.8	Confident	74	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-73.3	-37.3	174.7	-56.9	-42.2	0	0	0	110.9	S22 L135 T136 L137 R142 I143	S22-D139 WeakPolarHBondContact CB-OD1 3.34Å; S22-D139 VanDerWaalsContact CB-OD2 3.29Å; S22-D139 WeakPolarHBondContact CB-OD2 3.27Å; S22-D139 PolarHBondContact N-OD2 3.2Å; S22-D139 PolarHBondContact OG-OD1 2.89Å; S22-D139 PolarHBondContact OG-OD2 2.89Å; L135-D139 HydrophobicContact CD2-CB 4.06Å; T136-D139 PolarHBondContact N-OD2 3.32Å; T136-D139 WeakPolarHBondContact O-CA 3.31Å; T136-D139 WeakPolarHBondContact O-CB 3.32Å; T136-D139 PolarHBondContact O-N 2.92Å; T136-D139 PolarHBondContact OG1-N 2.92Å; T136-D139 PolarHBondContact OG1-OD2 2.78Å; L137-D139 VanDerWaalsContact C-N 3.29Å; L137-D139 PolarHBondContact O-N 2.96Å; D139-R142 PolarHBondContact O-N 2.85Å; D139-R142 IonicContact OD1-NH1 2.82Å; D139-R142 PolarHBondContact OD1-NH1 3.37Å; D139-R142 VanDerWaalsContact OD1-NH1 3.11Å; D139-I143 WeakPolarHBondContact O-CB 3.31Å; D139-I143 WeakPolarHBondContact O-CD1 3.32Å; D139-I143 VanDerWaalsContact O-CG1 3.22Å; D139-I143 WeakPolarHBondContact O-CG1 3.43Å; D139-I143 PolarHBondContact O-N 2.98Å
140	H	76	Confident	75.6	Confident	39 Å²	39	72 Å²	72	18%	0.181	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-44.6	173	-68.6	176.1	0	0	0	112	T136 L137 I143 R144	T136-H140 PolarHBondContact O-N 2.81Å; T136-H140 VanDerWaalsContact O-N 3.09Å; L137-H140 WeakPolarHBondContact O-CB 3.44Å; L137-H140 PolarHBondContact O-N 3.33Å; H140-I143 PolarHBondContact O-N 3.27Å; H140-R144 WeakPolarHBondContact O-CB 3.18Å; H140-R144 PolarHBondContact O-N 3.43Å
141	D	79.4	Confident	76.8	Confident	82 Å²	82	68.9 Å²	68.9	44%	0.439	34%	0.343	S	S	.	.	H	α-helix	trans	-67.6	-39.1	179	-72.4	-11.8	0	0	0	112	L137 R144 Q145	L137-D141 PolarHBondContact O-N 2.9Å; D141-R144 PolarHBondContact O-N 2.73Å; D141-R144 IonicContact OD1-CZ 3.63Å; D141-R144 IonicContact OD1-NH1 3.08Å; D141-R144 PolarHBondContact OD1-NH1 3.19Å; D141-R144 IonicContact OD1-NH2 3.66Å; D141-Q145 WeakPolarHBondContact O-CB 3.48Å; D141-Q145 PolarHBondContact O-N 2.62Å
142	R	77.1	Confident	77.7	Confident	77 Å²	77	70.5 Å²	70.5	29%	0.291	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-42.4	171.8	-73	170.9	-164.4	150.4	9.4	112.6	K19 S22 N138 D139 R144 Q145 F146	K19-R142 PolarHBondContact O-NH1 2.88Å; K19-R142 VanDerWaalsContact O-NH1 3.08Å; S22-R142 PolarHBondContact OG-NH1 3.16Å; N138-R142 VanDerWaalsContact O-CG 3.22Å; N138-R142 WeakPolarHBondContact O-CG 3.43Å; N138-R142 PolarHBondContact O-N 3.25Å; N138-R142 VanDerWaalsContact O-N 3.11Å; D139-R142 PolarHBondContact O-N 2.85Å; D139-R142 IonicContact OD1-NH1 2.82Å; D139-R142 PolarHBondContact OD1-NH1 3.37Å; D139-R142 VanDerWaalsContact OD1-NH1 3.11Å; R142-R144 VanDerWaalsContact C-N 3.34Å; R142-Q145 PolarHBondContact O-N 2.84Å; R142-F146 VanDerWaalsContact O-CB 3.28Å; R142-F146 WeakPolarHBondContact O-CB 3.39Å; R142-F146 PolarHBondContact O-N 3.39Å
143	I	79.5	Confident	78.4	Confident	49 Å²	49	79 Å²	79	25%	0.251	37%	0.374	S	S	.	.	H	α-helix	trans	-63.8	-41.7	176	-70.9	163.5	0	0	0	110.1	I20 L135 D139 H140 F146 I147	I20-I143 HydrophobicContact CD1-CD1 4.38Å; I20-I143 HydrophobicContact CD1-CG1 3.98Å; I20-I143 HydrophobicContact CG1-CD1 4.4Å; I20-I143 HydrophobicContact CG1-CG1 4.19Å; I20-I143 HydrophobicContact CG2-CD1 4.2Å; L135-I143 HydrophobicContact CD2-CD1 4.15Å; D139-I143 WeakPolarHBondContact O-CB 3.31Å; D139-I143 WeakPolarHBondContact O-CD1 3.32Å; D139-I143 VanDerWaalsContact O-CG1 3.22Å; D139-I143 WeakPolarHBondContact O-CG1 3.43Å; D139-I143 PolarHBondContact O-N 2.98Å; H140-I143 PolarHBondContact O-N 3.27Å; I143-F146 PolarHBondContact O-N 2.98Å; I143-I147 HydrophobicContact CG2-CD1 3.78Å; I143-I147 HydrophobicContact CG2-CG1 4.44Å; I143-I147 VanDerWaalsContact O-CG1 3.31Å; I143-I147 WeakPolarHBondContact O-CG1 3.47Å; I143-I147 PolarHBondContact O-N 2.73Å
144	R	80.6	Confident	79.2	Confident	151 Å²	151	77 Å²	77	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-63.5	-48	176.3	-164.6	-176.7	-54.6	107.5	6.9	111.6	H140 D141 R142 F146 I147 Q148	H140-R144 WeakPolarHBondContact O-CB 3.18Å; H140-R144 PolarHBondContact O-N 3.43Å; D141-R144 PolarHBondContact O-N 2.73Å; D141-R144 IonicContact OD1-CZ 3.63Å; D141-R144 IonicContact OD1-NH1 3.08Å; D141-R144 PolarHBondContact OD1-NH1 3.19Å; D141-R144 IonicContact OD1-NH2 3.66Å; R142-R144 VanDerWaalsContact C-N 3.34Å; R144-F146 VanDerWaalsContact C-N 3.33Å; R144-F146 PolarHBondContact O-N 3.32Å; R144-I147 PolarHBondContact O-N 2.88Å; R144-Q148 WeakPolarHBondContact O-CB 3.22Å; R144-Q148 PolarHBondContact O-N 3.45Å
145	Q	81.6	Confident	79.9	Confident	98 Å²	98	77.6 Å²	77.6	46%	0.458	37%	0.367	S	S	.	.	H	α-helix	trans	-60.9	-41.9	175.6	-177.1	178.2	-3.7	0	0	111.2	D141 R142 Q148 E149	D141-Q145 WeakPolarHBondContact O-CB 3.48Å; D141-Q145 PolarHBondContact O-N 2.62Å; R142-Q145 PolarHBondContact O-N 2.84Å; Q145-Q148 WeakPolarHBondContact O-CB 3.36Å; Q145-Q148 PolarHBondContact O-N 3.18Å; Q145-E149 HydrophobicContact CG-CG 4.24Å; Q145-E149 PolarHBondContact NE2-OE1 2.94Å; Q145-E149 WeakPolarHBondContact O-CB 3.38Å; Q145-E149 WeakPolarHBondContact O-CG 3.24Å; Q145-E149 PolarHBondContact O-N 2.95Å
146	F	81.3	Confident	80.6	Confident	67 Å²	67	80.3 Å²	80.3	29%	0.294	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-51.6	176	170.6	-113.1	0	0	0	112.4	L17 R142 I143 R144 Q148 E149 F150	L17-F146 HydrophobicContact CD1-CD2 3.33Å; L17-F146 HydrophobicContact CD1-CE2 3.35Å; L17-F146 HydrophobicContact CD1-CG 4.09Å; L17-F146 HydrophobicContact CD1-CZ 4.13Å; L17-F146 HydrophobicContact CD2-CB 3.5Å; L17-F146 HydrophobicContact CD2-CD1 4.47Å; L17-F146 HydrophobicContact CD2-CD2 3.45Å; L17-F146 VanDerWaalsContact CD2-CD2 3.45Å; L17-F146 HydrophobicContact CD2-CE2 4.33Å; L17-F146 HydrophobicContact CD2-CG 3.52Å; L17-F146 HydrophobicContact CG-CD2 4.02Å; L17-F146 HydrophobicContact CG-CE2 4.48Å; L17-F146 HydrophobicContact CG-CG 4.45Å; R142-F146 VanDerWaalsContact O-CB 3.28Å; R142-F146 WeakPolarHBondContact O-CB 3.39Å; R142-F146 PolarHBondContact O-N 3.39Å; I143-F146 PolarHBondContact O-N 2.98Å; R144-F146 VanDerWaalsContact C-N 3.33Å; R144-F146 PolarHBondContact O-N 3.32Å; F146-Q148 PolarHBondContact O-N 3.46Å; F146-E149 PolarHBondContact O-N 2.85Å; F146-F150 HydrophobicContact CD2-CB 4.24Å; F146-F150 HydrophobicContact CE1-CB 4.49Å; F146-F150 HydrophobicContact CE2-CB 3.77Å; F146-F150 HydrophobicContact CE2-CD2 4.46Å; F146-F150 HydrophobicContact CE2-CG 4.32Å; F146-F150 HydrophobicContact CZ-CB 3.91Å; F146-F150 HydrophobicContact CZ-CD2 4.32Å; F146-F150 HydrophobicContact CZ-CG 4.09Å; F146-F150 WeakPolarHBondContact O-CB 3Å; F146-F150 PolarHBondContact O-N 3.3Å
147	I	81.9	Confident	81.1	Confident	97 Å²	97	81.9 Å²	81.9	50%	0.497	39%	0.391	S	S	.	.	H	α-helix	trans	-58.6	-39.9	179.7	-69.8	168.7	0	0	0	109.6	I143 R144 T151	I143-I147 HydrophobicContact CG2-CD1 3.78Å; I143-I147 HydrophobicContact CG2-CG1 4.44Å; I143-I147 VanDerWaalsContact O-CG1 3.31Å; I143-I147 WeakPolarHBondContact O-CG1 3.47Å; I143-I147 PolarHBondContact O-N 2.73Å; R144-I147 PolarHBondContact O-N 2.88Å; I147-T151 WeakPolarHBondContact O-CB 3.33Å; I147-T151 PolarHBondContact O-N 2.86Å; I147-T151 PolarHBondContact O-OG1 2.86Å
148	Q	81.6	Confident	81.7	Confident	114 Å²	114	83.1 Å²	83.1	53%	0.533	40%	0.395	S	S	.	.	H	α-helix	trans	-62.6	-55.6	173.9	-170.1	175.6	11.2	0	0	112.1	R144 Q145 F146 F150 T151 F152	R144-Q148 WeakPolarHBondContact O-CB 3.22Å; R144-Q148 PolarHBondContact O-N 3.45Å; Q145-Q148 WeakPolarHBondContact O-CB 3.36Å; Q145-Q148 PolarHBondContact O-N 3.18Å; F146-Q148 PolarHBondContact O-N 3.46Å; Q148-F150 PolarHBondContact O-N 2.79Å; Q148-T151 PolarHBondContact O-N 3.28Å; Q148-F152 HydrophobicContact CG-CD2 3.73Å; Q148-F152 HydrophobicContact CG-CE2 3.87Å; Q148-F152 VanDerWaalsContact O-CD2 3.27Å; Q148-F152 WeakPolarHBondContact O-CD2 3.4Å; Q148-F152 PolarHBondContact O-N 2.78Å
149	E	82.3	Confident	82.3	Confident	49 Å²	49	79.2 Å²	79.2	23%	0.229	37%	0.373	C	S	.	.	H	α-helix	trans	-61.7	-45.2	-178.8	-75.7	178.9	172.1	0	0	112.6	Y16 Q145 F146 R153	Y16-E149 PolarHBondContact OH-OE2 2.85Å; Q145-E149 HydrophobicContact CG-CG 4.24Å; Q145-E149 PolarHBondContact NE2-OE1 2.94Å; Q145-E149 WeakPolarHBondContact O-CB 3.38Å; Q145-E149 WeakPolarHBondContact O-CG 3.24Å; Q145-E149 PolarHBondContact O-N 2.95Å; F146-E149 PolarHBondContact O-N 2.85Å; E149-R153 WeakPolarHBondContact O-CA 3.3Å; E149-R153 VanDerWaalsContact O-CB 3.23Å; E149-R153 WeakPolarHBondContact O-CB 3.31Å; E149-R153 PolarHBondContact O-N 3.3Å
150	F	83.1	Confident	82.9	Confident	102 Å²	102	83.9 Å²	83.9	45%	0.447	40%	0.395	S	S	.	.	I	π-helix	trans	-61.2	-44.6	175.1	175.5	-103.3	0	0	0	111.4	F146 Q148 G154 L155	F146-F150 HydrophobicContact CD2-CB 4.24Å; F146-F150 HydrophobicContact CE1-CB 4.49Å; F146-F150 HydrophobicContact CE2-CB 3.77Å; F146-F150 HydrophobicContact CE2-CD2 4.46Å; F146-F150 HydrophobicContact CE2-CG 4.32Å; F146-F150 HydrophobicContact CZ-CB 3.91Å; F146-F150 HydrophobicContact CZ-CD2 4.32Å; F146-F150 HydrophobicContact CZ-CG 4.09Å; F146-F150 WeakPolarHBondContact O-CB 3Å; F146-F150 PolarHBondContact O-N 3.3Å; Q148-F150 PolarHBondContact O-N 2.79Å; F150-G154 CarbonylContact O-C 3.15Å; F150-G154 VanDerWaalsContact O-CA 3.24Å; F150-G154 WeakPolarHBondContact O-CA 3.22Å; F150-G154 PolarHBondContact O-N 2.88Å; F150-L155 HydrophobicContact CD1-CB 4.39Å; F150-L155 HydrophobicContact CE1-CB 4Å; F150-L155 HydrophobicContact CE1-CD2 4.28Å; F150-L155 HydrophobicContact CZ-CB 4.35Å; F150-L155 PolarHBondContact O-N 3.18Å
151	T	82.4	Confident	83.6	Confident	46 Å²	46	87.4 Å²	87.4	28%	0.282	41%	0.41	S	S	.	.	I	π-helix	trans	-64.3	-49	179.6	-59.7	0	0	0	0	111.3	I147 Q148 L156	I147-T151 WeakPolarHBondContact O-CB 3.33Å; I147-T151 PolarHBondContact O-N 2.86Å; I147-T151 PolarHBondContact O-OG1 2.86Å; Q148-T151 PolarHBondContact O-N 3.28Å; T151-L156 HydrophobicContact CG2-CD1 4.14Å; T151-L156 HydrophobicContact CG2-CG 4.25Å; T151-L156 WeakPolarHBondContact O-CB 2.96Å; T151-L156 WeakPolarHBondContact O-CG 3.39Å; T151-L156 PolarHBondContact O-N 3.19Å
152	F	82.5	Confident	84.1	Confident	135 Å²	135	85.3 Å²	85.3	59%	0.592	40%	0.399	S	S	*	.	I	π-helix	trans	-77	-37	-176.2	-78.4	-69.6	0	0	0	114.5	Q148 L156 P157	Q148-F152 HydrophobicContact CG-CD2 3.73Å; Q148-F152 HydrophobicContact CG-CE2 3.87Å; Q148-F152 VanDerWaalsContact O-CD2 3.27Å; Q148-F152 WeakPolarHBondContact O-CD2 3.4Å; Q148-F152 PolarHBondContact O-N 2.78Å; F152-L156 HydrophobicContact CD1-CD1 4.16Å; F152-L156 HydrophobicContact CE1-CD1 4.44Å; F152-P157 WeakPolarHBondContact O-CD 3.47Å; F152-P157 WeakPolarHBondContact O-CG 3.5Å
153	R	81.1	Confident	84.7	Confident	201 Å²	201	83 Å²	83	76%	0.758	39%	0.392	S	S	*	.	I	π-helix	trans	-100.1	-23.9	-174.9	-58.3	-175.9	174.4	-175.3	0.5	114.1	E149	E149-R153 WeakPolarHBondContact O-CA 3.3Å; E149-R153 VanDerWaalsContact O-CB 3.23Å; E149-R153 WeakPolarHBondContact O-CB 3.31Å; E149-R153 PolarHBondContact O-N 3.3Å
154	G	84.6	Confident	85.2	Confident	30 Å²	30	87 Å²	87	31%	0.309	40%	0.404	S	S	.	.	I	π-helix	trans	-107.7	-69	-178.8	0	0	0	0	0	112.9	F150 H158	F150-G154 CarbonylContact O-C 3.15Å; F150-G154 VanDerWaalsContact O-CA 3.24Å; F150-G154 WeakPolarHBondContact O-CA 3.22Å; F150-G154 PolarHBondContact O-N 2.88Å; G154-H158 WeakPolarHBondContact O-CB 3.27Å; G154-H158 PolarHBondContact O-N 3.15Å
155	L	84.1	Confident	85.6	Confident	70 Å²	70	84.1 Å²	84.1	37%	0.366	40%	0.397	S	S	.	.	I	π-helix	trans	-66.5	-52.3	-167.7	-174.4	60.8	0	0	0	112.9	F150 H158 I159	F150-L155 HydrophobicContact CD1-CB 4.39Å; F150-L155 HydrophobicContact CE1-CB 4Å; F150-L155 HydrophobicContact CE1-CD2 4.28Å; F150-L155 HydrophobicContact CZ-CB 4.35Å; F150-L155 PolarHBondContact O-N 3.18Å; L155-H158 PolarHBondContact O-N 3.06Å; L155-I159 HydrophobicContact CD1-CD1 3.99Å; L155-I159 HydrophobicContact CD1-CG1 4.32Å; L155-I159 HydrophobicContact CG-CD1 3.9Å; L155-I159 WeakPolarHBondContact O-CG1 3.31Å; L155-I159 PolarHBondContact O-N 2.79Å
156	L	85.7	Confident	85.8	Confident	68 Å²	68	80.6 Å²	80.6	36%	0.356	38%	0.381	S	S	.	.	H	α-helix	trans	-61.9	-49	-179.8	-74.3	171.1	0	0	0	112.2	T151 F152 H158 I159 E160 V228	T151-L156 HydrophobicContact CG2-CD1 4.14Å; T151-L156 HydrophobicContact CG2-CG 4.25Å; T151-L156 WeakPolarHBondContact O-CB 2.96Å; T151-L156 WeakPolarHBondContact O-CG 3.39Å; T151-L156 PolarHBondContact O-N 3.19Å; F152-L156 HydrophobicContact CD1-CD1 4.16Å; F152-L156 HydrophobicContact CE1-CD1 4.44Å; L156-H158 VanDerWaalsContact C-N 3.28Å; L156-H158 PolarHBondContact O-N 2.93Å; L156-I159 PolarHBondContact O-N 2.96Å; L156-E160 WeakPolarHBondContact O-CB 3.36Å; L156-E160 PolarHBondContact O-N 2.91Å; L156-V228 HydrophobicContact CD2-CG1 4.33Å
157	P	88.7	Confident	86	Confident	57 Å²	57	80.4 Å²	80.4	37%	0.37	38%	0.383	S	S	.	.	H	α-helix	trans	-60.5	-33.1	173.9	-26.9	37	0	0	0	113.9	F152 K161	F152-P157 WeakPolarHBondContact O-CD 3.47Å; F152-P157 WeakPolarHBondContact O-CG 3.5Å; P157-K161 VanDerWaalsContact O-CB 3.26Å; P157-K161 WeakPolarHBondContact O-CB 3.1Å; P157-K161 PolarHBondContact O-N 2.85Å
158	H	88.2	Confident	86.2	Confident	109 Å²	109	80.6 Å²	80.6	51%	0.505	39%	0.385	S	S	.	.	H	α-helix	trans	-69.6	-45	175.7	-176	73.7	0	0	0	112	G154 L155 L156 K161 N162	G154-H158 WeakPolarHBondContact O-CB 3.27Å; G154-H158 PolarHBondContact O-N 3.15Å; L155-H158 PolarHBondContact O-N 3.06Å; L156-H158 VanDerWaalsContact C-N 3.28Å; L156-H158 PolarHBondContact O-N 2.93Å; H158-K161 PolarHBondContact O-N 3Å; H158-N162 PolarHBondContact CD2-ND2 2.88Å; H158-N162 PolarHBondContact NE2-ND2 2.88Å; H158-N162 PolarHBondContact O-N 3.02Å; H158-N162 PolarHBondContact O-ND2 3.32Å
159	I	90	Very high	86.1	Confident	22 Å²	22	78.9 Å²	78.9	11%	0.113	38%	0.377	C	S	.	.	H	α-helix	trans	-60.5	-46.6	174.3	-68.8	168.2	0	0	0	110.1	L155 L156 K161 N162 I163 L224 V228	L155-I159 HydrophobicContact CD1-CD1 3.99Å; L155-I159 HydrophobicContact CD1-CG1 4.32Å; L155-I159 HydrophobicContact CG-CD1 3.9Å; L155-I159 WeakPolarHBondContact O-CG1 3.31Å; L155-I159 PolarHBondContact O-N 2.79Å; L156-I159 PolarHBondContact O-N 2.96Å; I159-K161 PolarHBondContact O-N 2.9Å; I159-N162 PolarHBondContact O-N 3.35Å; I159-I163 HydrophobicContact CG2-CD1 3.78Å; I159-I163 HydrophobicContact CG2-CG1 4.38Å; I159-I163 WeakPolarHBondContact O-CG1 3.3Å; I159-I163 PolarHBondContact O-N 3Å; I159-L224 HydrophobicContact CG2-CB 4.38Å; I159-L224 HydrophobicContact CG2-CD2 4.31Å; I159-V228 HydrophobicContact CD1-CG1 4.42Å; I159-V228 HydrophobicContact CG2-CG1 3.75Å
160	E	89.4	Confident	85.7	Confident	98 Å²	98	78 Å²	78	46%	0.458	37%	0.374	S	S	.	.	H	α-helix	trans	-61.3	-45.2	179.3	-155.2	-150.5	146	0	0	111.5	L156 N162 I163 R164	L156-E160 WeakPolarHBondContact O-CB 3.36Å; L156-E160 PolarHBondContact O-N 2.91Å; E160-N162 VanDerWaalsContact C-N 3.34Å; E160-N162 PolarHBondContact O-N 2.78Å; E160-I163 PolarHBondContact O-N 3.47Å; E160-R164 WeakPolarHBondContact O-CG 3.23Å; E160-R164 PolarHBondContact O-N 2.68Å; E160-R164 IonicContact OE1-CZ 3.84Å; E160-R164 IonicContact OE1-NE 2.66Å; E160-R164 PolarHBondContact OE1-NE 2.96Å; E160-R164 IonicContact OE1-NH2 2.73Å; E160-R164 PolarHBondContact OE1-NH2 2.81Å; E160-R164 IonicContact OE2-CZ 3.19Å; E160-R164 IonicContact OE2-NH2 3.11Å; E160-R164 PolarHBondContact OE2-NH2 2.97Å
161	K	90.8	Very high	85.3	Confident	114 Å²	114	77 Å²	77	50%	0.496	38%	0.376	S	S	.	.	H	α-helix	trans	-58.4	-43.6	174	-177.6	-179.4	178.4	-178.2	0	112	P157 H158 I159 R164 Q165	P157-K161 VanDerWaalsContact O-CB 3.26Å; P157-K161 WeakPolarHBondContact O-CB 3.1Å; P157-K161 PolarHBondContact O-N 2.85Å; H158-K161 PolarHBondContact O-N 3Å; I159-K161 PolarHBondContact O-N 2.9Å; K161-R164 PolarHBondContact O-N 3.3Å; K161-Q165 WeakPolarHBondContact O-CB 3.31Å; K161-Q165 VanDerWaalsContact O-CG 3.3Å; K161-Q165 WeakPolarHBondContact O-CG 3.42Å; K161-Q165 PolarHBondContact O-N 2.86Å
162	N	90.3	Very high	84.7	Confident	38 Å²	38	78.5 Å²	78.5	20%	0.203	39%	0.388	C	S	.	.	H	α-helix	trans	-64.1	-42.7	176.8	-75.1	-49.8	0	0	0	112	H158 I159 E160 Q165 L166 L224	H158-N162 PolarHBondContact CD2-ND2 2.88Å; H158-N162 PolarHBondContact NE2-ND2 2.88Å; H158-N162 PolarHBondContact O-N 3.02Å; H158-N162 PolarHBondContact O-ND2 3.32Å; I159-N162 PolarHBondContact O-N 3.35Å; E160-N162 VanDerWaalsContact C-N 3.34Å; E160-N162 PolarHBondContact O-N 2.78Å; N162-Q165 PolarHBondContact O-N 3.06Å; N162-L166 WeakPolarHBondContact O-CB 3.28Å; N162-L166 VanDerWaalsContact O-CG 3.27Å; N162-L166 WeakPolarHBondContact O-CG 3.42Å; N162-L166 PolarHBondContact O-N 2.9Å; N162-L224 HydrophobicContact CB-CD1 3.8Å
163	I	90	Very high	83.9	Confident	27 Å²	27	77.5 Å²	77.5	14%	0.138	38%	0.381	C	S	.	.	H	α-helix	trans	-61.4	-47.4	176	-68.4	168.2	0	0	0	110.2	I159 E160 L166 N167 M221 L224 V228	I159-I163 HydrophobicContact CG2-CD1 3.78Å; I159-I163 HydrophobicContact CG2-CG1 4.38Å; I159-I163 WeakPolarHBondContact O-CG1 3.3Å; I159-I163 PolarHBondContact O-N 3Å; E160-I163 PolarHBondContact O-N 3.47Å; I163-L166 PolarHBondContact O-N 2.96Å; I163-N167 VanDerWaalsContact O-CB 3.31Å; I163-N167 WeakPolarHBondContact O-CB 3.21Å; I163-N167 PolarHBondContact O-N 3.29Å; I163-M221 HydrophobicContact CG2-CG 4.41Å; I163-L224 HydrophobicContact CD1-CB 4.02Å; I163-L224 HydrophobicContact CG1-CB 3.74Å; I163-L224 HydrophobicContact CG1-CD1 4.22Å; I163-V228 HydrophobicContact CD1-CG2 4.3Å
164	R	88.8	Confident	82.8	Confident	134 Å²	134	75.3 Å²	75.3	51%	0.506	38%	0.376	S	S	.	.	H	α-helix	trans	-58.2	-50.3	176.1	-66.9	-169.6	-131.2	144.6	-2.1	111.4	E160 K161 L166 N167 D168	E160-R164 WeakPolarHBondContact O-CG 3.23Å; E160-R164 PolarHBondContact O-N 2.68Å; E160-R164 IonicContact OE1-CZ 3.84Å; E160-R164 IonicContact OE1-NE 2.66Å; E160-R164 PolarHBondContact OE1-NE 2.96Å; E160-R164 IonicContact OE1-NH2 2.73Å; E160-R164 PolarHBondContact OE1-NH2 2.81Å; E160-R164 IonicContact OE2-CZ 3.19Å; E160-R164 IonicContact OE2-NH2 3.11Å; E160-R164 PolarHBondContact OE2-NH2 2.97Å; K161-R164 PolarHBondContact O-N 3.3Å; R164-L166 PolarHBondContact O-N 2.96Å; R164-N167 PolarHBondContact O-N 3.21Å; R164-N167 VanDerWaalsContact O-N 3.17Å; R164-D168 PolarHBondContact O-N 2.66Å
165	Q	88.8	Confident	81.2	Confident	91 Å²	91	77 Å²	77	43%	0.425	39%	0.394	S	S	.	.	H	α-helix	trans	-60	-42.5	179.4	-75.4	-179.4	-27.1	0	0	113.4	K161 N162 Q169	K161-Q165 WeakPolarHBondContact O-CB 3.31Å; K161-Q165 VanDerWaalsContact O-CG 3.3Å; K161-Q165 WeakPolarHBondContact O-CG 3.42Å; K161-Q165 PolarHBondContact O-N 2.86Å; N162-Q165 PolarHBondContact O-N 3.06Å; Q165-Q169 VanDerWaalsContact O-CG 3.27Å; Q165-Q169 WeakPolarHBondContact O-CG 3.06Å; Q165-Q169 PolarHBondContact O-N 3.03Å; Q165-Q169 VanDerWaalsContact O-N 3.11Å
166	L	86.8	Confident	79.4	Confident	23 Å²	23	79.8 Å²	79.8	12%	0.12	41%	0.409	C	S	.	.	H	α-helix	trans	-67.7	-37.6	176.6	-70.5	167.5	0	0	0	111.5	N162 I163 R164 Q169 L170 Q217 K220 M221 L224	N162-L166 WeakPolarHBondContact O-CB 3.28Å; N162-L166 VanDerWaalsContact O-CG 3.27Å; N162-L166 WeakPolarHBondContact O-CG 3.42Å; N162-L166 PolarHBondContact O-N 2.9Å; I163-L166 PolarHBondContact O-N 2.96Å; R164-L166 PolarHBondContact O-N 2.96Å; L166-Q169 PolarHBondContact O-N 2.92Å; L166-L170 WeakPolarHBondContact O-CB 2.99Å; L166-L170 PolarHBondContact O-N 3.16Å; L166-Q217 HydrophobicContact CD2-CB 4.09Å; L166-Q217 HydrophobicContact CD2-CG 4.3Å; L166-K220 HydrophobicContact CD1-CG 4.31Å; L166-M221 HydrophobicContact CB-CB 3.99Å; L166-M221 HydrophobicContact CB-CG 3.98Å; L166-M221 HydrophobicContact CB-SD 3.79Å; L166-M221 HydrophobicContact CD1-CB 3.94Å; L166-M221 HydrophobicContact CD1-CG 4.42Å; L166-L224 HydrophobicContact CD1-CD1 3.98Å
167	N	85.8	Confident	77.4	Confident	63 Å²	63	80 Å²	80	34%	0.337	42%	0.416	S	S	.	.	H	α-helix	trans	-68.1	-41.9	176.7	-175.2	63.8	0	0	0	112	I163 R164 Q169 L170 V171 M221	I163-N167 VanDerWaalsContact O-CB 3.31Å; I163-N167 WeakPolarHBondContact O-CB 3.21Å; I163-N167 PolarHBondContact O-N 3.29Å; R164-N167 PolarHBondContact O-N 3.21Å; R164-N167 VanDerWaalsContact O-N 3.17Å; N167-Q169 VanDerWaalsContact C-N 3.31Å; N167-Q169 PolarHBondContact O-N 2.75Å; N167-L170 WeakPolarHBondContact O-CA 3.19Å; N167-L170 WeakPolarHBondContact O-CB 2.91Å; N167-L170 PolarHBondContact O-N 3.27Å; N167-V171 WeakPolarHBondContact O-CG2 3.28Å; N167-V171 PolarHBondContact O-N 2.9Å; N167-M221 HydrophobicContact CB-SD 3.76Å; N167-M221 PolarHBondContact N-SD 3.08Å; N167-M221 VanDerWaalsContact N-SD 3.4Å
168	D	85.2	Confident	75.6	Confident	101 Å²	101	85.5 Å²	85.5	54%	0.54	43%	0.43	S	S	.	.	H	α-helix	trans	-62.9	-39	176.1	-65.4	-23.2	0	0	0	111.3	R164 L170 S172	R164-D168 PolarHBondContact O-N 2.66Å; D168-L170 VanDerWaalsContact C-N 3.32Å; D168-L170 PolarHBondContact O-N 2.87Å; D168-S172 VanDerWaalsContact O-CB 3.28Å; D168-S172 WeakPolarHBondContact O-CB 3.44Å; D168-S172 PolarHBondContact O-N 2.87Å; D168-S172 PolarHBondContact O-OG 2.95Å
169	Q	79.8	Confident	73.6	Confident	79 Å²	79	84.7 Å²	84.7	37%	0.369	44%	0.436	S	S	.	.	H	α-helix	trans	-64.8	-33.1	171.9	-72.3	174.9	17.3	0	0	112.7	Q165 L166 N167 S172 R173	Q165-Q169 VanDerWaalsContact O-CG 3.27Å; Q165-Q169 WeakPolarHBondContact O-CG 3.06Å; Q165-Q169 PolarHBondContact O-N 3.03Å; Q165-Q169 VanDerWaalsContact O-N 3.11Å; L166-Q169 PolarHBondContact O-N 2.92Å; N167-Q169 VanDerWaalsContact C-N 3.31Å; N167-Q169 PolarHBondContact O-N 2.75Å; Q169-S172 WeakPolarHBondContact CA-OG 3.02Å; Q169-S172 PolarHBondContact O-OG 2.76Å; Q169-R173 WeakPolarHBondContact O-CB 2.96Å; Q169-R173 WeakPolarHBondContact O-CD 2.93Å; Q169-R173 VanDerWaalsContact O-CG 3.22Å; Q169-R173 WeakPolarHBondContact O-CG 3.26Å; Q169-R173 PolarHBondContact O-N 2.93Å
170	L	74.1	Confident	71.5	Confident	29 Å²	29	89 Å²	89	15%	0.152	46%	0.459	C	S	.	.	H	α-helix	trans	-73.2	-46.7	176.3	-158.2	179.6	0	0	0	111.2	L166 N167 D168 R173 K174 I218 M221	L166-L170 WeakPolarHBondContact O-CB 2.99Å; L166-L170 PolarHBondContact O-N 3.16Å; N167-L170 WeakPolarHBondContact O-CA 3.19Å; N167-L170 WeakPolarHBondContact O-CB 2.91Å; N167-L170 PolarHBondContact O-N 3.27Å; D168-L170 VanDerWaalsContact C-N 3.32Å; D168-L170 PolarHBondContact O-N 2.87Å; L170-R173 PolarHBondContact O-N 2.97Å; L170-K174 HydrophobicContact CD2-CD 3.78Å; L170-K174 VanDerWaalsContact CD2-CE 3.42Å; L170-K174 HydrophobicContact CD2-CG 4.08Å; L170-K174 PolarHBondContact O-N 3.01Å; L170-I218 HydrophobicContact CD1-CD1 4.32Å; L170-I218 HydrophobicContact CD1-CG1 3.77Å; L170-I218 HydrophobicContact CG-CD1 4.26Å; L170-I218 HydrophobicContact CG-CG1 4.02Å; L170-M221 HydrophobicContact CD1-CE 3.66Å
171	V	74.2	Confident	69.4	Low	83 Å²	83	92.8 Å²	92.8	50%	0.503	47%	0.474	S	S	.	.	H	α-helix	trans	-67.2	-45.1	-179.2	173.3	0	0	0	0	111.3	N167 R173 K174 G175	N167-V171 WeakPolarHBondContact O-CG2 3.28Å; N167-V171 PolarHBondContact O-N 2.9Å; V171-R173 VanDerWaalsContact C-N 3.26Å; V171-R173 PolarHBondContact O-N 2.98Å; V171-K174 WeakPolarHBondContact O-CB 3.36Å; V171-K174 PolarHBondContact O-N 3.47Å; V171-G175 PolarHBondContact O-N 3.26Å
172	S	70.3	Confident	67.2	Low	77 Å²	77	92.8 Å²	92.8	54%	0.538	48%	0.484	S	S	.	.	H	α-helix	trans	-59.5	-36.3	175	53.9	0	0	0	0	112.6	D168 Q169 G175	D168-S172 VanDerWaalsContact O-CB 3.28Å; D168-S172 WeakPolarHBondContact O-CB 3.44Å; D168-S172 PolarHBondContact O-N 2.87Å; D168-S172 PolarHBondContact O-OG 2.95Å; Q169-S172 WeakPolarHBondContact CA-OG 3.02Å; Q169-S172 PolarHBondContact O-OG 2.76Å; S172-G175 PolarHBondContact O-N 3.11Å
173	R	66.2	Low	64.9	Low	114 Å²	114	93.8 Å²	93.8	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-70.9	-33.3	172.5	-74.5	174.3	176.6	168.2	-0	113.6	Q169 L170 V171 G175 L176	Q169-R173 WeakPolarHBondContact O-CB 2.96Å; Q169-R173 WeakPolarHBondContact O-CD 2.93Å; Q169-R173 VanDerWaalsContact O-CG 3.22Å; Q169-R173 WeakPolarHBondContact O-CG 3.26Å; Q169-R173 PolarHBondContact O-N 2.93Å; L170-R173 PolarHBondContact O-N 2.97Å; V171-R173 VanDerWaalsContact C-N 3.26Å; V171-R173 PolarHBondContact O-N 2.98Å; R173-G175 PolarHBondContact O-N 3.32Å; R173-L176 PolarHBondContact O-N 3.32Å; R173-L176 VanDerWaalsContact O-N 3.16Å
174	K	56.3	Low	62.7	Low	154 Å²	154	96.9 Å²	96.9	67%	0.67	52%	0.517	S	S	*	.	H	α-helix	trans	-63.7	-21.8	173.9	-82.1	176.2	173.1	169.8	0	113.4	L170 V171 L176	L170-K174 HydrophobicContact CD2-CD 3.78Å; L170-K174 VanDerWaalsContact CD2-CE 3.42Å; L170-K174 HydrophobicContact CD2-CG 4.08Å; L170-K174 PolarHBondContact O-N 3.01Å; V171-K174 WeakPolarHBondContact O-CB 3.36Å; V171-K174 PolarHBondContact O-N 3.47Å; K174-L176 VanDerWaalsContact C-N 3.32Å
175	G	51.7	Low	60.7	Low	66 Å²	66	99.7 Å²	99.7	68%	0.68	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.1	173.5	0	0	0	0	0	114.8	V171 S172 R173	V171-G175 PolarHBondContact O-N 3.26Å; S172-G175 PolarHBondContact O-N 3.11Å; R173-G175 PolarHBondContact O-N 3.32Å
176	L	47.4	Very low	58.8	Low	128 Å²	128	104.3 Å²	104.3	67%	0.67	55%	0.552	S	S	*	*	S	Bend	trans	-108.6	112.3	173.1	-84.1	78	0	0	0	109.4	R173 K174	R173-L176 PolarHBondContact O-N 3.32Å; R173-L176 VanDerWaalsContact O-N 3.16Å; K174-L176 VanDerWaalsContact C-N 3.32Å
177	S	41.7	Very low	56.9	Low	74 Å²	74	111.8 Å²	111.8	52%	0.517	58%	0.584	S	S	.	*			trans	-56.3	145.9	-174.3	77.6	0	0	0	0	113.5	S179	S177-S179 PolarHBondContact O-N 3.4Å
178	R	51.4	Low	55.1	Low	172 Å²	172	118.7 Å²	118.7	65%	0.649	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-2.3	174.4	-74.1	-174.1	173.2	-169	-2.8	114.7	D244	R178-D244 IonicContact CZ-OD1 2.87Å; R178-D244 IonicContact CZ-OD2 3.77Å; R178-D244 IonicContact NH1-OD1 2.96Å; R178-D244 PolarHBondContact NH1-OD1 2.97Å; R178-D244 IonicContact NH1-OD2 3.24Å; R178-D244 IonicContact NH2-OD1 3.97Å; R178-D244 PolarHBondContact NH2-OD1 2.84Å; R178-D244 VanDerWaalsContact NH2-OD1 3.11Å; R178-D244 IonicContact NH2-OD2 2.7Å; R178-D244 PolarHBondContact NH2-OD2 2.9Å
179	S	46.4	Very low	52.7	Low	92 Å²	92	117.2 Å²	117.2	64%	0.643	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-15.9	-175.5	-166.9	0	0	0	0	115.1	S177	S177-S179 PolarHBondContact O-N 3.4Å
180	L	45.8	Very low	50.6	Low	112 Å²	112	117.9 Å²	117.9	59%	0.586	65%	0.648	S	S	*	*	S	Bend	trans	-94.1	-26.8	-169.8	-65.9	175.5	0	0	0	114.5
181	F	44.9	Very low	48.6	Very low	178 Å²	178	119.8 Å²	119.8	78%	0.781	68%	0.675	S	S	*	*	H	α-helix	trans	-85.5	-17	-174.9	-99.1	-88.5	0	0	0	115.3	A183	F181-A183 VanDerWaalsContact C-N 3.32Å
182	T	45.1	Very low	46.7	Very low	114 Å²	114	125.7 Å²	125.7	70%	0.699	69%	0.694	S	S	*	*	H	α-helix	trans	-80.2	-16.6	172.2	-30.5	0	0	0	0	112.3
183	A	41.3	Very low	45.2	Very low	58 Å²	58	128.5 Å²	128.5	48%	0.479	71%	0.707	S	S	.	*	H	α-helix	trans	-85.4	-33	-175.7	0	0	0	0	0	113.6	F181 K185 K186	F181-A183 VanDerWaalsContact C-N 3.32Å; A183-K185 PolarHBondContact O-N 3.3Å; A183-K186 PolarHBondContact O-N 3.47Å
184	T	44.6	Very low	44	Very low	92 Å²	92	128.2 Å²	128.2	56%	0.564	72%	0.72	S	S	*	*	H	α-helix	trans	-74.7	-24.5	-175.3	47.1	0	0	0	0	113.9	K186 F187	T184-K186 PolarHBondContact O-N 3.47Å; T184-F187 PolarHBondContact O-N 3.44Å
185	K	46.2	Very low	42.9	Very low	194 Å²	194	129.4 Å²	129.4	84%	0.843	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-4.9	173.5	-154.9	171.8	-175.9	175.6	0	113.8	A183	A183-K185 PolarHBondContact O-N 3.3Å
186	K	50.4	Low	42.6	Very low	188 Å²	188	136.4 Å²	136.4	82%	0.817	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	0.6	177.2	-77.2	-170.5	174.6	-177.2	0	115.2	A183 T184	A183-K186 PolarHBondContact O-N 3.47Å; T184-K186 PolarHBondContact O-N 3.47Å
187	F	46.1	Very low	41.7	Very low	179 Å²	179	135.8 Å²	135.8	79%	0.785	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.4	-5.7	-175.1	-119.4	-91.9	0	0	0	116.6	T184	T184-F187 PolarHBondContact O-N 3.44Å
188	F	47.3	Very low	41.4	Very low	208 Å²	208	139.7 Å²	139.7	91%	0.912	76%	0.76	S	S	*	*	S	Bend	trans	-132.7	59.5	175.4	-89.4	-85.6	0	0	0	111.7
189	G	35.2	Very low	40.8	Very low	71 Å²	71	139.3 Å²	139.3	73%	0.732	77%	0.771	S	S	*	*			trans	-156.9	46.9	-176.1	0	0	0	0	0	113.7	G191	G189-G191 PolarHBondContact O-N 3.12Å
190	G	35.4	Very low	39.9	Very low	92 Å²	92	143.3 Å²	143.3	95%	0.948	78%	0.779	S	S	*	*			trans	-79.5	112.3	174.4	0	0	0	0	0	111.4
191	G	33.7	Very low	39.5	Very low	70 Å²	70	143.9 Å²	143.9	72%	0.722	79%	0.79	S	S	*	*			trans	175.8	63.3	-177.7	0	0	0	0	0	117.2	G189	G189-G191 PolarHBondContact O-N 3.12Å
192	K	33.2	Very low	39.3	Very low	206 Å²	206	145 Å²	145	90%	0.896	79%	0.794	S	S	*	*			trans	60.1	121.4	159.6	-58.4	-177.1	-179.4	-179.6	0	118.9
193	V	38.4	Very low	39	Very low	136 Å²	136	143.2 Å²	143.2	82%	0.824	79%	0.786	S	S	*	*			trans	-67.9	143.4	157.2	178.9	0	0	0	0	108.7
194	P	41.8	Very low	39.4	Very low	109 Å²	109	143.4 Å²	143.4	71%	0.708	78%	0.782	S	S	*	*				-133	136.4	115	35.2	-25.7	0	0	0	114.4
195	E	32.5	Very low	39.4	Very low	179 Å²	179	147.5 Å²	147.5	84%	0.836	79%	0.788	S	S	*	*			trans	62.8	150.1	140.8	-62.9	-171.1	119.7	0	0	123.5	S197	E195-S197 PolarHBondContact O-N 3.23Å
196	K	45.1	Very low	39.5	Very low	213 Å²	213	141.1 Å²	141.1	93%	0.926	78%	0.777	S	S	*	*			trans	-69.3	109.5	175.8	-64	167.5	177.1	173.3	0	109.5
197	S	30.2	Very low	39.7	Very low	115 Å²	115	136.4 Å²	136.4	80%	0.804	76%	0.761	S	S	*	*			trans	-94.8	155.7	155.6	57	0	0	0	0	111	E195	E195-S197 PolarHBondContact O-N 3.23Å
198	I	35.3	Very low	40.5	Very low	155 Å²	155	136.1 Å²	136.1	80%	0.795	76%	0.762	S	S	*	*			trans	-64.3	156.8	-172	-70	150.3	0	0	0	111.6	E200	I198-E200 PolarHBondContact O-N 2.65Å
199	N	37.6	Very low	41.9	Very low	165 Å²	165	127.4 Å²	127.4	88%	0.882	72%	0.723	S	S	*	*			trans	-57.9	90.1	172.2	-74.1	-35	0	0	0	112
200	E	28.8	Very low	44.1	Very low	176 Å²	176	127.6 Å²	127.6	82%	0.822	71%	0.711	S	S	*	*			trans	-86.8	129.8	157.1	-73	-168.8	140.7	0	0	109.6	I198 K202	I198-E200 PolarHBondContact O-N 2.65Å; E200-K202 PolarHBondContact O-N 3.32Å; E200-K202 VanDerWaalsContact O-N 3.15Å
201	P	36.4	Very low	46	Very low	124 Å²	124	127.9 Å²	127.9	81%	0.805	70%	0.696	S	S	*	*			trans	-68.6	114.9	173.5	28.5	-31.9	0	0	0	108.7	S203	P201-S203 PolarHBondContact O-N 2.87Å
202	K	40.4	Very low	48.2	Very low	200 Å²	200	130.3 Å²	130.3	87%	0.87	69%	0.689	S	S	*	*			trans	-50.8	118.9	169.6	-73	179.1	178.5	175.9	0	108.7	E200 T204	E200-K202 PolarHBondContact O-N 3.32Å; E200-K202 VanDerWaalsContact O-N 3.15Å; K202-T204 PolarHBondContact O-N 3.4Å
203	S	39.8	Very low	50.7	Low	77 Å²	77	120.9 Å²	120.9	54%	0.538	65%	0.649	S	S	.	*			trans	-51.3	125.1	-178.4	178	0	0	0	0	111.2	P201 Y205 G206	P201-S203 PolarHBondContact O-N 2.87Å; S203-Y205 PolarHBondContact O-N 2.98Å; S203-Y205 PolarHBondContact OG-N 3.15Å; S203-G206 PolarHBondContact O-N 3.17Å
204	T	48.7	Very low	52.9	Low	63 Å²	63	116.8 Å²	116.8	39%	0.387	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.5	-12	176.5	-35.7	0	0	0	0	112.7	K202 M251 V290	K202-T204 PolarHBondContact O-N 3.4Å; T204-M251 HydrophobicContact CG2-CB 4.4Å; T204-V290 HydrophobicContact CG2-CG1 4.5Å; T204-V290 PolarHBondContact OG1-O 3.35Å
205	Y	46	Very low	55	Low	178 Å²	178	113.2 Å²	113.2	70%	0.698	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-8.4	174.1	-62.4	-94.5	0	0	0	113.9	S203	S203-Y205 PolarHBondContact O-N 2.98Å; S203-Y205 PolarHBondContact OG-N 3.15Å
206	G	46.8	Very low	57.7	Low	60 Å²	60	106.3 Å²	106.3	62%	0.619	57%	0.568	S	S	*	*			trans	-89.6	-8	-162	0	0	0	0	0	117.9	S203 Q208	S203-G206 PolarHBondContact O-N 3.17Å; G206-Q208 PolarHBondContact O-N 2.89Å
207	L	56.1	Low	59.7	Low	89 Å²	89	97.6 Å²	97.6	47%	0.466	53%	0.531	S	S	.	.			trans	-98.6	75.1	180	-151	85.2	0	0	0	111.5	Y209 D248 A250 Y253	L207-Y209 HydrophobicContact CD2-CE2 4.09Å; L207-Y209 PolarHBondContact O-N 2.82Å; L207-D248 HydrophobicContact CD2-CB 4.1Å; L207-A250 HydrophobicContact CD2-CB 3.86Å; L207-Y253 WeakPolarHBondContact O-CE2 3.18Å
208	Q	62.4	Low	62.6	Low	173 Å²	173	92.8 Å²	92.8	81%	0.808	50%	0.496	S	S	*	.			trans	-78.9	99.7	176.9	-163.1	170.1	18.8	0	0	109.8	G206	G206-Q208 PolarHBondContact O-N 2.89Å
209	Y	76.1	Confident	65.3	Low	24 Å²	24	87.8 Å²	87.8	9%	0.094	47%	0.467	C	S	.	.			trans	-62.1	133.5	172.5	-76	-86.1	0	0	0	110.1	L207 A213 E215 L216 F245 D248 A250 Y253	L207-Y209 HydrophobicContact CD2-CE2 4.09Å; L207-Y209 PolarHBondContact O-N 2.82Å; Y209-A213 HydrophobicContact CD1-CB 3.79Å; Y209-A213 HydrophobicContact CG-CB 4.4Å; Y209-E215 HydrophobicContact CE1-CB 4.26Å; Y209-E215 HydrophobicContact CE1-CG 4.21Å; Y209-L216 VanDerWaalsContact CB-CD1 3.49Å; Y209-L216 HydrophobicContact CG-CG 4.22Å; Y209-F245 HydrophobicContact CD2-CD1 4.46Å; Y209-F245 HydrophobicContact CD2-CE1 4.18Å; Y209-F245 AromaticContact CE2-CD1 3.57Å; Y209-F245 HydrophobicContact CE2-CD1 3.57Å; Y209-F245 AromaticContact CE2-CE1 3.71Å; Y209-F245 HydrophobicContact CE2-CE1 3.71Å; Y209-F245 AromaticContact CZ-CD1 3.67Å; Y209-F245 AromaticContact CZ-CE1 3.93Å; Y209-D248 WeakPolarHBondContact OH-CB 3.38Å; Y209-D248 PolarHBondContact OH-OD2 3.49Å; Y209-A250 HydrophobicContact CE2-CB 3.58Å; Y209-Y253 AromaticContact CD2-CD2 3.91Å; Y209-Y253 HydrophobicContact CD2-CD2 3.91Å; Y209-Y253 AromaticContact CD2-CE2 3.82Å; Y209-Y253 HydrophobicContact CD2-CE2 3.82Å; Y209-Y253 HydrophobicContact CD2-CG 4.3Å; Y209-Y253 AromaticContact CE2-CD2 3.97Å; Y209-Y253 HydrophobicContact CE2-CD2 3.97Å; Y209-Y253 HydrophobicContact CE2-CE2 4.3Å; Y209-Y253 HydrophobicContact CE2-CG 4.33Å
210	P	81.5	Confident	67.9	Low	75 Å²	75	85.8 Å²	85.8	49%	0.487	45%	0.451	S	S	.	.			trans	-64.3	148	168.5	28.1	-33.5	0	0	0	109.8	E212 A213	P210-E212 PolarHBondContact O-N 2.65Å; P210-A213 HydrophobicContact CG-CB 4.15Å; P210-A213 WeakPolarHBondContact O-CB 2.96Å; P210-A213 PolarHBondContact O-N 3.18Å
211	P	75.1	Confident	70.9	Confident	98 Å²	98	77.5 Å²	77.5	64%	0.636	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.2	-176.2	19.8	-27.4	0	0	0	114.2
212	E	80.4	Confident	73.7	Confident	121 Å²	121	71.6 Å²	71.6	57%	0.565	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-3.9	174.4	-58.1	70.7	-153.2	0	0	114.1	P210 Q217	P210-E212 PolarHBondContact O-N 2.65Å; E212-Q217 VanDerWaalsContact O-CD 3.3Å; E212-Q217 PolarHBondContact O-OE1 3.09Å
213	A	85.3	Confident	76.3	Confident	8 Å²	8	64.7 Å²	64.7	7%	0.066	35%	0.346	C	S	.	.			trans	-59.1	134.8	-179.7	0	0	0	0	0	111.2	Y209 P210 E215 L216 Q217	Y209-A213 HydrophobicContact CD1-CB 3.79Å; Y209-A213 HydrophobicContact CG-CB 4.4Å; P210-A213 HydrophobicContact CG-CB 4.15Å; P210-A213 WeakPolarHBondContact O-CB 2.96Å; P210-A213 PolarHBondContact O-N 3.18Å; A213-E215 PolarHBondContact O-N 3.2Å; A213-E215 VanDerWaalsContact O-N 3.13Å; A213-L216 HydrophobicContact CB-CB 4.39Å; A213-L216 PolarHBondContact O-N 2.85Å; A213-L216 VanDerWaalsContact O-N 3.09Å; A213-Q217 WeakPolarHBondContact O-CG 3.48Å; A213-Q217 PolarHBondContact O-N 2.79Å
214	P	83.9	Confident	78.9	Confident	51 Å²	51	62.2 Å²	62.2	33%	0.331	33%	0.327	S	S	.	.	H	α-helix	trans	-53	-38	-179	4.1	-10.8	0	0	0	113.1	Q217 I218	P214-Q217 PolarHBondContact O-N 2.75Å; P214-I218 WeakPolarHBondContact O-CB 3.4Å; P214-I218 WeakPolarHBondContact O-CD1 3.43Å; P214-I218 WeakPolarHBondContact O-CG1 3.49Å; P214-I218 PolarHBondContact O-N 3.4Å
215	E	86.6	Confident	81	Confident	33 Å²	33	59.3 Å²	59.3	15%	0.154	31%	0.309	C	S	.	.	H	α-helix	trans	-67.3	-42.9	-178.6	-56.6	69	-148.4	0	0	111.2	Y209 A213 R219 D244 F245	Y209-E215 HydrophobicContact CE1-CB 4.26Å; Y209-E215 HydrophobicContact CE1-CG 4.21Å; A213-E215 PolarHBondContact O-N 3.2Å; A213-E215 VanDerWaalsContact O-N 3.13Å; E215-R219 WeakPolarHBondContact O-CB 3.15Å; E215-R219 PolarHBondContact O-N 3.1Å; E215-D244 HydrophobicContact CG-CB 3.69Å; E215-F245 HydrophobicContact CB-CD1 4.11Å; E215-F245 HydrophobicContact CB-CE1 3.48Å; E215-F245 VanDerWaalsContact CB-CE1 3.48Å; E215-F245 HydrophobicContact CB-CZ 3.97Å; E215-F245 HydrophobicContact CG-CE1 4.47Å
216	L	88.5	Confident	83.3	Confident	34 Å²	34	53 Å²	53	18%	0.178	29%	0.285	C	S	.	.	H	α-helix	trans	-71.5	-34.7	173.6	-73	-166.2	0	0	0	112.7	Y209 A213 R219 K220 F245 Y253	Y209-L216 VanDerWaalsContact CB-CD1 3.49Å; Y209-L216 HydrophobicContact CG-CG 4.22Å; A213-L216 HydrophobicContact CB-CB 4.39Å; A213-L216 PolarHBondContact O-N 2.85Å; A213-L216 VanDerWaalsContact O-N 3.09Å; L216-R219 PolarHBondContact O-N 3.16Å; L216-K220 VanDerWaalsContact O-CB 3.3Å; L216-K220 WeakPolarHBondContact O-CB 3.12Å; L216-K220 PolarHBondContact O-N 2.86Å; L216-F245 HydrophobicContact CD2-CE1 4.33Å; L216-F245 HydrophobicContact CD2-CZ 4.15Å; L216-Y253 HydrophobicContact CD2-CD1 3.97Å; L216-Y253 HydrophobicContact CD2-CE1 3.85Å
217	Q	89	Confident	85.5	Confident	30 Å²	30	56.1 Å²	56.1	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-64.8	-40	174.5	-71.8	-177.6	-31	0	0	111.4	L166 E212 A213 P214 M221	L166-Q217 HydrophobicContact CD2-CB 4.09Å; L166-Q217 HydrophobicContact CD2-CG 4.3Å; E212-Q217 VanDerWaalsContact O-CD 3.3Å; E212-Q217 PolarHBondContact O-OE1 3.09Å; A213-Q217 WeakPolarHBondContact O-CG 3.48Å; A213-Q217 PolarHBondContact O-N 2.79Å; P214-Q217 PolarHBondContact O-N 2.75Å; Q217-M221 WeakPolarHBondContact O-CB 3.4Å; Q217-M221 PolarHBondContact O-N 2.83Å
218	I	89.8	Confident	87.1	Confident	15 Å²	15	54.5 Å²	54.5	8%	0.077	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-43.6	172.8	-66.4	164.1	0	0	0	110.9	L170 P214 M221 A222 C237 A241	L170-I218 HydrophobicContact CD1-CD1 4.32Å; L170-I218 HydrophobicContact CD1-CG1 3.77Å; L170-I218 HydrophobicContact CG-CD1 4.26Å; L170-I218 HydrophobicContact CG-CG1 4.02Å; P214-I218 WeakPolarHBondContact O-CB 3.4Å; P214-I218 WeakPolarHBondContact O-CD1 3.43Å; P214-I218 WeakPolarHBondContact O-CG1 3.49Å; P214-I218 PolarHBondContact O-N 3.4Å; I218-M221 PolarHBondContact O-N 2.89Å; I218-A222 WeakPolarHBondContact O-CB 3.25Å; I218-A222 PolarHBondContact O-N 3.35Å; I218-C237 HydrophobicContact CG2-CB 3.96Å; I218-C237 WeakPolarHBondContact CG2-O 3.28Å; I218-A241 HydrophobicContact CG2-CB 4.05Å
219	R	92.3	Very high	88.5	Confident	49 Å²	49	52.8 Å²	52.8	19%	0.185	27%	0.273	C	S	.	.	H	α-helix	trans	-58.6	-48.5	174.5	-179.5	64.8	163.7	111	-5.2	111.4	E215 L216 M221 A222 D223 F245 G256	E215-R219 WeakPolarHBondContact O-CB 3.15Å; E215-R219 PolarHBondContact O-N 3.1Å; L216-R219 PolarHBondContact O-N 3.16Å; R219-M221 PolarHBondContact O-N 2.89Å; R219-A222 WeakPolarHBondContact O-CB 3.31Å; R219-A222 PolarHBondContact O-N 2.83Å; R219-A222 VanDerWaalsContact O-N 3.14Å; R219-D223 IonicContact CZ-OD1 3.77Å; R219-D223 IonicContact CZ-OD2 3.05Å; R219-D223 IonicContact NH1-OD1 3.08Å; R219-D223 PolarHBondContact NH1-OD1 2.92Å; R219-D223 IonicContact NH1-OD2 2.68Å; R219-D223 PolarHBondContact NH1-OD2 3.43Å; R219-D223 PolarHBondContact O-N 2.89Å; R219-F245 HydrophobicContact CB-CZ 4.37Å; R219-G256 PolarHBondContact NH2-O 3.36Å
220	K	92.4	Very high	89.2	Confident	124 Å²	124	56.3 Å²	56.3	54%	0.539	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-41.8	177.3	-178.1	177.3	-179.4	177.9	0	112.3	L166 L216 A222 D223 L224	L166-K220 HydrophobicContact CD1-CG 4.31Å; L216-K220 VanDerWaalsContact O-CB 3.3Å; L216-K220 WeakPolarHBondContact O-CB 3.12Å; L216-K220 PolarHBondContact O-N 2.86Å; K220-A222 VanDerWaalsContact C-N 3.31Å; K220-A222 PolarHBondContact O-N 3Å; K220-D223 PolarHBondContact O-N 3.42Å; K220-L224 WeakPolarHBondContact O-CG 3.33Å; K220-L224 PolarHBondContact O-N 3.26Å
221	M	92.3	Very high	89.8	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-42.6	174.6	-169	173.6	77.2	0	0	110.9	I163 L166 N167 L170 Q217 I218 R219 L224 C225 C237	I163-M221 HydrophobicContact CG2-CG 4.41Å; L166-M221 HydrophobicContact CB-CB 3.99Å; L166-M221 HydrophobicContact CB-CG 3.98Å; L166-M221 HydrophobicContact CB-SD 3.79Å; L166-M221 HydrophobicContact CD1-CB 3.94Å; L166-M221 HydrophobicContact CD1-CG 4.42Å; N167-M221 HydrophobicContact CB-SD 3.76Å; N167-M221 PolarHBondContact N-SD 3.08Å; N167-M221 VanDerWaalsContact N-SD 3.4Å; L170-M221 HydrophobicContact CD1-CE 3.66Å; Q217-M221 WeakPolarHBondContact O-CB 3.4Å; Q217-M221 PolarHBondContact O-N 2.83Å; I218-M221 PolarHBondContact O-N 2.89Å; R219-M221 PolarHBondContact O-N 2.89Å; M221-L224 PolarHBondContact O-N 2.96Å; M221-C225 PolarHBondContact O-N 2.88Å; M221-C225 PolarHBondContact O-SG 2.88Å; M221-C237 WeakPolarHBondContact CE-SG 3.43Å
222	A	94.6	Very high	90.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-39.3	176.4	0	0	0	0	0	112.7	I218 R219 K220 C225 F226 A234 C237 Y238	I218-A222 WeakPolarHBondContact O-CB 3.25Å; I218-A222 PolarHBondContact O-N 3.35Å; R219-A222 WeakPolarHBondContact O-CB 3.31Å; R219-A222 PolarHBondContact O-N 2.83Å; R219-A222 VanDerWaalsContact O-N 3.14Å; K220-A222 VanDerWaalsContact C-N 3.31Å; K220-A222 PolarHBondContact O-N 3Å; A222-C225 PolarHBondContact O-N 3.46Å; A222-F226 WeakPolarHBondContact O-CB 3.29Å; A222-F226 PolarHBondContact O-N 3.44Å; A222-A234 WeakPolarHBondContact O-CB 3.39Å; A222-C237 HydrophobicContact CB-CB 3.52Å; A222-Y238 HydrophobicContact CB-CD1 3.34Å; A222-Y238 HydrophobicContact CB-CD2 4.24Å; A222-Y238 HydrophobicContact CB-CE1 3.17Å; A222-Y238 HydrophobicContact CB-CE2 4.12Å; A222-Y238 HydrophobicContact CB-CG 3.88Å; A222-Y238 PolarHBondContact O-OH 2.82Å
223	D	94.8	Very high	91	Very high	55 Å²	55	52.3 Å²	52.3	29%	0.294	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-43.6	173.6	-67.4	-41	0	0	0	112.1	R219 K220 F226 L227 Y238	R219-D223 IonicContact CZ-OD1 3.77Å; R219-D223 IonicContact CZ-OD2 3.05Å; R219-D223 IonicContact NH1-OD1 3.08Å; R219-D223 PolarHBondContact NH1-OD1 2.92Å; R219-D223 IonicContact NH1-OD2 2.68Å; R219-D223 PolarHBondContact NH1-OD2 3.43Å; R219-D223 PolarHBondContact O-N 2.89Å; K220-D223 PolarHBondContact O-N 3.42Å; D223-F226 PolarHBondContact O-N 3.27Å; D223-L227 WeakPolarHBondContact O-CG 3.44Å; D223-L227 PolarHBondContact O-N 2.84Å; D223-Y238 WeakPolarHBondContact CA-OH 3.5Å; D223-Y238 PolarHBondContact N-OH 2.83Å; D223-Y238 WeakPolarHBondContact OD1-CE1 3.39Å; D223-Y238 PolarHBondContact OD1-OH 3.47Å
224	L	93.8	Very high	91.4	Very high	25 Å²	25	52 Å²	52	13%	0.131	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-43.7	173	-68.7	173.8	0	0	0	111.9	I159 N162 I163 L166 K220 M221 F226 L227 V228	I159-L224 HydrophobicContact CG2-CB 4.38Å; I159-L224 HydrophobicContact CG2-CD2 4.31Å; N162-L224 HydrophobicContact CB-CD1 3.8Å; I163-L224 HydrophobicContact CD1-CB 4.02Å; I163-L224 HydrophobicContact CG1-CB 3.74Å; I163-L224 HydrophobicContact CG1-CD1 4.22Å; L166-L224 HydrophobicContact CD1-CD1 3.98Å; K220-L224 WeakPolarHBondContact O-CG 3.33Å; K220-L224 PolarHBondContact O-N 3.26Å; M221-L224 PolarHBondContact O-N 2.96Å; L224-F226 VanDerWaalsContact C-N 3.32Å; L224-F226 PolarHBondContact O-N 3.27Å; L224-L227 PolarHBondContact O-N 3.24Å; L224-V228 PolarHBondContact O-N 3.09Å
225	C	93.2	Very high	91.8	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-38.1	175.2	-66.4	0	0	0	0	112.3	M221 A222 V228 Q229 H230 L233 A234	M221-C225 PolarHBondContact O-N 2.88Å; M221-C225 PolarHBondContact O-SG 2.88Å; A222-C225 PolarHBondContact O-N 3.46Å; C225-V228 WeakPolarHBondContact O-CG2 3.46Å; C225-V228 PolarHBondContact O-N 2.83Å; C225-Q229 PolarHBondContact O-N 2.91Å; C225-H230 HydrophobicContact CB-CB 4.36Å; C225-H230 WeakPolarHBondContact O-CA 3.43Å; C225-H230 PolarHBondContact O-N 3.25Å; C225-L233 VanDerWaalsContact SG-CD2 3.59Å; C225-A234 HydrophobicContact CB-CB 4.01Å
226	F	94.5	Very high	92	Very high	45 Å²	45	51.8 Å²	51.8	20%	0.197	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-43.1	177.3	-171.4	-87.4	0	0	0	111.6	A222 D223 L224 V228 Q229 Y231 A234 Y238 M260 V263 S264 L267	A222-F226 WeakPolarHBondContact O-CB 3.29Å; A222-F226 PolarHBondContact O-N 3.44Å; D223-F226 PolarHBondContact O-N 3.27Å; L224-F226 VanDerWaalsContact C-N 3.32Å; L224-F226 PolarHBondContact O-N 3.27Å; F226-V228 VanDerWaalsContact C-N 3.3Å; F226-V228 PolarHBondContact O-N 3.28Å; F226-Q229 PolarHBondContact O-N 3.1Å; F226-Y231 AromaticContact CD2-CD1 3.81Å; F226-Y231 HydrophobicContact CD2-CD1 3.81Å; F226-Y231 HydrophobicContact CD2-CE1 4.04Å; F226-Y231 AromaticContact CE2-CD1 3.92Å; F226-Y231 HydrophobicContact CE2-CD1 3.92Å; F226-Y231 AromaticContact CE2-CE1 3.94Å; F226-Y231 HydrophobicContact CE2-CE1 3.94Å; F226-Y231 HydrophobicContact CG-CD1 4.47Å; F226-Y231 HydrophobicContact CG-CE1 4.43Å; F226-Y231 HydrophobicContact CZ-CE1 4.23Å; F226-A234 HydrophobicContact CB-CB 4.05Å; F226-A234 HydrophobicContact CD2-CB 4.46Å; F226-Y238 HydrophobicContact CB-CE2 4.49Å; F226-Y238 HydrophobicContact CD2-CE2 4.27Å; F226-M260 HydrophobicContact CD1-CE 3.93Å; F226-M260 HydrophobicContact CD2-CE 3.82Å; F226-M260 HydrophobicContact CE1-CE 3.82Å; F226-M260 HydrophobicContact CE2-CE 3.69Å; F226-M260 HydrophobicContact CG-CE 3.94Å; F226-M260 HydrophobicContact CZ-CE 3.7Å; F226-V263 HydrophobicContact CE2-CB 4.48Å; F226-V263 HydrophobicContact CE2-CG1 3.88Å; F226-V263 HydrophobicContact CZ-CG1 3.8Å; F226-S264 WeakPolarHBondContact CD2-OG 3.32Å; F226-L267 HydrophobicContact CE2-CD1 3.86Å; F226-L267 HydrophobicContact CZ-CD1 3.61Å
227	L	92.2	Very high	92.2	Very high	127 Å²	127	50.6 Å²	50.6	67%	0.665	25%	0.247	S	C	*	.	H	α-helix	trans	-60.1	-36.5	176.8	-73.8	168.6	0	0	0	113.1	D223 L224 Q229	D223-L227 WeakPolarHBondContact O-CG 3.44Å; D223-L227 PolarHBondContact O-N 2.84Å; L224-L227 PolarHBondContact O-N 3.24Å; L227-Q229 VanDerWaalsContact C-N 3.27Å; L227-Q229 PolarHBondContact O-N 3.46Å
228	V	90.4	Very high	92.5	Very high	54 Å²	54	49.1 Å²	49.1	33%	0.327	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	18	175.1	-56.4	0	0	0	0	113.4	L156 I159 I163 L224 C225 F226 H230	L156-V228 HydrophobicContact CD2-CG1 4.33Å; I159-V228 HydrophobicContact CD1-CG1 4.42Å; I159-V228 HydrophobicContact CG2-CG1 3.75Å; I163-V228 HydrophobicContact CD1-CG2 4.3Å; L224-V228 PolarHBondContact O-N 3.09Å; C225-V228 WeakPolarHBondContact O-CG2 3.46Å; C225-V228 PolarHBondContact O-N 2.83Å; F226-V228 VanDerWaalsContact C-N 3.3Å; F226-V228 PolarHBondContact O-N 3.28Å; V228-H230 HydrophobicContact CG2-CB 4.19Å; V228-H230 PolarHBondContact O-N 3.15Å; V228-H230 VanDerWaalsContact O-N 3.13Å
229	Q	92	Very high	92.6	Very high	137 Å²	137	52.1 Å²	52.1	64%	0.64	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	17.7	177.2	-48	-171.5	14.4	0	0	115.3	C225 F226 L227 Y231	C225-Q229 PolarHBondContact O-N 2.91Å; F226-Q229 PolarHBondContact O-N 3.1Å; L227-Q229 VanDerWaalsContact C-N 3.27Å; L227-Q229 PolarHBondContact O-N 3.46Å; Q229-Y231 HydrophobicContact CB-CD2 4.49Å; Q229-Y231 HydrophobicContact CB-CE1 4.4Å; Q229-Y231 HydrophobicContact CB-CE2 3.77Å; Q229-Y231 HydrophobicContact CG-CE2 4.44Å; Q229-Y231 WeakPolarHBondContact CG-OH 3.21Å; Q229-Y231 VanDerWaalsContact O-CD2 3.23Å; Q229-Y231 WeakPolarHBondContact O-CD2 3.4Å; Q229-Y231 PolarHBondContact O-N 3Å
230	H	91.1	Very high	92.6	Very high	99 Å²	99	52.5 Å²	52.5	46%	0.458	26%	0.262	S	S	.	.			trans	-82.5	58.3	176	-159.4	-23.2	0	0	0	110.8	C225 V228 E232 L233 A234	C225-H230 HydrophobicContact CB-CB 4.36Å; C225-H230 WeakPolarHBondContact O-CA 3.43Å; C225-H230 PolarHBondContact O-N 3.25Å; V228-H230 HydrophobicContact CG2-CB 4.19Å; V228-H230 PolarHBondContact O-N 3.15Å; V228-H230 VanDerWaalsContact O-N 3.13Å; H230-E232 VanDerWaalsContact C-N 3.27Å; H230-E232 PolarHBondContact O-N 2.87Å; H230-E232 VanDerWaalsContact O-N 3.13Å; H230-L233 PolarHBondContact O-N 2.83Å; H230-L233 VanDerWaalsContact O-N 3.13Å; H230-A234 PolarHBondContact O-N 3.48Å; H230-A234 VanDerWaalsContact O-N 3.14Å
231	Y	93.3	Very high	92.5	Very high	42 Å²	42	46.6 Å²	46.6	17%	0.165	24%	0.236	C	C	.	.	H	α-helix	trans	-59.2	-29.9	-166.8	-56.1	-60.3	0	0	0	114.7	F226 Q229 A234 Y235 L267	F226-Y231 AromaticContact CD2-CD1 3.81Å; F226-Y231 HydrophobicContact CD2-CD1 3.81Å; F226-Y231 HydrophobicContact CD2-CE1 4.04Å; F226-Y231 AromaticContact CE2-CD1 3.92Å; F226-Y231 HydrophobicContact CE2-CD1 3.92Å; F226-Y231 AromaticContact CE2-CE1 3.94Å; F226-Y231 HydrophobicContact CE2-CE1 3.94Å; F226-Y231 HydrophobicContact CG-CD1 4.47Å; F226-Y231 HydrophobicContact CG-CE1 4.43Å; F226-Y231 HydrophobicContact CZ-CE1 4.23Å; Q229-Y231 HydrophobicContact CB-CD2 4.49Å; Q229-Y231 HydrophobicContact CB-CE1 4.4Å; Q229-Y231 HydrophobicContact CB-CE2 3.77Å; Q229-Y231 HydrophobicContact CG-CE2 4.44Å; Q229-Y231 WeakPolarHBondContact CG-OH 3.21Å; Q229-Y231 VanDerWaalsContact O-CD2 3.23Å; Q229-Y231 WeakPolarHBondContact O-CD2 3.4Å; Q229-Y231 PolarHBondContact O-N 3Å; Y231-A234 PolarHBondContact O-N 3.14Å; Y231-Y235 WeakPolarHBondContact O-CB 3.37Å; Y231-Y235 PolarHBondContact O-N 2.86Å; Y231-L267 HydrophobicContact CD1-CB 3.89Å; Y231-L267 HydrophobicContact CD1-CD1 4.22Å; Y231-L267 HydrophobicContact CD2-CB 3.75Å; Y231-L267 VanDerWaalsContact CD2-O 3.24Å; Y231-L267 WeakPolarHBondContact CD2-O 3.5Å; Y231-L267 HydrophobicContact CE1-CB 3.88Å; Y231-L267 HydrophobicContact CE1-CD1 3.65Å; Y231-L267 HydrophobicContact CE1-CG 4.43Å; Y231-L267 HydrophobicContact CE2-CB 3.73Å; Y231-L267 HydrophobicContact CG-CB 3.83Å
232	E	90.9	Very high	92.5	Very high	114 Å²	114	48 Å²	48	53%	0.533	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-44.1	176.8	-175.8	165.4	-159.7	0	0	113.3	H230 S236 Q268	H230-E232 VanDerWaalsContact C-N 3.27Å; H230-E232 PolarHBondContact O-N 2.87Å; H230-E232 VanDerWaalsContact O-N 3.13Å; E232-S236 PolarHBondContact O-N 2.95Å; E232-S236 VanDerWaalsContact O-N 3.12Å; E232-S236 PolarHBondContact O-OG 2.68Å; E232-Q268 HydrophobicContact CB-CG 4.47Å; E232-Q268 VanDerWaalsContact CD-NE2 3.33Å
233	L	90.1	Very high	92.3	Very high	54 Å²	54	55 Å²	55	28%	0.283	27%	0.273	S	S	.	.	H	α-helix	trans	-73.8	-39.3	177.8	-176.5	56.1	0	0	0	110.2	C225 H230 S236 C237	C225-L233 VanDerWaalsContact SG-CD2 3.59Å; H230-L233 PolarHBondContact O-N 2.83Å; H230-L233 VanDerWaalsContact O-N 3.13Å; L233-S236 PolarHBondContact O-N 3.38Å; L233-C237 WeakPolarHBondContact O-CB 3.4Å; L233-C237 PolarHBondContact O-N 3.02Å; L233-C237 PolarHBondContact O-SG 3.35Å
234	A	93.4	Very high	91.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56.8	-50.5	172.5	0	0	0	0	0	111.6	A222 C225 F226 H230 Y231 S236 C237 Y238	A222-A234 WeakPolarHBondContact O-CB 3.39Å; C225-A234 HydrophobicContact CB-CB 4.01Å; F226-A234 HydrophobicContact CB-CB 4.05Å; F226-A234 HydrophobicContact CD2-CB 4.46Å; H230-A234 PolarHBondContact O-N 3.48Å; H230-A234 VanDerWaalsContact O-N 3.14Å; Y231-A234 PolarHBondContact O-N 3.14Å; A234-S236 PolarHBondContact O-N 3.34Å; A234-C237 PolarHBondContact O-N 3.36Å; A234-Y238 HydrophobicContact CB-CD2 4.3Å; A234-Y238 HydrophobicContact CB-CE2 3.89Å; A234-Y238 WeakPolarHBondContact O-CD2 3.4Å; A234-Y238 VanDerWaalsContact O-CG 3.29Å; A234-Y238 PolarHBondContact O-N 2.77Å
235	Y	92.9	Very high	91.8	Very high	27 Å²	27	51.5 Å²	51.5	11%	0.106	25%	0.254	C	S	.	.	H	α-helix	trans	-53.6	-50.8	174.8	170.4	-100.4	0	0	0	112.2	Y231 C237 Y238 H239 A261 A265	Y231-Y235 WeakPolarHBondContact O-CB 3.37Å; Y231-Y235 PolarHBondContact O-N 2.86Å; Y235-C237 VanDerWaalsContact C-N 3.28Å; Y235-C237 PolarHBondContact O-N 3.11Å; Y235-Y238 PolarHBondContact O-N 3.32Å; Y235-H239 WeakPolarHBondContact O-CB 3.49Å; Y235-H239 PolarHBondContact O-N 2.88Å; Y235-A261 HydrophobicContact CD2-CB 4.22Å; Y235-A261 WeakPolarHBondContact CD2-O 3.5Å; Y235-A261 HydrophobicContact CE2-CB 4.41Å; Y235-A265 HydrophobicContact CD2-CB 3.79Å; Y235-A265 HydrophobicContact CE2-CB 3.94Å
236	S	91.2	Very high	91.7	Very high	53 Å²	53	54.1 Å²	54.1	37%	0.371	27%	0.268	S	S	.	.	H	α-helix	trans	-61.5	-39	-176.5	-60.6	0	0	0	0	111.9	E232 L233 A234 T240	E232-S236 PolarHBondContact O-N 2.95Å; E232-S236 VanDerWaalsContact O-N 3.12Å; E232-S236 PolarHBondContact O-OG 2.68Å; L233-S236 PolarHBondContact O-N 3.38Å; A234-S236 PolarHBondContact O-N 3.34Å; S236-T240 PolarHBondContact O-N 2.84Å; S236-T240 VanDerWaalsContact O-N 3.17Å; S236-T240 PolarHBondContact O-OG1 2.87Å
237	C	93	Very high	91.4	Very high	9 Å²	9	56 Å²	56	6%	0.061	29%	0.286	C	S	.	.	H	α-helix	trans	-74.3	-44.1	177.6	-66.1	0	0	0	0	112.2	I218 M221 A222 L233 A234 Y235 H239 T240 A241	I218-C237 HydrophobicContact CG2-CB 3.96Å; I218-C237 WeakPolarHBondContact CG2-O 3.28Å; M221-C237 WeakPolarHBondContact CE-SG 3.43Å; A222-C237 HydrophobicContact CB-CB 3.52Å; L233-C237 WeakPolarHBondContact O-CB 3.4Å; L233-C237 PolarHBondContact O-N 3.02Å; L233-C237 PolarHBondContact O-SG 3.35Å; A234-C237 PolarHBondContact O-N 3.36Å; Y235-C237 VanDerWaalsContact C-N 3.28Å; Y235-C237 PolarHBondContact O-N 3.11Å; C237-H239 PolarHBondContact O-N 2.89Å; C237-T240 WeakPolarHBondContact O-CB 3.44Å; C237-T240 PolarHBondContact O-N 3.49Å; C237-A241 WeakPolarHBondContact O-CB 3.3Å; C237-A241 PolarHBondContact O-N 2.96Å
238	Y	95.3	Very high	91.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.7	-40.9	174.1	-65.3	-44.6	0	0	0	112.6	A222 D223 F226 A234 Y235 T240 A241 K242 M260 S264	A222-Y238 HydrophobicContact CB-CD1 3.34Å; A222-Y238 HydrophobicContact CB-CD2 4.24Å; A222-Y238 HydrophobicContact CB-CE1 3.17Å; A222-Y238 HydrophobicContact CB-CE2 4.12Å; A222-Y238 HydrophobicContact CB-CG 3.88Å; A222-Y238 PolarHBondContact O-OH 2.82Å; D223-Y238 WeakPolarHBondContact CA-OH 3.5Å; D223-Y238 PolarHBondContact N-OH 2.83Å; D223-Y238 WeakPolarHBondContact OD1-CE1 3.39Å; D223-Y238 PolarHBondContact OD1-OH 3.47Å; F226-Y238 HydrophobicContact CB-CE2 4.49Å; F226-Y238 HydrophobicContact CD2-CE2 4.27Å; A234-Y238 HydrophobicContact CB-CD2 4.3Å; A234-Y238 HydrophobicContact CB-CE2 3.89Å; A234-Y238 WeakPolarHBondContact O-CD2 3.4Å; A234-Y238 VanDerWaalsContact O-CG 3.29Å; A234-Y238 PolarHBondContact O-N 2.77Å; Y235-Y238 PolarHBondContact O-N 3.32Å; Y238-T240 VanDerWaalsContact C-N 3.27Å; Y238-T240 PolarHBondContact O-N 2.91Å; Y238-A241 PolarHBondContact O-N 3.04Å; Y238-K242 VanDerWaalsContact O-CB 3.26Å; Y238-K242 WeakPolarHBondContact O-CB 3.47Å; Y238-K242 PolarHBondContact O-N 2.99Å; Y238-M260 HydrophobicContact CD1-CB 4.19Å; Y238-M260 HydrophobicContact CD2-CB 3.76Å; Y238-M260 WeakPolarHBondContact CD2-O 3.33Å; Y238-M260 HydrophobicContact CE1-CB 4.03Å; Y238-M260 HydrophobicContact CE2-CB 3.58Å; Y238-M260 HydrophobicContact CE2-CE 4.34Å; Y238-M260 HydrophobicContact CG-CB 4.06Å; Y238-S264 WeakPolarHBondContact CD2-OG 3.4Å; Y238-S264 VanDerWaalsContact CE2-OG 3.26Å; Y238-S264 WeakPolarHBondContact CE2-OG 3.47Å
239	H	91.9	Very high	91	Very high	77 Å²	77	57.4 Å²	57.4	36%	0.356	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-36.9	175.7	-179.4	73	0	0	0	112	Y235 C237 Y279	Y235-H239 WeakPolarHBondContact O-CB 3.49Å; Y235-H239 PolarHBondContact O-N 2.88Å; C237-H239 PolarHBondContact O-N 2.89Å; H239-Y279 PolarHBondContact CE1-OH 2.86Å; H239-Y279 AromaticContact ND1-CZ 3.95Å; H239-Y279 PolarHBondContact ND1-OH 2.86Å; H239-Y279 VanDerWaalsContact ND1-OH 3.13Å
240	T	91.3	Very high	90.8	Very high	57 Å²	57	51.1 Å²	51.1	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-68.4	-54.7	173.5	-56.5	0	0	0	0	110.9	S236 C237 Y238 K242 K243	S236-T240 PolarHBondContact O-N 2.84Å; S236-T240 VanDerWaalsContact O-N 3.17Å; S236-T240 PolarHBondContact O-OG1 2.87Å; C237-T240 WeakPolarHBondContact O-CB 3.44Å; C237-T240 PolarHBondContact O-N 3.49Å; Y238-T240 VanDerWaalsContact C-N 3.27Å; Y238-T240 PolarHBondContact O-N 2.91Å; T240-K242 VanDerWaalsContact C-N 3.32Å; T240-K242 PolarHBondContact O-N 3.24Å; T240-K243 WeakPolarHBondContact O-CB 3.25Å; T240-K243 PolarHBondContact O-N 2.96Å
241	A	91.3	Very high	90.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.4	-40.9	-178.1	0	0	0	0	0	112.6	I218 C237 Y238 K243 D244 F245	I218-A241 HydrophobicContact CG2-CB 4.05Å; C237-A241 WeakPolarHBondContact O-CB 3.3Å; C237-A241 PolarHBondContact O-N 2.96Å; Y238-A241 PolarHBondContact O-N 3.04Å; A241-K243 VanDerWaalsContact C-N 3.27Å; A241-K243 PolarHBondContact O-N 2.78Å; A241-D244 PolarHBondContact O-N 2.62Å; A241-F245 HydrophobicContact CB-CD2 4.27Å; A241-F245 HydrophobicContact CB-CE2 3.73Å; A241-F245 HydrophobicContact CB-CZ 4.33Å; A241-F245 WeakPolarHBondContact O-CD2 3.34Å; A241-F245 WeakPolarHBondContact O-CG 3.16Å; A241-F245 PolarHBondContact O-N 3.46Å
242	K	92.4	Very high	90.7	Very high	31 Å²	31	49 Å²	49	14%	0.135	25%	0.253	C	S	.	.	H	α-helix	trans	-48.2	-47.4	171.5	167.1	-166.7	167.5	-179.3	0	112.2	Y238 T240 D244 F245 L246 A257 L258	Y238-K242 VanDerWaalsContact O-CB 3.26Å; Y238-K242 WeakPolarHBondContact O-CB 3.47Å; Y238-K242 PolarHBondContact O-N 2.99Å; T240-K242 VanDerWaalsContact C-N 3.32Å; T240-K242 PolarHBondContact O-N 3.24Å; K242-D244 VanDerWaalsContact C-N 3.29Å; K242-D244 PolarHBondContact O-N 3.16Å; K242-F245 PolarHBondContact O-N 2.59Å; K242-L246 HydrophobicContact CD-CD1 4.46Å; K242-L246 HydrophobicContact CG-CD1 3.88Å; K242-L246 HydrophobicContact CG-CG 4.47Å; K242-L246 WeakPolarHBondContact O-CB 3.39Å; K242-L246 VanDerWaalsContact O-CG 3.31Å; K242-L246 WeakPolarHBondContact O-CG 3.37Å; K242-L246 PolarHBondContact O-N 3.08Å; K242-A257 HydrophobicContact CB-CB 3.91Å; K242-L258 HydrophobicContact CD-CD2 3.61Å; K242-L258 HydrophobicContact CD-CG 3.75Å; K242-L258 HydrophobicContact CG-CD2 4.42Å; K242-L258 HydrophobicContact CG-CG 4.03Å; K242-L258 VanDerWaalsContact NZ-CD2 3.28Å
243	K	89.3	Confident	90.7	Very high	149 Å²	149	47.2 Å²	47.2	65%	0.648	24%	0.242	S	C	*	.	H	α-helix	trans	-63.1	-40.6	-174.6	-177.9	-179.6	175.1	179.6	0	110.9	T240 A241 L246 S247	T240-K243 WeakPolarHBondContact O-CB 3.25Å; T240-K243 PolarHBondContact O-N 2.96Å; A241-K243 VanDerWaalsContact C-N 3.27Å; A241-K243 PolarHBondContact O-N 2.78Å; K243-L246 PolarHBondContact O-N 3.47Å; K243-S247 PolarHBondContact O-N 3.18Å; K243-S247 VanDerWaalsContact O-N 3.1Å; K243-S247 PolarHBondContact O-OG 3.42Å
244	D	87.4	Confident	90.9	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.032	23%	0.229	C	C	.	.	H	α-helix	trans	-74.6	-42.4	-178.3	-58.6	-29.6	0	0	0	110.8	R178 E215 A241 K242 L246 S247 D248	R178-D244 IonicContact CZ-OD1 2.87Å; R178-D244 IonicContact CZ-OD2 3.77Å; R178-D244 IonicContact NH1-OD1 2.96Å; R178-D244 PolarHBondContact NH1-OD1 2.97Å; R178-D244 IonicContact NH1-OD2 3.24Å; R178-D244 IonicContact NH2-OD1 3.97Å; R178-D244 PolarHBondContact NH2-OD1 2.84Å; R178-D244 VanDerWaalsContact NH2-OD1 3.11Å; R178-D244 IonicContact NH2-OD2 2.7Å; R178-D244 PolarHBondContact NH2-OD2 2.9Å; E215-D244 HydrophobicContact CG-CB 3.69Å; A241-D244 PolarHBondContact O-N 2.62Å; K242-D244 VanDerWaalsContact C-N 3.29Å; K242-D244 PolarHBondContact O-N 3.16Å; D244-L246 VanDerWaalsContact C-N 3.27Å; D244-L246 PolarHBondContact O-N 3Å; D244-S247 WeakPolarHBondContact CA-OG 3.3Å; D244-S247 PolarHBondContact O-N 3.2Å; D244-S247 PolarHBondContact O-OG 3.42Å; D244-D248 PolarHBondContact O-N 3.03Å; D244-D248 VanDerWaalsContact O-N 3.08Å
245	F	91.7	Very high	91	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-35.4	171.3	-62	-43.9	0	0	0	113	Y209 E215 L216 R219 A241 K242 Q249 A250 Y253 A254 A257	Y209-F245 HydrophobicContact CD2-CD1 4.46Å; Y209-F245 HydrophobicContact CD2-CE1 4.18Å; Y209-F245 AromaticContact CE2-CD1 3.57Å; Y209-F245 HydrophobicContact CE2-CD1 3.57Å; Y209-F245 AromaticContact CE2-CE1 3.71Å; Y209-F245 HydrophobicContact CE2-CE1 3.71Å; Y209-F245 AromaticContact CZ-CD1 3.67Å; Y209-F245 AromaticContact CZ-CE1 3.93Å; E215-F245 HydrophobicContact CB-CD1 4.11Å; E215-F245 HydrophobicContact CB-CE1 3.48Å; E215-F245 VanDerWaalsContact CB-CE1 3.48Å; E215-F245 HydrophobicContact CB-CZ 3.97Å; E215-F245 HydrophobicContact CG-CE1 4.47Å; L216-F245 HydrophobicContact CD2-CE1 4.33Å; L216-F245 HydrophobicContact CD2-CZ 4.15Å; R219-F245 HydrophobicContact CB-CZ 4.37Å; A241-F245 HydrophobicContact CB-CD2 4.27Å; A241-F245 HydrophobicContact CB-CE2 3.73Å; A241-F245 HydrophobicContact CB-CZ 4.33Å; A241-F245 WeakPolarHBondContact O-CD2 3.34Å; A241-F245 WeakPolarHBondContact O-CG 3.16Å; A241-F245 PolarHBondContact O-N 3.46Å; K242-F245 PolarHBondContact O-N 2.59Å; F245-Q249 PolarHBondContact O-N 2.9Å; F245-A250 HydrophobicContact CB-CB 4.31Å; F245-A250 HydrophobicContact CD1-CB 4.44Å; F245-A250 PolarHBondContact O-N 2.61Å; F245-Y253 HydrophobicContact CD1-CG 4.39Å; F245-Y253 WeakPolarHBondContact CD2-O 3.2Å; F245-Y253 HydrophobicContact CE1-CG 4.28Å; F245-A254 HydrophobicContact CB-CB 3.78Å; F245-A257 HydrophobicContact CD2-CB 3.9Å; F245-A257 HydrophobicContact CE2-CB 4.06Å
246	L	89.4	Confident	91	Very high	56 Å²	56	43.6 Å²	43.6	29%	0.293	23%	0.227	S	C	.	.	H	α-helix	trans	-71.1	-38	175.5	-75.5	172.1	0	0	0	112.7	K242 K243 D244 D248 Q249 M251 A254	K242-L246 HydrophobicContact CD-CD1 4.46Å; K242-L246 HydrophobicContact CG-CD1 3.88Å; K242-L246 HydrophobicContact CG-CG 4.47Å; K242-L246 WeakPolarHBondContact O-CB 3.39Å; K242-L246 VanDerWaalsContact O-CG 3.31Å; K242-L246 WeakPolarHBondContact O-CG 3.37Å; K242-L246 PolarHBondContact O-N 3.08Å; K243-L246 PolarHBondContact O-N 3.47Å; D244-L246 VanDerWaalsContact C-N 3.27Å; D244-L246 PolarHBondContact O-N 3Å; L246-D248 VanDerWaalsContact C-N 3.26Å; L246-D248 PolarHBondContact O-N 2.76Å; L246-Q249 PolarHBondContact O-N 2.72Å; L246-Q249 PolarHBondContact O-NE2 3.2Å; L246-M251 HydrophobicContact CD2-CE 4.36Å; L246-M251 HydrophobicContact CD2-SD 4.28Å; L246-A254 HydrophobicContact CD2-CB 3.73Å; L246-A254 HydrophobicContact CG-CB 3.89Å
247	S	88.3	Confident	91.2	Very high	83 Å²	83	41.1 Å²	41.1	58%	0.58	21%	0.209	S	C	*	.	H	α-helix	trans	-65.2	-33.2	174.8	51.1	0	0	0	0	112.3	K243 D244 Q249	K243-S247 PolarHBondContact O-N 3.18Å; K243-S247 VanDerWaalsContact O-N 3.1Å; K243-S247 PolarHBondContact O-OG 3.42Å; D244-S247 WeakPolarHBondContact CA-OG 3.3Å; D244-S247 PolarHBondContact O-N 3.2Å; D244-S247 PolarHBondContact O-OG 3.42Å; S247-Q249 VanDerWaalsContact C-N 3.29Å; S247-Q249 PolarHBondContact O-N 2.98Å
248	D	86.5	Confident	91.4	Very high	72 Å²	72	40.7 Å²	40.7	39%	0.385	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-1.8	-179	-64.4	-5.1	0	0	0	113.4	L207 Y209 D244 L246 A250	L207-D248 HydrophobicContact CD2-CB 4.1Å; Y209-D248 WeakPolarHBondContact OH-CB 3.38Å; Y209-D248 PolarHBondContact OH-OD2 3.49Å; D244-D248 PolarHBondContact O-N 3.03Å; D244-D248 VanDerWaalsContact O-N 3.08Å; L246-D248 VanDerWaalsContact C-N 3.26Å; L246-D248 PolarHBondContact O-N 2.76Å; D248-A250 HydrophobicContact CB-CB 4.4Å; D248-A250 PolarHBondContact O-N 2.76Å
249	Q	87.5	Confident	91.4	Very high	139 Å²	139	40.9 Å²	40.9	65%	0.65	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	27.6	-172.5	-58.1	-68.6	-76.2	0	0	113.3	F245 L246 S247 M251	F245-Q249 PolarHBondContact O-N 2.9Å; L246-Q249 PolarHBondContact O-N 2.72Å; L246-Q249 PolarHBondContact O-NE2 3.2Å; S247-Q249 VanDerWaalsContact C-N 3.29Å; S247-Q249 PolarHBondContact O-N 2.98Å; Q249-M251 PolarHBondContact O-N 2.95Å
250	A	89.3	Confident	91.5	Very high	5 Å²	5	38.7 Å²	38.7	4%	0.041	20%	0.198	C	C	.	.			trans	-82.6	62	178.7	0	0	0	0	0	111.2	L207 Y209 F245 D248 L252 Y253 A254	L207-A250 HydrophobicContact CD2-CB 3.86Å; Y209-A250 HydrophobicContact CE2-CB 3.58Å; F245-A250 HydrophobicContact CB-CB 4.31Å; F245-A250 HydrophobicContact CD1-CB 4.44Å; F245-A250 PolarHBondContact O-N 2.61Å; D248-A250 HydrophobicContact CB-CB 4.4Å; D248-A250 PolarHBondContact O-N 2.76Å; A250-L252 VanDerWaalsContact C-N 3.29Å; A250-L252 PolarHBondContact O-N 3.01Å; A250-L252 VanDerWaalsContact O-N 3.11Å; A250-Y253 HydrophobicContact CB-CD2 4.12Å; A250-Y253 PolarHBondContact O-N 3.03Å; A250-A254 PolarHBondContact O-N 2.73Å
251	M	90.6	Very high	91.7	Very high	31 Å²	31	36 Å²	36	15%	0.153	18%	0.181	C	C	.	.	H	α-helix	trans	-58.3	-33.2	-161.3	-61.3	-56.8	-70.1	0	0	114.7	T204 L246 Q249 A254 A255 T286 V290	T204-M251 HydrophobicContact CG2-CB 4.4Å; L246-M251 HydrophobicContact CD2-CE 4.36Å; L246-M251 HydrophobicContact CD2-SD 4.28Å; Q249-M251 PolarHBondContact O-N 2.95Å; M251-A254 PolarHBondContact O-N 2.91Å; M251-A255 WeakPolarHBondContact O-CB 3.48Å; M251-A255 PolarHBondContact O-N 3.04Å; M251-T286 HydrophobicContact CB-CG2 3.84Å; M251-T286 HydrophobicContact CE-CG2 3.78Å; M251-T286 WeakPolarHBondContact O-CG2 3.48Å; M251-V290 HydrophobicContact CB-CG1 4.03Å; M251-V290 HydrophobicContact CG-CG1 3.89Å
252	L	91.6	Very high	91.8	Very high	65 Å²	65	36 Å²	36	34%	0.34	18%	0.181	S	C	.	.	H	α-helix	trans	-66	-44.4	176	-171.9	70	0	0	0	112.4	A250 G256 Y287 C291 L296	A250-L252 VanDerWaalsContact C-N 3.29Å; A250-L252 PolarHBondContact O-N 3.01Å; A250-L252 VanDerWaalsContact O-N 3.11Å; L252-G256 PolarHBondContact O-N 2.97Å; L252-G256 VanDerWaalsContact O-N 3.13Å; L252-Y287 HydrophobicContact CD1-CD1 4.04Å; L252-Y287 HydrophobicContact CD1-CE1 3.87Å; L252-C291 HydrophobicContact CD1-CB 4.22Å; L252-L296 HydrophobicContact CD1-CD1 3.84Å
253	Y	91.3	Very high	91.9	Very high	77 Å²	77	35.1 Å²	35.1	30%	0.302	18%	0.178	S	C	.	.	H	α-helix	trans	-69.2	-38.7	176	-64.1	-83.3	0	0	0	111.3	L207 Y209 L216 F245 A250 G256 A257	L207-Y253 WeakPolarHBondContact O-CE2 3.18Å; Y209-Y253 AromaticContact CD2-CD2 3.91Å; Y209-Y253 HydrophobicContact CD2-CD2 3.91Å; Y209-Y253 AromaticContact CD2-CE2 3.82Å; Y209-Y253 HydrophobicContact CD2-CE2 3.82Å; Y209-Y253 HydrophobicContact CD2-CG 4.3Å; Y209-Y253 AromaticContact CE2-CD2 3.97Å; Y209-Y253 HydrophobicContact CE2-CD2 3.97Å; Y209-Y253 HydrophobicContact CE2-CE2 4.3Å; Y209-Y253 HydrophobicContact CE2-CG 4.33Å; L216-Y253 HydrophobicContact CD2-CD1 3.97Å; L216-Y253 HydrophobicContact CD2-CE1 3.85Å; F245-Y253 HydrophobicContact CD1-CG 4.39Å; F245-Y253 WeakPolarHBondContact CD2-O 3.2Å; F245-Y253 HydrophobicContact CE1-CG 4.28Å; A250-Y253 HydrophobicContact CB-CD2 4.12Å; A250-Y253 PolarHBondContact O-N 3.03Å; Y253-G256 PolarHBondContact O-N 2.91Å; Y253-A257 WeakPolarHBondContact O-CB 3.1Å; Y253-A257 PolarHBondContact O-N 3.35Å
254	A	93.2	Very high	92.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-44.1	174.4	0	0	0	0	0	112.3	F245 L246 A250 M251 A257 L258	F245-A254 HydrophobicContact CB-CB 3.78Å; L246-A254 HydrophobicContact CD2-CB 3.73Å; L246-A254 HydrophobicContact CG-CB 3.89Å; A250-A254 PolarHBondContact O-N 2.73Å; M251-A254 PolarHBondContact O-N 2.91Å; A254-A257 PolarHBondContact O-N 2.89Å; A254-L258 WeakPolarHBondContact O-CB 3.35Å; A254-L258 WeakPolarHBondContact O-CG 3.29Å; A254-L258 PolarHBondContact O-N 3.26Å
255	A	94.9	Very high	92.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.3	-44	176	0	0	0	0	0	112.1	M251 A257 L258 E259 A283 T286 Y287	M251-A255 WeakPolarHBondContact O-CB 3.48Å; M251-A255 PolarHBondContact O-N 3.04Å; A255-A257 PolarHBondContact O-N 3.14Å; A255-L258 WeakPolarHBondContact O-CB 3.45Å; A255-L258 PolarHBondContact O-N 3.46Å; A255-E259 WeakPolarHBondContact O-CB 3.44Å; A255-E259 PolarHBondContact O-N 2.79Å; A255-A283 HydrophobicContact CB-CB 4.42Å; A255-T286 HydrophobicContact CB-CG2 3.9Å; A255-Y287 HydrophobicContact CB-CD1 3.84Å; A255-Y287 HydrophobicContact CB-CD2 4.18Å; A255-Y287 HydrophobicContact CB-CE1 3.55Å; A255-Y287 HydrophobicContact CB-CE2 3.92Å; A255-Y287 HydrophobicContact CB-CG 4.14Å
256	G	94.7	Very high	92.3	Very high	6 Å²	6	31.2 Å²	31.2	6%	0.062	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-34.4	176.5	0	0	0	0	0	113.8	R219 L252 Y253 M260 Y287	R219-G256 PolarHBondContact NH2-O 3.36Å; L252-G256 PolarHBondContact O-N 2.97Å; L252-G256 VanDerWaalsContact O-N 3.13Å; Y253-G256 PolarHBondContact O-N 2.91Å; G256-M260 WeakPolarHBondContact O-CB 3.36Å; G256-M260 WeakPolarHBondContact O-CG 3.38Å; G256-M260 PolarHBondContact O-N 3.44Å; G256-M260 VanDerWaalsContact O-N 3.09Å; G256-Y287 WeakPolarHBondContact CA-OH 3.21Å; G256-Y287 PolarHBondContact N-OH 3.37Å
257	A	95.3	Very high	92.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-73.7	-36.7	174	0	0	0	0	0	112.5	K242 F245 Y253 A254 A255 A261	K242-A257 HydrophobicContact CB-CB 3.91Å; F245-A257 HydrophobicContact CD2-CB 3.9Å; F245-A257 HydrophobicContact CE2-CB 4.06Å; Y253-A257 WeakPolarHBondContact O-CB 3.1Å; Y253-A257 PolarHBondContact O-N 3.35Å; A254-A257 PolarHBondContact O-N 2.89Å; A255-A257 PolarHBondContact O-N 3.14Å; A257-A261 WeakPolarHBondContact O-CB 3.35Å; A257-A261 PolarHBondContact O-N 2.96Å
258	L	95.4	Very high	92.3	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-57.8	-51.9	170.4	-90.6	160.6	0	0	0	111.4	K242 A254 A255 A261 A262 Y279 T282 A283	K242-L258 HydrophobicContact CD-CD2 3.61Å; K242-L258 HydrophobicContact CD-CG 3.75Å; K242-L258 HydrophobicContact CG-CD2 4.42Å; K242-L258 HydrophobicContact CG-CG 4.03Å; K242-L258 VanDerWaalsContact NZ-CD2 3.28Å; A254-L258 WeakPolarHBondContact O-CB 3.35Å; A254-L258 WeakPolarHBondContact O-CG 3.29Å; A254-L258 PolarHBondContact O-N 3.26Å; A255-L258 WeakPolarHBondContact O-CB 3.45Å; A255-L258 PolarHBondContact O-N 3.46Å; L258-A261 PolarHBondContact O-N 3.5Å; L258-A262 PolarHBondContact O-N 2.82Å; L258-Y279 HydrophobicContact CD2-CD1 3.75Å; L258-Y279 HydrophobicContact CD2-CD2 4.24Å; L258-Y279 HydrophobicContact CD2-CE1 4.5Å; L258-Y279 HydrophobicContact CD2-CG 3.62Å; L258-T282 HydrophobicContact CD1-CG2 3.77Å; L258-A283 HydrophobicContact CB-CB 3.97Å
259	E	95.6	Very high	91.4	Very high	3 Å²	3	29.8 Å²	29.8	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-58	-56.7	179.8	180	-174.4	174.5	0	0	110.8	A255 A261 A262 V263 M280 A283 Y287 R299	A255-E259 WeakPolarHBondContact O-CB 3.44Å; A255-E259 PolarHBondContact O-N 2.79Å; E259-A261 VanDerWaalsContact C-N 3.31Å; E259-A261 PolarHBondContact O-N 2.77Å; E259-A262 WeakPolarHBondContact O-CA 3.36Å; E259-A262 WeakPolarHBondContact O-CB 3.45Å; E259-A262 PolarHBondContact O-N 3.25Å; E259-V263 WeakPolarHBondContact O-CG2 3.09Å; E259-V263 PolarHBondContact O-N 2.92Å; E259-M280 HydrophobicContact CB-SD 4.15Å; E259-M280 HydrophobicContact CG-CE 3.98Å; E259-M280 HydrophobicContact CG-SD 3.81Å; E259-A283 HydrophobicContact CB-CB 4.36Å; E259-Y287 PolarHBondContact OE2-OH 3.48Å; E259-R299 VanDerWaalsContact CD-NH2 3.3Å; E259-R299 IonicContact OE1-CZ 3.52Å; E259-R299 VanDerWaalsContact OE1-CZ 3.26Å; E259-R299 IonicContact OE1-NH1 2.65Å; E259-R299 PolarHBondContact OE1-NH1 2.82Å; E259-R299 IonicContact OE1-NH2 3.28Å; E259-R299 PolarHBondContact OE1-NH2 2.94Å; E259-R299 IonicContact OE2-CZ 3.17Å; E259-R299 IonicContact OE2-NH1 3.52Å; E259-R299 IonicContact OE2-NH2 2.67Å; E259-R299 PolarHBondContact OE2-NH2 2.86Å
260	M	95.4	Very high	90.4	Very high	32 Å²	32	27.4 Å²	27.4	16%	0.158	18%	0.178	C	C	.	.	H	α-helix	trans	-68.5	-27.7	-176.5	-68.3	-59	-61.7	0	0	113.2	F226 Y238 G256 S264	F226-M260 HydrophobicContact CD1-CE 3.93Å; F226-M260 HydrophobicContact CD2-CE 3.82Å; F226-M260 HydrophobicContact CE1-CE 3.82Å; F226-M260 HydrophobicContact CE2-CE 3.69Å; F226-M260 HydrophobicContact CG-CE 3.94Å; F226-M260 HydrophobicContact CZ-CE 3.7Å; Y238-M260 HydrophobicContact CD1-CB 4.19Å; Y238-M260 HydrophobicContact CD2-CB 3.76Å; Y238-M260 WeakPolarHBondContact CD2-O 3.33Å; Y238-M260 HydrophobicContact CE1-CB 4.03Å; Y238-M260 HydrophobicContact CE2-CB 3.58Å; Y238-M260 HydrophobicContact CE2-CE 4.34Å; Y238-M260 HydrophobicContact CG-CB 4.06Å; G256-M260 WeakPolarHBondContact O-CB 3.36Å; G256-M260 WeakPolarHBondContact O-CG 3.38Å; G256-M260 PolarHBondContact O-N 3.44Å; G256-M260 VanDerWaalsContact O-N 3.09Å; M260-S264 VanDerWaalsContact O-CB 3.3Å; M260-S264 WeakPolarHBondContact O-CB 3.24Å; M260-S264 PolarHBondContact O-N 3.03Å; M260-S264 PolarHBondContact O-OG 3.35Å
261	A	94.2	Very high	89	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.7	-44.9	166.7	0	0	0	0	0	111.4	Y235 A257 L258 E259 S264 A265 Y279	Y235-A261 HydrophobicContact CD2-CB 4.22Å; Y235-A261 WeakPolarHBondContact CD2-O 3.5Å; Y235-A261 HydrophobicContact CE2-CB 4.41Å; A257-A261 WeakPolarHBondContact O-CB 3.35Å; A257-A261 PolarHBondContact O-N 2.96Å; L258-A261 PolarHBondContact O-N 3.5Å; E259-A261 VanDerWaalsContact C-N 3.31Å; E259-A261 PolarHBondContact O-N 2.77Å; A261-S264 PolarHBondContact O-N 2.78Å; A261-A265 WeakPolarHBondContact O-CB 3.47Å; A261-A265 PolarHBondContact O-N 3.05Å; A261-Y279 HydrophobicContact CB-CD2 4.18Å; A261-Y279 HydrophobicContact CB-CE2 4.39Å
262	A	93.9	Very high	87.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65	-40.9	178.5	0	0	0	0	0	112.5	L258 E259 F266 Y275 P276 M280	L258-A262 PolarHBondContact O-N 2.82Å; E259-A262 WeakPolarHBondContact O-CA 3.36Å; E259-A262 WeakPolarHBondContact O-CB 3.45Å; E259-A262 PolarHBondContact O-N 3.25Å; A262-F266 PolarHBondContact O-N 2.79Å; A262-F266 VanDerWaalsContact O-N 3.16Å; A262-Y275 HydrophobicContact CB-CE2 4.1Å; A262-P276 HydrophobicContact CB-CG 4.01Å; A262-M280 HydrophobicContact CB-CE 4.17Å; A262-M280 HydrophobicContact CB-CG 3.77Å; A262-M280 HydrophobicContact CB-SD 3.89Å
263	V	93.7	Very high	86.1	Confident	12 Å²	12	37.9 Å²	37.9	7%	0.073	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-45.8	174.8	-178.4	0	0	0	0	111.5	F226 E259 A265 F266 L267 M280 L303 I307	F226-V263 HydrophobicContact CE2-CB 4.48Å; F226-V263 HydrophobicContact CE2-CG1 3.88Å; F226-V263 HydrophobicContact CZ-CG1 3.8Å; E259-V263 WeakPolarHBondContact O-CG2 3.09Å; E259-V263 PolarHBondContact O-N 2.92Å; V263-A265 VanDerWaalsContact C-N 3.35Å; V263-A265 PolarHBondContact O-N 2.93Å; V263-F266 WeakPolarHBondContact O-CB 3.4Å; V263-F266 PolarHBondContact O-N 2.7Å; V263-F266 VanDerWaalsContact O-N 3.12Å; V263-L267 HydrophobicContact CG1-CD1 3.83Å; V263-L267 HydrophobicContact CG1-CG 4.27Å; V263-L267 WeakPolarHBondContact O-CG 3.14Å; V263-L267 PolarHBondContact O-N 3.1Å; V263-M280 HydrophobicContact CG2-CE 3.51Å; V263-L303 HydrophobicContact CG2-CD2 3.71Å; V263-L303 HydrophobicContact CG2-CG 4.42Å; V263-I307 HydrophobicContact CG2-CD1 4.42Å
264	S	93.5	Very high	85.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-42.3	178.8	-57.8	0	0	0	0	112	F226 Y238 M260 A261 F266 L267 Q268	F226-S264 WeakPolarHBondContact CD2-OG 3.32Å; Y238-S264 WeakPolarHBondContact CD2-OG 3.4Å; Y238-S264 VanDerWaalsContact CE2-OG 3.26Å; Y238-S264 WeakPolarHBondContact CE2-OG 3.47Å; M260-S264 VanDerWaalsContact O-CB 3.3Å; M260-S264 WeakPolarHBondContact O-CB 3.24Å; M260-S264 PolarHBondContact O-N 3.03Å; M260-S264 PolarHBondContact O-OG 3.35Å; A261-S264 PolarHBondContact O-N 2.78Å; S264-F266 VanDerWaalsContact C-N 3.26Å; S264-F266 PolarHBondContact O-N 2.75Å; S264-L267 PolarHBondContact O-N 3.48Å; S264-Q268 PolarHBondContact O-N 3.32Å; S264-Q268 VanDerWaalsContact O-N 3.16Å
265	A	91.5	Very high	85.2	Confident	8 Å²	8	40.5 Å²	40.5	7%	0.066	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-30.8	175.9	0	0	0	0	0	112.8	Y235 A261 V263 P276	Y235-A265 HydrophobicContact CD2-CB 3.79Å; Y235-A265 HydrophobicContact CE2-CB 3.94Å; A261-A265 WeakPolarHBondContact O-CB 3.47Å; A261-A265 PolarHBondContact O-N 3.05Å; V263-A265 VanDerWaalsContact C-N 3.35Å; V263-A265 PolarHBondContact O-N 2.93Å; A265-P276 HydrophobicContact CB-CG 4.23Å
266	F	91.5	Very high	85	Confident	65 Å²	65	41.2 Å²	41.2	29%	0.285	27%	0.266	S	S	.	.	H	α-helix	trans	-75.7	-41.9	175.7	168.9	-105.9	0	0	0	112.8	A262 V263 S264 Q268 Y275 I307 S310 Q311	A262-F266 PolarHBondContact O-N 2.79Å; A262-F266 VanDerWaalsContact O-N 3.16Å; V263-F266 WeakPolarHBondContact O-CB 3.4Å; V263-F266 PolarHBondContact O-N 2.7Å; V263-F266 VanDerWaalsContact O-N 3.12Å; S264-F266 VanDerWaalsContact C-N 3.26Å; S264-F266 PolarHBondContact O-N 2.75Å; F266-Q268 VanDerWaalsContact C-N 3.28Å; F266-Q268 PolarHBondContact O-N 3.19Å; F266-Y275 HydrophobicContact CB-CD2 4Å; F266-I307 HydrophobicContact CB-CG2 4.38Å; F266-I307 HydrophobicContact CD1-CD1 4.18Å; F266-I307 HydrophobicContact CD1-CG1 3.86Å; F266-I307 HydrophobicContact CD1-CG2 4.19Å; F266-I307 HydrophobicContact CD2-CG2 3.58Å; F266-I307 HydrophobicContact CE1-CG1 3.96Å; F266-I307 HydrophobicContact CE1-CG2 4.4Å; F266-I307 HydrophobicContact CE2-CG2 3.83Å; F266-I307 HydrophobicContact CG-CD1 4.46Å; F266-I307 HydrophobicContact CG-CG1 4.27Å; F266-I307 HydrophobicContact CG-CG2 3.77Å; F266-I307 HydrophobicContact CZ-CG1 4.45Å; F266-I307 HydrophobicContact CZ-CG2 4.23Å; F266-S310 WeakPolarHBondContact CE2-OG 3.38Å; F266-S310 VanDerWaalsContact CZ-OG 3.26Å; F266-S310 WeakPolarHBondContact CZ-OG 3.16Å; F266-Q311 HydrophobicContact CE2-CG 4.25Å
267	L	91.5	Very high	84.8	Confident	64 Å²	64	42.6 Å²	42.6	34%	0.335	28%	0.275	S	S	.	.	H	α-helix	trans	-76.5	-12.3	-178.4	-66.1	177.2	0	0	0	113.9	F226 Y231 V263 S264 G269	F226-L267 HydrophobicContact CE2-CD1 3.86Å; F226-L267 HydrophobicContact CZ-CD1 3.61Å; Y231-L267 HydrophobicContact CD1-CB 3.89Å; Y231-L267 HydrophobicContact CD1-CD1 4.22Å; Y231-L267 HydrophobicContact CD2-CB 3.75Å; Y231-L267 VanDerWaalsContact CD2-O 3.24Å; Y231-L267 WeakPolarHBondContact CD2-O 3.5Å; Y231-L267 HydrophobicContact CE1-CB 3.88Å; Y231-L267 HydrophobicContact CE1-CD1 3.65Å; Y231-L267 HydrophobicContact CE1-CG 4.43Å; Y231-L267 HydrophobicContact CE2-CB 3.73Å; Y231-L267 HydrophobicContact CG-CB 3.83Å; V263-L267 HydrophobicContact CG1-CD1 3.83Å; V263-L267 HydrophobicContact CG1-CG 4.27Å; V263-L267 WeakPolarHBondContact O-CG 3.14Å; V263-L267 PolarHBondContact O-N 3.1Å; S264-L267 PolarHBondContact O-N 3.48Å; L267-G269 VanDerWaalsContact C-N 3.25Å; L267-G269 PolarHBondContact O-N 2.84Å
268	Q	87.4	Confident	84.7	Confident	40 Å²	40	47.6 Å²	47.6	19%	0.187	30%	0.298	C	S	.	.	S	Bend	trans	-69.7	79.2	172.4	-165.7	-176.4	-5	0	0	110.5	E232 S264 F266 G270 A271	E232-Q268 HydrophobicContact CB-CG 4.47Å; E232-Q268 VanDerWaalsContact CD-NE2 3.33Å; S264-Q268 PolarHBondContact O-N 3.32Å; S264-Q268 VanDerWaalsContact O-N 3.16Å; F266-Q268 VanDerWaalsContact C-N 3.28Å; F266-Q268 PolarHBondContact O-N 3.19Å; Q268-G270 PolarHBondContact O-N 3.05Å; Q268-A271 HydrophobicContact CB-CB 4.11Å; Q268-A271 HydrophobicContact CG-CB 3.96Å; Q268-A271 WeakPolarHBondContact O-CB 3.32Å; Q268-A271 PolarHBondContact O-N 3.07Å; Q268-A271 VanDerWaalsContact O-N 3.13Å
269	G	67.5	Low	84.7	Confident	77 Å²	77	48.8 Å²	48.8	79%	0.794	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	131.9	-178.3	0	0	0	0	0	112.9	L267 A271	L267-G269 VanDerWaalsContact C-N 3.25Å; L267-G269 PolarHBondContact O-N 2.84Å; G269-A271 VanDerWaalsContact C-N 3.34Å
270	G	67.4	Low	84.6	Confident	90 Å²	90	48.6 Å²	48.6	93%	0.928	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	7.3	-178.3	0	0	0	0	0	115.8	Q268	Q268-G270 PolarHBondContact O-N 3.05Å
271	A	59.5	Low	84.6	Confident	36 Å²	36	50 Å²	50	30%	0.298	31%	0.31	S	S	.	.			trans	-66.2	144.4	-177.4	0	0	0	0	0	114.7	Q268 G269 R273	Q268-A271 HydrophobicContact CB-CB 4.11Å; Q268-A271 HydrophobicContact CG-CB 3.96Å; Q268-A271 WeakPolarHBondContact O-CB 3.32Å; Q268-A271 PolarHBondContact O-N 3.07Å; Q268-A271 VanDerWaalsContact O-N 3.13Å; G269-A271 VanDerWaalsContact C-N 3.34Å; A271-R273 PolarHBondContact O-N 3.3Å
272	S	57.1	Low	84.6	Confident	128 Å²	128	52.8 Å²	52.8	90%	0.895	33%	0.327	S	S	*	.	S	Bend	trans	-69.4	-9.1	171	173.7	0	0	0	0	114.2
273	R	64.6	Low	84.7	Confident	157 Å²	157	52.8 Å²	52.8	59%	0.592	33%	0.327	S	S	*	.	S	Bend	trans	-102.8	124.8	-173.6	-65	-175	-176.3	-138.7	-0.4	110.2	A271	A271-R273 PolarHBondContact O-N 3.3Å
274	P	78.2	Confident	84.9	Confident	112 Å²	112	52.6 Å²	52.6	73%	0.727	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-67.1	149.6	175	29	-34.5	0	0	0	110.9	P276	P274-P276 WeakPolarHBondContact O-CD 3.09Å
275	Y	87.3	Confident	85	Confident	19 Å²	19	58 Å²	58	8%	0.075	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-50.3	120.4	172	163.7	-117.3	0	0	0	110.8	A262 F266 S277 M280 S304 I307 L308	A262-Y275 HydrophobicContact CB-CE2 4.1Å; F266-Y275 HydrophobicContact CB-CD2 4Å; Y275-S277 VanDerWaalsContact C-N 3.31Å; Y275-S277 PolarHBondContact O-N 2.88Å; Y275-M280 HydrophobicContact CE2-CG 4.19Å; Y275-M280 WeakPolarHBondContact OH-CG 3.48Å; Y275-S304 PolarHBondContact OH-OG 2.9Å; Y275-I307 HydrophobicContact CD1-CG2 3.93Å; Y275-I307 HydrophobicContact CD2-CG2 3.87Å; Y275-I307 HydrophobicContact CE1-CG2 3.74Å; Y275-I307 HydrophobicContact CE2-CB 4.46Å; Y275-I307 HydrophobicContact CE2-CD1 4.05Å; Y275-I307 HydrophobicContact CE2-CG2 3.67Å; Y275-I307 HydrophobicContact CG-CG2 3.98Å; Y275-L308 HydrophobicContact CD1-CD2 4.42Å; Y275-L308 HydrophobicContact CE1-CD2 3.94Å; Y275-L308 HydrophobicContact CE1-CG 4.23Å
276	P	90.1	Very high	85.1	Confident	15 Å²	15	58 Å²	58	10%	0.097	35%	0.351	C	S	.	.			trans	-82.4	75.5	-174.2	33.5	-35.5	0	0	0	110.4	A262 A265 P274 H278 Y279	A262-P276 HydrophobicContact CB-CG 4.01Å; A265-P276 HydrophobicContact CB-CG 4.23Å; P274-P276 WeakPolarHBondContact O-CD 3.09Å; P276-H278 PolarHBondContact O-N 3.26Å; P276-H278 VanDerWaalsContact O-N 3.16Å; P276-Y279 HydrophobicContact CB-CD2 4.11Å; P276-Y279 HydrophobicContact CB-CE2 4.48Å; P276-Y279 HydrophobicContact CB-CG 4.12Å; P276-Y279 HydrophobicContact CG-CD2 3.94Å; P276-Y279 HydrophobicContact CG-CE2 4.45Å; P276-Y279 HydrophobicContact CG-CG 4.31Å; P276-Y279 WeakPolarHBondContact O-CB 3.43Å; P276-Y279 PolarHBondContact O-N 2.93Å
277	S	90.3	Very high	85.3	Confident	36 Å²	36	55.4 Å²	55.4	25%	0.252	34%	0.339	S	S	.	.	H	α-helix	trans	-48.7	-43.2	-179.9	54	0	0	0	0	113.2	Y275 Y279 M280 D281	Y275-S277 VanDerWaalsContact C-N 3.31Å; Y275-S277 PolarHBondContact O-N 2.88Å; S277-Y279 PolarHBondContact O-N 2.88Å; S277-Y279 VanDerWaalsContact O-N 3.07Å; S277-M280 WeakPolarHBondContact O-CA 3.08Å; S277-M280 WeakPolarHBondContact O-CB 3.35Å; S277-M280 PolarHBondContact O-N 3.17Å; S277-D281 PolarHBondContact O-N 2.84Å
278	H	92.8	Very high	85.4	Confident	105 Å²	105	56.1 Å²	56.1	49%	0.486	34%	0.337	S	S	.	.	H	α-helix	trans	-56.1	-25.2	176.5	73.1	-70.1	0	0	0	114.7	P276 T282	P276-H278 PolarHBondContact O-N 3.26Å; P276-H278 VanDerWaalsContact O-N 3.16Å; H278-T282 WeakPolarHBondContact O-CB 3.23Å; H278-T282 PolarHBondContact O-N 3.42Å; H278-T282 PolarHBondContact O-OG1 2.75Å
279	Y	94.9	Very high	85.6	Confident	25 Å²	25	58.9 Å²	58.9	10%	0.098	35%	0.353	C	S	.	.	H	α-helix	trans	-71.6	-40.9	172.3	-76.7	6.2	0	0	0	111.7	H239 L258 A261 P276 S277 A283	H239-Y279 PolarHBondContact CE1-OH 2.86Å; H239-Y279 AromaticContact ND1-CZ 3.95Å; H239-Y279 PolarHBondContact ND1-OH 2.86Å; H239-Y279 VanDerWaalsContact ND1-OH 3.13Å; L258-Y279 HydrophobicContact CD2-CD1 3.75Å; L258-Y279 HydrophobicContact CD2-CD2 4.24Å; L258-Y279 HydrophobicContact CD2-CE1 4.5Å; L258-Y279 HydrophobicContact CD2-CG 3.62Å; A261-Y279 HydrophobicContact CB-CD2 4.18Å; A261-Y279 HydrophobicContact CB-CE2 4.39Å; P276-Y279 HydrophobicContact CB-CD2 4.11Å; P276-Y279 HydrophobicContact CB-CE2 4.48Å; P276-Y279 HydrophobicContact CB-CG 4.12Å; P276-Y279 HydrophobicContact CG-CD2 3.94Å; P276-Y279 HydrophobicContact CG-CE2 4.45Å; P276-Y279 HydrophobicContact CG-CG 4.31Å; P276-Y279 WeakPolarHBondContact O-CB 3.43Å; P276-Y279 PolarHBondContact O-N 2.93Å; S277-Y279 PolarHBondContact O-N 2.88Å; S277-Y279 VanDerWaalsContact O-N 3.07Å; Y279-A283 WeakPolarHBondContact O-CB 3.41Å; Y279-A283 PolarHBondContact O-N 3.04Å
280	M	95.1	Very high	86.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-66.1	-46.1	172.6	-70.6	-56.7	-148.8	0	0	111.1	E259 A262 V263 Y275 S277 T282 A283 I284 L303 I307	E259-M280 HydrophobicContact CB-SD 4.15Å; E259-M280 HydrophobicContact CG-CE 3.98Å; E259-M280 HydrophobicContact CG-SD 3.81Å; A262-M280 HydrophobicContact CB-CE 4.17Å; A262-M280 HydrophobicContact CB-CG 3.77Å; A262-M280 HydrophobicContact CB-SD 3.89Å; V263-M280 HydrophobicContact CG2-CE 3.51Å; Y275-M280 HydrophobicContact CE2-CG 4.19Å; Y275-M280 WeakPolarHBondContact OH-CG 3.48Å; S277-M280 WeakPolarHBondContact O-CA 3.08Å; S277-M280 WeakPolarHBondContact O-CB 3.35Å; S277-M280 PolarHBondContact O-N 3.17Å; M280-T282 VanDerWaalsContact C-N 3.26Å; M280-T282 PolarHBondContact O-N 2.65Å; M280-A283 PolarHBondContact O-N 3.31Å; M280-I284 HydrophobicContact CB-CD1 4.41Å; M280-I284 WeakPolarHBondContact O-CB 3.44Å; M280-I284 WeakPolarHBondContact O-CD1 3.3Å; M280-I284 WeakPolarHBondContact O-CG1 3.38Å; M280-I284 PolarHBondContact O-N 3.39Å; M280-L303 HydrophobicContact CE-CD2 4.28Å; M280-L303 HydrophobicContact CE-CG 4.35Å; M280-I307 HydrophobicContact CE-CD1 4.09Å
281	D	94.3	Very high	87.9	Confident	61 Å²	61	54.3 Å²	54.3	33%	0.326	29%	0.292	S	S	.	.	H	α-helix	trans	-55.7	-44	177.5	-68.6	-45.1	0	0	0	111.4	S277 Q285	S277-D281 PolarHBondContact O-N 2.84Å; D281-Q285 WeakPolarHBondContact O-CB 3.42Å; D281-Q285 VanDerWaalsContact O-CG 3.28Å; D281-Q285 WeakPolarHBondContact O-CG 3.37Å; D281-Q285 PolarHBondContact O-N 3Å
282	T	95.4	Very high	89.4	Confident	59 Å²	59	60.7 Å²	60.7	36%	0.362	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-41.4	175.9	-52.9	0	0	0	0	111.8	L258 H278 M280 T286	L258-T282 HydrophobicContact CD1-CG2 3.77Å; H278-T282 WeakPolarHBondContact O-CB 3.23Å; H278-T282 PolarHBondContact O-N 3.42Å; H278-T282 PolarHBondContact O-OG1 2.75Å; M280-T282 VanDerWaalsContact C-N 3.26Å; M280-T282 PolarHBondContact O-N 2.65Å; T282-T286 VanDerWaalsContact O-CB 3.27Å; T282-T286 WeakPolarHBondContact O-CB 3.19Å; T282-T286 PolarHBondContact O-N 2.92Å; T282-T286 PolarHBondContact O-OG1 3.06Å
283	A	96.2	Very high	91	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-45.4	177.6	0	0	0	0	0	111.7	A255 L258 E259 Y279 M280 T286 Y287	A255-A283 HydrophobicContact CB-CB 4.42Å; L258-A283 HydrophobicContact CB-CB 3.97Å; E259-A283 HydrophobicContact CB-CB 4.36Å; Y279-A283 WeakPolarHBondContact O-CB 3.41Å; Y279-A283 PolarHBondContact O-N 3.04Å; M280-A283 PolarHBondContact O-N 3.31Å; A283-T286 PolarHBondContact O-N 3.03Å; A283-Y287 HydrophobicContact CB-CD2 4.5Å; A283-Y287 HydrophobicContact CB-CE2 4.34Å; A283-Y287 WeakPolarHBondContact O-CB 3.49Å; A283-Y287 WeakPolarHBondContact O-CD2 3.17Å; A283-Y287 PolarHBondContact O-N 3.14Å
284	I	96.3	Very high	92.2	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.036	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-47.4	179.2	-64.9	162.3	0	0	0	110.6	M280 Y287 R288 C300 A301 L320 M324	M280-I284 HydrophobicContact CB-CD1 4.41Å; M280-I284 WeakPolarHBondContact O-CB 3.44Å; M280-I284 WeakPolarHBondContact O-CD1 3.3Å; M280-I284 WeakPolarHBondContact O-CG1 3.38Å; M280-I284 PolarHBondContact O-N 3.39Å; I284-Y287 PolarHBondContact O-N 2.93Å; I284-R288 VanDerWaalsContact O-CB 3.23Å; I284-R288 WeakPolarHBondContact O-CB 3.41Å; I284-R288 PolarHBondContact O-N 3.42Å; I284-C300 HydrophobicContact CG1-CB 3.87Å; I284-C300 VanDerWaalsContact CG1-SG 3.57Å; I284-A301 HydrophobicContact CD1-CB 3.89Å; I284-A301 HydrophobicContact CG1-CB 4.29Å; I284-A301 HydrophobicContact CG2-CB 4.35Å; I284-L320 HydrophobicContact CD1-CD1 3.94Å; I284-L320 HydrophobicContact CD1-CD2 4.1Å; I284-M324 HydrophobicContact CG2-CE 4Å; I284-M324 HydrophobicContact CG2-SD 3.69Å
285	Q	95.3	Very high	92.8	Very high	113 Å²	113	52.9 Å²	52.9	53%	0.528	26%	0.263	S	S	.	.	H	α-helix	trans	-60.9	-43.4	174	-71.9	170.2	15.9	0	0	111.6	D281 R288 D289	D281-Q285 WeakPolarHBondContact O-CB 3.42Å; D281-Q285 VanDerWaalsContact O-CG 3.28Å; D281-Q285 WeakPolarHBondContact O-CG 3.37Å; D281-Q285 PolarHBondContact O-N 3Å; Q285-R288 PolarHBondContact O-N 3.32Å; Q285-D289 WeakPolarHBondContact O-CB 3.48Å; Q285-D289 PolarHBondContact O-N 2.9Å
286	T	95.1	Very high	93	Very high	10 Å²	10	54.2 Å²	54.2	6%	0.061	27%	0.271	C	S	.	.	I	π-helix	trans	-63	-46	178.3	-58.3	0	0	0	0	111.5	M251 A255 T282 A283 V290 C291	M251-T286 HydrophobicContact CB-CG2 3.84Å; M251-T286 HydrophobicContact CE-CG2 3.78Å; M251-T286 WeakPolarHBondContact O-CG2 3.48Å; A255-T286 HydrophobicContact CB-CG2 3.9Å; T282-T286 VanDerWaalsContact O-CB 3.27Å; T282-T286 WeakPolarHBondContact O-CB 3.19Å; T282-T286 PolarHBondContact O-N 2.92Å; T282-T286 PolarHBondContact O-OG1 3.06Å; A283-T286 PolarHBondContact O-N 3.03Å; T286-V290 HydrophobicContact CG2-CB 4.38Å; T286-V290 WeakPolarHBondContact O-CB 2.83Å; T286-V290 PolarHBondContact O-N 2.81Å; T286-C291 PolarHBondContact O-N 2.71Å; T286-C291 PolarHBondContact O-SG 2.67Å
287	Y	95.3	Very high	93.2	Very high	9 Å²	9	53.5 Å²	53.5	4%	0.035	27%	0.267	C	S	.	.	I	π-helix	trans	-61.3	-45.2	176.1	-73.6	-51.5	0	0	0	112	L252 A255 G256 E259 A283 I284 K292 N293 L296 C300	L252-Y287 HydrophobicContact CD1-CD1 4.04Å; L252-Y287 HydrophobicContact CD1-CE1 3.87Å; A255-Y287 HydrophobicContact CB-CD1 3.84Å; A255-Y287 HydrophobicContact CB-CD2 4.18Å; A255-Y287 HydrophobicContact CB-CE1 3.55Å; A255-Y287 HydrophobicContact CB-CE2 3.92Å; A255-Y287 HydrophobicContact CB-CG 4.14Å; G256-Y287 WeakPolarHBondContact CA-OH 3.21Å; G256-Y287 PolarHBondContact N-OH 3.37Å; E259-Y287 PolarHBondContact OE2-OH 3.48Å; A283-Y287 HydrophobicContact CB-CD2 4.5Å; A283-Y287 HydrophobicContact CB-CE2 4.34Å; A283-Y287 WeakPolarHBondContact O-CB 3.49Å; A283-Y287 WeakPolarHBondContact O-CD2 3.17Å; A283-Y287 PolarHBondContact O-N 3.14Å; I284-Y287 PolarHBondContact O-N 2.93Å; Y287-K292 PolarHBondContact O-N 2.96Å; Y287-K292 VanDerWaalsContact O-N 3.13Å; Y287-N293 PolarHBondContact O-N 2.72Å; Y287-L296 HydrophobicContact CD1-CB 3.66Å; Y287-L296 HydrophobicContact CD1-CD1 3.99Å; Y287-L296 HydrophobicContact CD1-CG 4.5Å; Y287-L296 HydrophobicContact CD2-CB 4.23Å; Y287-L296 HydrophobicContact CE1-CB 3.86Å; Y287-L296 HydrophobicContact CE1-CD1 3.7Å; Y287-L296 HydrophobicContact CE1-CG 4.39Å; Y287-L296 HydrophobicContact CE2-CB 4.39Å; Y287-L296 HydrophobicContact CG-CB 3.86Å; Y287-C300 HydrophobicContact CD2-CB 4.11Å; Y287-C300 HydrophobicContact CE2-CB 4.07Å
288	R	92.8	Very high	93.3	Very high	80 Å²	80	53.8 Å²	53.8	30%	0.302	26%	0.264	S	S	.	.	I	π-helix	trans	-69.5	-57.6	-177.4	-175.7	-170.2	176.3	144.8	1.4	112.6	I284 Q285 K292 M294 A297 K323	I284-R288 VanDerWaalsContact O-CB 3.23Å; I284-R288 WeakPolarHBondContact O-CB 3.41Å; I284-R288 PolarHBondContact O-N 3.42Å; Q285-R288 PolarHBondContact O-N 3.32Å; R288-K292 WeakPolarHBondContact O-CA 3.41Å; R288-M294 HydrophobicContact CG-CE 3.96Å; R288-M294 HydrophobicContact CG-SD 4.23Å; R288-A297 HydrophobicContact CB-CB 4.01Å; R288-K323 PolarHBondContact NH1-O 2.81Å
289	D	92.9	Very high	93.4	Very high	98 Å²	98	54 Å²	54	52%	0.524	26%	0.261	S	S	.	.	I	π-helix	trans	-94.5	-32.9	-162.4	-54.2	-38.2	0	0	0	112.1	Q285	Q285-D289 WeakPolarHBondContact O-CB 3.48Å; Q285-D289 PolarHBondContact O-N 2.9Å
290	V	93.1	Very high	93.5	Very high	65 Å²	65	52.9 Å²	52.9	39%	0.394	26%	0.256	S	S	.	.	I	π-helix	trans	-100	-48.4	-175.3	-172.9	0	0	0	0	112.2	T204 M251 T286	T204-V290 HydrophobicContact CG2-CG1 4.5Å; T204-V290 PolarHBondContact OG1-O 3.35Å; M251-V290 HydrophobicContact CB-CG1 4.03Å; M251-V290 HydrophobicContact CG-CG1 3.89Å; T286-V290 HydrophobicContact CG2-CB 4.38Å; T286-V290 WeakPolarHBondContact O-CB 2.83Å; T286-V290 PolarHBondContact O-N 2.81Å
291	C	90	Very high	93.5	Very high	6 Å²	6	52.9 Å²	52.9	4%	0.041	26%	0.256	C	S	.	.	S	Bend	trans	-82.9	-15.2	178.3	-58.9	0	0	0	0	112.9	L252 T286 N293	L252-C291 HydrophobicContact CD1-CB 4.22Å; T286-C291 PolarHBondContact O-N 2.71Å; T286-C291 PolarHBondContact O-SG 2.67Å; C291-N293 HydrophobicContact CB-CB 4.4Å; C291-N293 PolarHBondContact O-N 2.92Å
292	K	90.6	Very high	93.5	Very high	170 Å²	170	53.6 Å²	53.6	74%	0.739	26%	0.26	S	S	*	.			trans	52	22.9	-174.1	-57.5	-176.7	180	-178.3	0	113.8	Y287 R288 M294	Y287-K292 PolarHBondContact O-N 2.96Å; Y287-K292 VanDerWaalsContact O-N 3.13Å; R288-K292 WeakPolarHBondContact O-CA 3.41Å; K292-M294 PolarHBondContact O-N 3.2Å
293	N	90	Very high	93.5	Very high	51 Å²	51	53.8 Å²	53.8	27%	0.273	26%	0.258	S	S	.	.			trans	-99.3	87.1	179.8	-170	-37.5	0	0	0	109.1	Y287 C291 M295 L296 A297	Y287-N293 PolarHBondContact O-N 2.72Å; C291-N293 HydrophobicContact CB-CB 4.4Å; C291-N293 PolarHBondContact O-N 2.92Å; N293-M295 PolarHBondContact O-N 2.97Å; N293-M295 PolarHBondContact OD1-N 3.48Å; N293-L296 HydrophobicContact CB-CB 4.45Å; N293-L296 HydrophobicContact CB-CD1 4.33Å; N293-L296 WeakPolarHBondContact ND2-CD1 3.42Å; N293-L296 PolarHBondContact O-N 2.68Å; N293-L296 WeakPolarHBondContact OD1-CG 3.36Å; N293-L296 PolarHBondContact OD1-N 3.08Å; N293-L296 VanDerWaalsContact OD1-N 3.08Å; N293-A297 PolarHBondContact O-N 3.16Å; N293-A297 VanDerWaalsContact O-N 3.15Å
294	M	89.7	Confident	93.5	Very high	58 Å²	58	53.8 Å²	53.8	29%	0.286	26%	0.258	S	S	.	.	H	α-helix	trans	-66	-36.8	-174.6	-168.1	63.6	74.4	0	0	112.7	R288 K292 L296 A297 E298 R332	R288-M294 HydrophobicContact CG-CE 3.96Å; R288-M294 HydrophobicContact CG-SD 4.23Å; K292-M294 PolarHBondContact O-N 3.2Å; M294-L296 VanDerWaalsContact C-N 3.33Å; M294-L296 PolarHBondContact O-N 3.32Å; M294-A297 WeakPolarHBondContact O-CB 3.42Å; M294-A297 PolarHBondContact O-N 3.05Å; M294-A297 VanDerWaalsContact O-N 3.14Å; M294-E298 HydrophobicContact CG-CG 4.49Å; M294-E298 WeakPolarHBondContact CG-OE1 3.27Å; M294-E298 WeakPolarHBondContact O-CG 3.45Å; M294-E298 PolarHBondContact O-N 3.2Å; M294-R332 PolarHBondContact SD-NH1 3.34Å; M294-R332 PolarHBondContact SD-NH2 3.11Å; M294-R332 VanDerWaalsContact SD-NH2 3.42Å
295	M	90.6	Very high	93.5	Very high	124 Å²	124	53.6 Å²	53.6	61%	0.611	26%	0.257	S	S	*	.	H	α-helix	trans	-58.4	-42.4	176.1	-69.1	-63.3	-69.3	0	0	112.4	N293 R299	N293-M295 PolarHBondContact O-N 2.97Å; N293-M295 PolarHBondContact OD1-N 3.48Å; M295-R299 WeakPolarHBondContact O-CB 3.32Å; M295-R299 PolarHBondContact O-N 2.83Å
296	L	93.2	Very high	93.5	Very high	47 Å²	47	53 Å²	53	25%	0.246	26%	0.255	C	S	.	.	H	α-helix	trans	-70.8	-37.6	175.6	-68.1	179.6	0	0	0	112.3	L252 Y287 N293 M294 R299 C300	L252-L296 HydrophobicContact CD1-CD1 3.84Å; Y287-L296 HydrophobicContact CD1-CB 3.66Å; Y287-L296 HydrophobicContact CD1-CD1 3.99Å; Y287-L296 HydrophobicContact CD1-CG 4.5Å; Y287-L296 HydrophobicContact CD2-CB 4.23Å; Y287-L296 HydrophobicContact CE1-CB 3.86Å; Y287-L296 HydrophobicContact CE1-CD1 3.7Å; Y287-L296 HydrophobicContact CE1-CG 4.39Å; Y287-L296 HydrophobicContact CE2-CB 4.39Å; Y287-L296 HydrophobicContact CG-CB 3.86Å; N293-L296 HydrophobicContact CB-CB 4.45Å; N293-L296 HydrophobicContact CB-CD1 4.33Å; N293-L296 WeakPolarHBondContact ND2-CD1 3.42Å; N293-L296 PolarHBondContact O-N 2.68Å; N293-L296 WeakPolarHBondContact OD1-CG 3.36Å; N293-L296 PolarHBondContact OD1-N 3.08Å; N293-L296 VanDerWaalsContact OD1-N 3.08Å; M294-L296 VanDerWaalsContact C-N 3.33Å; M294-L296 PolarHBondContact O-N 3.32Å; L296-R299 PolarHBondContact O-N 3.47Å; L296-C300 VanDerWaalsContact O-CB 3.24Å; L296-C300 WeakPolarHBondContact O-CB 3.33Å; L296-C300 PolarHBondContact O-N 2.94Å
297	A	94.1	Very high	93.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-43.4	175.1	0	0	0	0	0	111.6	R288 N293 M294 A301 M324	R288-A297 HydrophobicContact CB-CB 4.01Å; N293-A297 PolarHBondContact O-N 3.16Å; N293-A297 VanDerWaalsContact O-N 3.15Å; M294-A297 WeakPolarHBondContact O-CB 3.42Å; M294-A297 PolarHBondContact O-N 3.05Å; M294-A297 VanDerWaalsContact O-N 3.14Å; A297-A301 VanDerWaalsContact O-CB 3.28Å; A297-A301 WeakPolarHBondContact O-CB 3.3Å; A297-A301 PolarHBondContact O-N 3.36Å; A297-M324 HydrophobicContact CB-CE 3.79Å
298	E	92.4	Very high	93.4	Very high	41 Å²	41	52.8 Å²	52.8	19%	0.192	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-51.1	175.3	-74.2	177	-125.6	0	0	112.4	M294 C300 A301 L302 M324 R332	M294-E298 HydrophobicContact CG-CG 4.49Å; M294-E298 WeakPolarHBondContact CG-OE1 3.27Å; M294-E298 WeakPolarHBondContact O-CG 3.45Å; M294-E298 PolarHBondContact O-N 3.2Å; E298-C300 VanDerWaalsContact C-N 3.27Å; E298-C300 PolarHBondContact O-N 3.37Å; E298-A301 PolarHBondContact O-N 3.28Å; E298-A301 VanDerWaalsContact O-N 3.12Å; E298-L302 WeakPolarHBondContact O-CG 3.17Å; E298-L302 PolarHBondContact O-N 3.1Å; E298-M324 HydrophobicContact CG-CE 4.33Å; E298-R332 VanDerWaalsContact CD-NH1 3.31Å; E298-R332 VanDerWaalsContact OE1-CD 3.32Å; E298-R332 WeakPolarHBondContact OE1-CD 3.48Å; E298-R332 IonicContact OE1-CZ 3.62Å; E298-R332 IonicContact OE1-NE 2.92Å; E298-R332 PolarHBondContact OE1-NE 2.98Å; E298-R332 IonicContact OE1-NH1 2.71Å; E298-R332 PolarHBondContact OE1-NH1 2.78Å; E298-R332 WeakPolarHBondContact OE2-CD 3.45Å; E298-R332 WeakPolarHBondContact OE2-CG 3.3Å; E298-R332 IonicContact OE2-CZ 3.89Å; E298-R332 IonicContact OE2-NE 3.67Å; E298-R332 PolarHBondContact OE2-NE 3.11Å
299	R	94.8	Very high	93.5	Very high	111 Å²	111	50.8 Å²	50.8	42%	0.419	25%	0.247	S	C	.	.	H	α-helix	trans	-55.6	-44.8	177.6	-174.1	-172.8	62.6	67.5	13.6	111.3	E259 M295 L296 L303	E259-R299 VanDerWaalsContact CD-NH2 3.3Å; E259-R299 IonicContact OE1-CZ 3.52Å; E259-R299 VanDerWaalsContact OE1-CZ 3.26Å; E259-R299 IonicContact OE1-NH1 2.65Å; E259-R299 PolarHBondContact OE1-NH1 2.82Å; E259-R299 IonicContact OE1-NH2 3.28Å; E259-R299 PolarHBondContact OE1-NH2 2.94Å; E259-R299 IonicContact OE2-CZ 3.17Å; E259-R299 IonicContact OE2-NH1 3.52Å; E259-R299 IonicContact OE2-NH2 2.67Å; E259-R299 PolarHBondContact OE2-NH2 2.86Å; M295-R299 WeakPolarHBondContact O-CB 3.32Å; M295-R299 PolarHBondContact O-N 2.83Å; L296-R299 PolarHBondContact O-N 3.47Å; R299-L303 WeakPolarHBondContact O-CB 3.37Å; R299-L303 PolarHBondContact O-N 2.79Å
300	C	95.8	Very high	93.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-41	177.5	-171.6	0	0	0	0	111.9	I284 Y287 L296 E298 S304	I284-C300 HydrophobicContact CG1-CB 3.87Å; I284-C300 VanDerWaalsContact CG1-SG 3.57Å; Y287-C300 HydrophobicContact CD2-CB 4.11Å; Y287-C300 HydrophobicContact CE2-CB 4.07Å; L296-C300 VanDerWaalsContact O-CB 3.24Å; L296-C300 WeakPolarHBondContact O-CB 3.33Å; L296-C300 PolarHBondContact O-N 2.94Å; E298-C300 VanDerWaalsContact C-N 3.27Å; E298-C300 PolarHBondContact O-N 3.37Å; C300-S304 WeakPolarHBondContact O-CB 3.32Å; C300-S304 PolarHBondContact O-N 2.72Å
301	A	95.5	Very high	93.4	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-41.4	177.5	0	0	0	0	0	113.4	I284 A297 E298 S304 A305 L320 M324	I284-A301 HydrophobicContact CD1-CB 3.89Å; I284-A301 HydrophobicContact CG1-CB 4.29Å; I284-A301 HydrophobicContact CG2-CB 4.35Å; A297-A301 VanDerWaalsContact O-CB 3.28Å; A297-A301 WeakPolarHBondContact O-CB 3.3Å; A297-A301 PolarHBondContact O-N 3.36Å; E298-A301 PolarHBondContact O-N 3.28Å; E298-A301 VanDerWaalsContact O-N 3.12Å; A301-S304 PolarHBondContact O-N 2.94Å; A301-A305 WeakPolarHBondContact O-CB 3.03Å; A301-A305 PolarHBondContact O-N 2.66Å; A301-L320 HydrophobicContact CB-CD2 4.44Å; A301-L320 HydrophobicContact CB-CG 4.4Å; A301-M324 HydrophobicContact CB-CE 4.14Å; A301-M324 HydrophobicContact CB-CG 3.81Å; A301-M324 HydrophobicContact CB-SD 4.48Å
302	L	95.5	Very high	93.5	Very high	76 Å²	76	53.4 Å²	53.4	40%	0.398	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-46	174.8	-70.4	172	0	0	0	111	E298 S304 A305 E306 L321 L336	E298-L302 WeakPolarHBondContact O-CG 3.17Å; E298-L302 PolarHBondContact O-N 3.1Å; L302-S304 PolarHBondContact O-N 2.86Å; L302-A305 PolarHBondContact O-N 2.79Å; L302-E306 PolarHBondContact O-N 3Å; L302-L321 HydrophobicContact CD2-CD2 4.05Å; L302-L336 HydrophobicContact CD2-CD2 3.92Å
303	L	95.2	Very high	93.7	Very high	62 Å²	62	48.9 Å²	48.9	33%	0.325	25%	0.253	S	S	.	.	H	α-helix	trans	-60.5	-44.2	175.8	-179.6	58.9	0	0	0	112	V263 M280 R299 A305 E306 I307	V263-L303 HydrophobicContact CG2-CD2 3.71Å; V263-L303 HydrophobicContact CG2-CG 4.42Å; M280-L303 HydrophobicContact CE-CD2 4.28Å; M280-L303 HydrophobicContact CE-CG 4.35Å; R299-L303 WeakPolarHBondContact O-CB 3.37Å; R299-L303 PolarHBondContact O-N 2.79Å; L303-A305 VanDerWaalsContact C-N 3.35Å; L303-E306 PolarHBondContact O-N 2.93Å; L303-I307 HydrophobicContact CD1-CD1 4.44Å; L303-I307 HydrophobicContact CG-CD1 4.28Å; L303-I307 WeakPolarHBondContact O-CG1 3.11Å; L303-I307 PolarHBondContact O-N 2.87Å; L303-I307 VanDerWaalsContact O-N 3.08Å
304	S	95.4	Very high	94	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.007	25%	0.25	C	S	.	.	H	α-helix	trans	-63.4	-38.9	174.7	-177	0	0	0	0	112.2	Y275 C300 A301 L302 I307 L308	Y275-S304 PolarHBondContact OH-OG 2.9Å; C300-S304 WeakPolarHBondContact O-CB 3.32Å; C300-S304 PolarHBondContact O-N 2.72Å; A301-S304 PolarHBondContact O-N 2.94Å; L302-S304 PolarHBondContact O-N 2.86Å; S304-I307 PolarHBondContact O-N 2.84Å; S304-L308 WeakPolarHBondContact O-CB 3.25Å; S304-L308 VanDerWaalsContact O-CG 3.25Å; S304-L308 WeakPolarHBondContact O-CG 3.29Å; S304-L308 PolarHBondContact O-N 2.81Å
305	A	96.1	Very high	94.3	Very high	2 Å²	2	49.9 Å²	49.9	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-40.1	175.9	0	0	0	0	0	112.5	A301 L302 L303 L308 K309 A317 L321	A301-A305 WeakPolarHBondContact O-CB 3.03Å; A301-A305 PolarHBondContact O-N 2.66Å; L302-A305 PolarHBondContact O-N 2.79Å; L303-A305 VanDerWaalsContact C-N 3.35Å; A305-L308 PolarHBondContact O-N 2.82Å; A305-K309 WeakPolarHBondContact O-CB 3.46Å; A305-K309 VanDerWaalsContact O-CG 3.31Å; A305-K309 WeakPolarHBondContact O-CG 3.44Å; A305-K309 PolarHBondContact O-N 3.46Å; A305-A317 HydrophobicContact CB-CB 4.4Å; A305-L321 HydrophobicContact CB-CD1 4.3Å; A305-L321 HydrophobicContact CB-CD2 3.95Å; A305-L321 HydrophobicContact CB-CG 4.07Å
306	E	95.3	Very high	94.5	Very high	101 Å²	101	47.8 Å²	47.8	47%	0.472	25%	0.25	S	C	.	.	H	α-helix	trans	-63.8	-44.1	173	-65.5	-50.5	145.8	0	0	112.2	L302 L303 L308 K309 S310	L302-E306 PolarHBondContact O-N 3Å; L303-E306 PolarHBondContact O-N 2.93Å; E306-L308 PolarHBondContact O-N 2.81Å; E306-K309 PolarHBondContact O-N 3.16Å; E306-K309 WeakPolarHBondContact OE1-CE 3.41Å; E306-K309 IonicContact OE1-NZ 2.75Å; E306-K309 PolarHBondContact OE1-NZ 2.84Å; E306-K309 WeakPolarHBondContact OE2-CE 3.33Å; E306-K309 IonicContact OE2-NZ 2.92Å; E306-K309 PolarHBondContact OE2-NZ 3.24Å; E306-S310 PolarHBondContact O-N 3.22Å
307	I	94.1	Very high	94.7	Very high	7 Å²	7	45.5 Å²	45.5	4%	0.036	24%	0.238	C	C	.	.	H	α-helix	trans	-58.4	-48.3	175.6	-68.2	167	0	0	0	110.3	V263 F266 Y275 M280 L303 S304 K309 S310 Q311	V263-I307 HydrophobicContact CG2-CD1 4.42Å; F266-I307 HydrophobicContact CB-CG2 4.38Å; F266-I307 HydrophobicContact CD1-CD1 4.18Å; F266-I307 HydrophobicContact CD1-CG1 3.86Å; F266-I307 HydrophobicContact CD1-CG2 4.19Å; F266-I307 HydrophobicContact CD2-CG2 3.58Å; F266-I307 HydrophobicContact CE1-CG1 3.96Å; F266-I307 HydrophobicContact CE1-CG2 4.4Å; F266-I307 HydrophobicContact CE2-CG2 3.83Å; F266-I307 HydrophobicContact CG-CD1 4.46Å; F266-I307 HydrophobicContact CG-CG1 4.27Å; F266-I307 HydrophobicContact CG-CG2 3.77Å; F266-I307 HydrophobicContact CZ-CG1 4.45Å; F266-I307 HydrophobicContact CZ-CG2 4.23Å; Y275-I307 HydrophobicContact CD1-CG2 3.93Å; Y275-I307 HydrophobicContact CD2-CG2 3.87Å; Y275-I307 HydrophobicContact CE1-CG2 3.74Å; Y275-I307 HydrophobicContact CE2-CB 4.46Å; Y275-I307 HydrophobicContact CE2-CD1 4.05Å; Y275-I307 HydrophobicContact CE2-CG2 3.67Å; Y275-I307 HydrophobicContact CG-CG2 3.98Å; M280-I307 HydrophobicContact CE-CD1 4.09Å; L303-I307 HydrophobicContact CD1-CD1 4.44Å; L303-I307 HydrophobicContact CG-CD1 4.28Å; L303-I307 WeakPolarHBondContact O-CG1 3.11Å; L303-I307 PolarHBondContact O-N 2.87Å; L303-I307 VanDerWaalsContact O-N 3.08Å; S304-I307 PolarHBondContact O-N 2.84Å; I307-K309 PolarHBondContact O-N 3.13Å; I307-S310 PolarHBondContact O-N 2.89Å; I307-S310 PolarHBondContact O-OG 2.88Å; I307-Q311 PolarHBondContact O-N 2.91Å
308	L	93.9	Very high	94.8	Very high	7 Å²	7	45.5 Å²	45.5	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-41.7	177.5	-70.8	168	0	0	0	112.2	Y275 S304 A305 E306 Q311 A312 K313 E316 A317 L320	Y275-L308 HydrophobicContact CD1-CD2 4.42Å; Y275-L308 HydrophobicContact CE1-CD2 3.94Å; Y275-L308 HydrophobicContact CE1-CG 4.23Å; S304-L308 WeakPolarHBondContact O-CB 3.25Å; S304-L308 VanDerWaalsContact O-CG 3.25Å; S304-L308 WeakPolarHBondContact O-CG 3.29Å; S304-L308 PolarHBondContact O-N 2.81Å; A305-L308 PolarHBondContact O-N 2.82Å; E306-L308 PolarHBondContact O-N 2.81Å; L308-Q311 CarbonylContact O-C 3.48Å; L308-Q311 PolarHBondContact O-N 3.05Å; L308-A312 PolarHBondContact O-N 2.78Å; L308-K313 HydrophobicContact CB-CB 4.23Å; L308-K313 HydrophobicContact CD2-CB 4.04Å; L308-K313 HydrophobicContact CD2-CD 3.75Å; L308-K313 WeakPolarHBondContact O-CA 3.23Å; L308-K313 WeakPolarHBondContact O-CB 3.45Å; L308-K313 PolarHBondContact O-N 2.92Å; L308-E316 HydrophobicContact CD1-CB 3.96Å; L308-E316 HydrophobicContact CD2-CB 4.01Å; L308-E316 HydrophobicContact CG-CB 4.5Å; L308-A317 HydrophobicContact CB-CB 3.93Å; L308-L320 HydrophobicContact CD1-CD2 4.47Å
309	K	94.8	Very high	95	Very high	39 Å²	39	46.6 Å²	46.6	17%	0.17	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-42.3	174.3	-77.3	-172.9	-70.7	169.6	0	112	A305 E306 I307 Q311 A312 Y314 A317	A305-K309 WeakPolarHBondContact O-CB 3.46Å; A305-K309 VanDerWaalsContact O-CG 3.31Å; A305-K309 WeakPolarHBondContact O-CG 3.44Å; A305-K309 PolarHBondContact O-N 3.46Å; E306-K309 PolarHBondContact O-N 3.16Å; E306-K309 WeakPolarHBondContact OE1-CE 3.41Å; E306-K309 IonicContact OE1-NZ 2.75Å; E306-K309 PolarHBondContact OE1-NZ 2.84Å; E306-K309 WeakPolarHBondContact OE2-CE 3.33Å; E306-K309 IonicContact OE2-NZ 2.92Å; E306-K309 PolarHBondContact OE2-NZ 3.24Å; I307-K309 PolarHBondContact O-N 3.13Å; K309-Q311 PolarHBondContact O-N 2.86Å; K309-A312 WeakPolarHBondContact O-CA 3.37Å; K309-A312 PolarHBondContact O-N 3.25Å; K309-Y314 HydrophobicContact CB-CD1 4.38Å; K309-Y314 HydrophobicContact CB-CE1 4.01Å; K309-Y314 HydrophobicContact CD-CD1 4.39Å; K309-Y314 HydrophobicContact CD-CE1 4.26Å; K309-Y314 HydrophobicContact CG-CD1 3.78Å; K309-Y314 HydrophobicContact CG-CE1 3.81Å; K309-A317 HydrophobicContact CG-CB 4.08Å
310	S	92.9	Very high	95.1	Very high	81 Å²	81	42 Å²	42	57%	0.566	23%	0.231	S	C	*	.	H	α-helix	trans	-62	-27.7	176.8	79.3	0	0	0	0	113.2	F266 E306 I307 A312	F266-S310 WeakPolarHBondContact CE2-OG 3.38Å; F266-S310 VanDerWaalsContact CZ-OG 3.26Å; F266-S310 WeakPolarHBondContact CZ-OG 3.16Å; E306-S310 PolarHBondContact O-N 3.22Å; I307-S310 PolarHBondContact O-N 2.89Å; I307-S310 PolarHBondContact O-OG 2.88Å; S310-A312 VanDerWaalsContact C-N 3.29Å
311	Q	91.1	Very high	95.1	Very high	72 Å²	72	42 Å²	42	34%	0.336	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	11.7	174.3	-64.6	-177.1	-16.6	0	0	113.3	F266 I307 L308 K309 K313	F266-Q311 HydrophobicContact CE2-CG 4.25Å; I307-Q311 PolarHBondContact O-N 2.91Å; L308-Q311 CarbonylContact O-C 3.48Å; L308-Q311 PolarHBondContact O-N 3.05Å; K309-Q311 PolarHBondContact O-N 2.86Å; Q311-K313 HydrophobicContact CB-CD 4.09Å; Q311-K313 HydrophobicContact CB-CG 4.16Å; Q311-K313 PolarHBondContact O-N 2.91Å; Q311-K313 VanDerWaalsContact O-N 3.11Å
312	A	92.5	Very high	95.2	Very high	71 Å²	71	44.4 Å²	44.4	59%	0.587	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	16.7	-172	0	0	0	0	0	115.2	L308 K309 S310 Y314	L308-A312 PolarHBondContact O-N 2.78Å; K309-A312 WeakPolarHBondContact O-CA 3.37Å; K309-A312 PolarHBondContact O-N 3.25Å; S310-A312 VanDerWaalsContact C-N 3.29Å; A312-Y314 HydrophobicContact CB-CD2 4.47Å; A312-Y314 HydrophobicContact CB-CE2 4.09Å; A312-Y314 VanDerWaalsContact O-CD2 3.3Å; A312-Y314 WeakPolarHBondContact O-CD2 3.37Å; A312-Y314 PolarHBondContact O-N 3.08Å
313	K	94.1	Very high	95.2	Very high	74 Å²	74	47.3 Å²	47.3	32%	0.322	25%	0.253	S	S	.	.			trans	-83.4	47.5	178.8	-68.5	173.4	152	-122.5	0	112.3	L308 Q311 S315 E316 A317	L308-K313 HydrophobicContact CB-CB 4.23Å; L308-K313 HydrophobicContact CD2-CB 4.04Å; L308-K313 HydrophobicContact CD2-CD 3.75Å; L308-K313 WeakPolarHBondContact O-CA 3.23Å; L308-K313 WeakPolarHBondContact O-CB 3.45Å; L308-K313 PolarHBondContact O-N 2.92Å; Q311-K313 HydrophobicContact CB-CD 4.09Å; Q311-K313 HydrophobicContact CB-CG 4.16Å; Q311-K313 PolarHBondContact O-N 2.91Å; Q311-K313 VanDerWaalsContact O-N 3.11Å; K313-S315 PolarHBondContact O-N 3.22Å; K313-E316 HydrophobicContact CB-CB 4.37Å; K313-E316 WeakPolarHBondContact CD-OE1 3.49Å; K313-E316 WeakPolarHBondContact CE-OE1 3.32Å; K313-E316 VanDerWaalsContact NZ-CD 3.26Å; K313-E316 IonicContact NZ-OE1 2.67Å; K313-E316 PolarHBondContact NZ-OE1 2.98Å; K313-E316 IonicContact NZ-OE2 3.26Å; K313-E316 PolarHBondContact NZ-OE2 3.2Å; K313-E316 PolarHBondContact O-N 3.49Å; K313-A317 PolarHBondContact O-N 2.82Å; K313-A317 VanDerWaalsContact O-N 3.13Å
314	Y	96.9	Very high	95.1	Very high	56 Å²	56	44.5 Å²	44.5	22%	0.22	24%	0.238	C	C	.	.	H	α-helix	trans	-56.1	-27.2	-177.2	-63.4	-78.6	0	0	0	114	K309 A312 A318 C343 N346	K309-Y314 HydrophobicContact CB-CD1 4.38Å; K309-Y314 HydrophobicContact CB-CE1 4.01Å; K309-Y314 HydrophobicContact CD-CD1 4.39Å; K309-Y314 HydrophobicContact CD-CE1 4.26Å; K309-Y314 HydrophobicContact CG-CD1 3.78Å; K309-Y314 HydrophobicContact CG-CE1 3.81Å; A312-Y314 HydrophobicContact CB-CD2 4.47Å; A312-Y314 HydrophobicContact CB-CE2 4.09Å; A312-Y314 VanDerWaalsContact O-CD2 3.3Å; A312-Y314 WeakPolarHBondContact O-CD2 3.37Å; A312-Y314 PolarHBondContact O-N 3.08Å; Y314-A318 WeakPolarHBondContact O-CB 3.29Å; Y314-A318 PolarHBondContact O-N 2.82Å; Y314-C343 WeakPolarHBondContact CB-O 3.36Å; Y314-C343 HydrophobicContact CD1-CB 4.38Å; Y314-C343 WeakPolarHBondContact O-CB 3.5Å; Y314-N346 HydrophobicContact CD1-CB 3.92Å; Y314-N346 HydrophobicContact CD2-CB 4.46Å; Y314-N346 VanDerWaalsContact CD2-O 3.28Å; Y314-N346 WeakPolarHBondContact CD2-O 3.4Å; Y314-N346 HydrophobicContact CE1-CB 3.65Å; Y314-N346 HydrophobicContact CE2-CB 4.21Å; Y314-N346 WeakPolarHBondContact CE2-O 3.45Å; Y314-N346 HydrophobicContact CG-CB 4.33Å
315	S	96.4	Very high	95	Very high	75 Å²	75	46.4 Å²	46.4	52%	0.524	25%	0.25	S	C	.	.	H	α-helix	trans	-67.9	-42.3	176.2	-175.6	0	0	0	0	112.9	K313 T319 M347	K313-S315 PolarHBondContact O-N 3.22Å; S315-T319 WeakPolarHBondContact O-CB 3.4Å; S315-T319 PolarHBondContact O-N 2.84Å; S315-T319 PolarHBondContact O-OG1 3.26Å; S315-M347 VanDerWaalsContact CA-CE 3.49Å
316	E	95.2	Very high	94.7	Very high	79 Å²	79	47.2 Å²	47.2	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-68.9	-44.7	176.9	-66.6	170.4	-125	0	0	109.3	L308 K313 T319 L320	L308-E316 HydrophobicContact CD1-CB 3.96Å; L308-E316 HydrophobicContact CD2-CB 4.01Å; L308-E316 HydrophobicContact CG-CB 4.5Å; K313-E316 HydrophobicContact CB-CB 4.37Å; K313-E316 WeakPolarHBondContact CD-OE1 3.49Å; K313-E316 WeakPolarHBondContact CE-OE1 3.32Å; K313-E316 VanDerWaalsContact NZ-CD 3.26Å; K313-E316 IonicContact NZ-OE1 2.67Å; K313-E316 PolarHBondContact NZ-OE1 2.98Å; K313-E316 IonicContact NZ-OE2 3.26Å; K313-E316 PolarHBondContact NZ-OE2 3.2Å; K313-E316 PolarHBondContact O-N 3.49Å; E316-T319 PolarHBondContact O-N 3.01Å; E316-L320 PolarHBondContact O-N 2.81Å
317	A	96.7	Very high	94.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59	-49.3	177.1	0	0	0	0	0	112.9	A305 L308 K309 K313 T319 L320 L321	A305-A317 HydrophobicContact CB-CB 4.4Å; L308-A317 HydrophobicContact CB-CB 3.93Å; K309-A317 HydrophobicContact CG-CB 4.08Å; K313-A317 PolarHBondContact O-N 2.82Å; K313-A317 VanDerWaalsContact O-N 3.13Å; A317-T319 VanDerWaalsContact C-N 3.32Å; A317-T319 PolarHBondContact O-N 3.22Å; A317-L320 PolarHBondContact O-N 2.89Å; A317-L321 VanDerWaalsContact O-CG 3.31Å; A317-L321 WeakPolarHBondContact O-CG 3.41Å; A317-L321 PolarHBondContact O-N 3.31Å
318	A	97.1	Very high	93.9	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.3	-44.6	176.9	0	0	0	0	0	111.8	Y314 L320 L321 I322 A340 C343 F344	Y314-A318 WeakPolarHBondContact O-CB 3.29Å; Y314-A318 PolarHBondContact O-N 2.82Å; A318-L320 VanDerWaalsContact C-N 3.33Å; A318-L320 PolarHBondContact O-N 2.86Å; A318-L321 PolarHBondContact O-N 3.34Å; A318-I322 WeakPolarHBondContact O-CD1 3.28Å; A318-I322 WeakPolarHBondContact O-CG1 3.48Å; A318-I322 PolarHBondContact O-N 2.97Å; A318-A340 HydrophobicContact CB-CB 4.39Å; A318-C343 HydrophobicContact CB-CB 3.73Å; A318-F344 HydrophobicContact CB-CE1 4.12Å; A318-F344 HydrophobicContact CB-CE2 4.08Å; A318-F344 HydrophobicContact CB-CZ 3.8Å
319	T	96.7	Very high	93.8	Very high	63 Å²	63	57.7 Å²	57.7	39%	0.387	31%	0.314	S	S	.	.	H	α-helix	trans	-63.1	-39.7	179.9	-56.8	0	0	0	0	111.6	S315 E316 A317 K323	S315-T319 WeakPolarHBondContact O-CB 3.4Å; S315-T319 PolarHBondContact O-N 2.84Å; S315-T319 PolarHBondContact O-OG1 3.26Å; E316-T319 PolarHBondContact O-N 3.01Å; A317-T319 VanDerWaalsContact C-N 3.32Å; A317-T319 PolarHBondContact O-N 3.22Å; T319-K323 HydrophobicContact CG2-CD 4.36Å; T319-K323 VanDerWaalsContact O-CG 3.27Å; T319-K323 WeakPolarHBondContact O-CG 3.33Å; T319-K323 PolarHBondContact O-N 2.94Å; T319-K323 VanDerWaalsContact O-N 3.14Å
320	L	96	Very high	93.8	Very high	14 Å²	14	57.7 Å²	57.7	7%	0.073	32%	0.316	C	S	.	.	H	α-helix	trans	-65.6	-48.2	176.7	-178.3	61.3	0	0	0	111.9	I284 A301 L308 E316 A317 A318 I322 K323 M324	I284-L320 HydrophobicContact CD1-CD1 3.94Å; I284-L320 HydrophobicContact CD1-CD2 4.1Å; A301-L320 HydrophobicContact CB-CD2 4.44Å; A301-L320 HydrophobicContact CB-CG 4.4Å; L308-L320 HydrophobicContact CD1-CD2 4.47Å; E316-L320 PolarHBondContact O-N 2.81Å; A317-L320 PolarHBondContact O-N 2.89Å; A318-L320 VanDerWaalsContact C-N 3.33Å; A318-L320 PolarHBondContact O-N 2.86Å; L320-I322 PolarHBondContact O-N 3.47Å; L320-K323 PolarHBondContact O-N 2.82Å; L320-M324 WeakPolarHBondContact O-CG 3.18Å; L320-M324 PolarHBondContact O-N 3.05Å
321	L	96.8	Very high	93.9	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-44	179.3	-67.5	167.7	0	0	0	111.6	L302 A305 A317 A318 M324 L336 Q339 A340	L302-L321 HydrophobicContact CD2-CD2 4.05Å; A305-L321 HydrophobicContact CB-CD1 4.3Å; A305-L321 HydrophobicContact CB-CD2 3.95Å; A305-L321 HydrophobicContact CB-CG 4.07Å; A317-L321 VanDerWaalsContact O-CG 3.31Å; A317-L321 WeakPolarHBondContact O-CG 3.41Å; A317-L321 PolarHBondContact O-N 3.31Å; A318-L321 PolarHBondContact O-N 3.34Å; L321-M324 PolarHBondContact O-N 3.07Å; L321-M324 VanDerWaalsContact O-N 3.15Å; L321-L336 HydrophobicContact CD2-CD2 3.62Å; L321-Q339 HydrophobicContact CD1-CB 3.82Å; L321-A340 HydrophobicContact CB-CB 4.09Å; L321-A340 HydrophobicContact CD1-CB 4.46Å
322	I	96.7	Very high	94	Very high	50 Å²	50	53.5 Å²	53.5	26%	0.256	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-42.6	177.3	-65.9	160.4	0	0	0	111.4	A318 L320 M324 T325 A340 F344 H358	A318-I322 WeakPolarHBondContact O-CD1 3.28Å; A318-I322 WeakPolarHBondContact O-CG1 3.48Å; A318-I322 PolarHBondContact O-N 2.97Å; L320-I322 PolarHBondContact O-N 3.47Å; I322-M324 PolarHBondContact O-N 3.45Å; I322-T325 WeakPolarHBondContact O-CB 3.44Å; I322-T325 WeakPolarHBondContact O-CG2 3.46Å; I322-T325 PolarHBondContact O-N 2.73Å; I322-T325 PolarHBondContact O-OG1 3.39Å; I322-A340 HydrophobicContact CD1-CB 4.1Å; I322-A340 HydrophobicContact CG1-CB 3.71Å; I322-F344 HydrophobicContact CD1-CE2 4.08Å; I322-F344 HydrophobicContact CD1-CZ 4.13Å; I322-H358 VanDerWaalsContact CD1-NE2 3.33Å; I322-H358 WeakPolarHBondContact CD1-NE2 3.41Å
323	K	94.6	Very high	94.2	Very high	137 Å²	137	50.1 Å²	50.1	60%	0.596	26%	0.259	S	S	*	.	H	α-helix	trans	-61.3	-23	176	-77.3	172	176.8	-179.9	0	113.6	R288 T319 L320 T325	R288-K323 PolarHBondContact NH1-O 2.81Å; T319-K323 HydrophobicContact CG2-CD 4.36Å; T319-K323 VanDerWaalsContact O-CG 3.27Å; T319-K323 WeakPolarHBondContact O-CG 3.33Å; T319-K323 PolarHBondContact O-N 2.94Å; T319-K323 VanDerWaalsContact O-N 3.14Å; L320-K323 PolarHBondContact O-N 2.82Å; K323-T325 VanDerWaalsContact C-N 3.35Å
324	M	93.3	Very high	94.4	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.02	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	4	177.2	-67.2	-60.3	-76.4	0	0	113.3	I284 A297 E298 A301 L320 L321 I322 R332 L336	I284-M324 HydrophobicContact CG2-CE 4Å; I284-M324 HydrophobicContact CG2-SD 3.69Å; A297-M324 HydrophobicContact CB-CE 3.79Å; E298-M324 HydrophobicContact CG-CE 4.33Å; A301-M324 HydrophobicContact CB-CE 4.14Å; A301-M324 HydrophobicContact CB-CG 3.81Å; A301-M324 HydrophobicContact CB-SD 4.48Å; L320-M324 WeakPolarHBondContact O-CG 3.18Å; L320-M324 PolarHBondContact O-N 3.05Å; L321-M324 PolarHBondContact O-N 3.07Å; L321-M324 VanDerWaalsContact O-N 3.15Å; I322-M324 PolarHBondContact O-N 3.45Å; M324-R332 PolarHBondContact O-NE 3.43Å; M324-R332 PolarHBondContact O-NH2 2.87Å; M324-L336 HydrophobicContact CB-CD1 3.78Å; M324-L336 VanDerWaalsContact O-CD1 3.24Å; M324-L336 WeakPolarHBondContact O-CD1 3.38Å
325	T	94.3	Very high	94.4	Very high	41 Å²	41	47.8 Å²	47.8	25%	0.252	25%	0.254	S	S	.	.			trans	-76.6	151.7	168	66.1	0	0	0	0	111.2	I322 K323 L336 L337	I322-T325 WeakPolarHBondContact O-CB 3.44Å; I322-T325 WeakPolarHBondContact O-CG2 3.46Å; I322-T325 PolarHBondContact O-N 2.73Å; I322-T325 PolarHBondContact O-OG1 3.39Å; K323-T325 VanDerWaalsContact C-N 3.35Å; T325-L336 HydrophobicContact CG2-CB 4.12Å; T325-L337 HydrophobicContact CG2-CD1 4.43Å; T325-L337 HydrophobicContact CG2-CD2 4.08Å; T325-L337 HydrophobicContact CG2-CG 3.81Å
326	S	89.9	Confident	94.4	Very high	18 Å²	18	44.7 Å²	44.7	13%	0.126	23%	0.231	C	C	.	.			trans	-155.2	167.5	-179.5	57.5	0	0	0	0	110.3	S333	S326-S333 PolarHBondContact N-OG 2.84Å; S326-S333 PolarHBondContact O-OG 2.87Å
327	E	85.4	Confident	94.5	Very high	141 Å²	141	41.5 Å²	41.5	66%	0.659	22%	0.216	S	C	*	.	S	Bend	trans	-85.1	-15.9	173.8	-53.3	-128.6	100.1	0	0	112.2	S329 R365	E327-S329 PolarHBondContact O-N 3.45Å; E327-R365 IonicContact OE1-CZ 3.32Å; E327-R365 IonicContact OE1-NH1 3.98Å; E327-R365 PolarHBondContact OE1-NH1 2.91Å; E327-R365 IonicContact OE1-NH2 2.61Å; E327-R365 PolarHBondContact OE1-NH2 2.88Å
328	D	86	Confident	94.6	Very high	147 Å²	147	41.9 Å²	41.9	79%	0.786	22%	0.218	S	C	*	.	S	Bend	trans	-66.1	-21.9	-177.3	-46.2	-42.2	0	0	0	113.3
329	S	92.3	Very high	94.6	Very high	48 Å²	48	45.3 Å²	45.3	34%	0.336	23%	0.234	S	C	.	.			trans	-148.5	101.5	176.2	-177.1	0	0	0	0	111.4	E327 L331 R332 S333	E327-S329 PolarHBondContact O-N 3.45Å; S329-L331 VanDerWaalsContact C-N 3.35Å; S329-L331 PolarHBondContact O-N 3.2Å; S329-R332 WeakPolarHBondContact OG-CB 3.2Å; S329-R332 PolarHBondContact OG-N 2.91Å; S329-S333 WeakPolarHBondContact O-CB 3.48Å; S329-S333 PolarHBondContact O-N 2.76Å; S329-S333 VanDerWaalsContact O-N 3.07Å; S329-S333 PolarHBondContact O-OG 3.03Å
330	D	94.9	Very high	94.7	Very high	38 Å²	38	42.3 Å²	42.3	20%	0.203	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-40.9	176.3	-83.1	-47.2	0	0	0	112.1	S333 A334 R365 K368 A369	D330-S333 PolarHBondContact O-N 2.85Å; D330-A334 WeakPolarHBondContact O-CB 3.43Å; D330-A334 PolarHBondContact O-N 3.19Å; D330-R365 WeakPolarHBondContact OD1-CD 3.38Å; D330-R365 IonicContact OD1-CZ 3.29Å; D330-R365 IonicContact OD1-NE 2.98Å; D330-R365 IonicContact OD1-NH1 2.72Å; D330-R365 PolarHBondContact OD1-NH1 2.81Å; D330-K368 HydrophobicContact CB-CB 4.1Å; D330-K368 VanDerWaalsContact OD2-CB 3.22Å; D330-K368 WeakPolarHBondContact OD2-CB 3.36Å; D330-K368 WeakPolarHBondContact OD2-CD 3.33Å; D330-A369 HydrophobicContact CB-CB 4.07Å
331	L	95.2	Very high	94.8	Very high	41 Å²	41	41.6 Å²	41.6	22%	0.215	21%	0.212	C	C	.	.	H	α-helix	trans	-64.2	-48.7	-177.9	177.7	59.2	0	0	0	112.2	L93 S329 A334 L335 F366 A369 Q371	L93-L331 HydrophobicContact CD2-CD2 4.13Å; S329-L331 VanDerWaalsContact C-N 3.35Å; S329-L331 PolarHBondContact O-N 3.2Å; L331-A334 WeakPolarHBondContact O-CB 3.27Å; L331-A334 PolarHBondContact O-N 3.11Å; L331-L335 HydrophobicContact CG-CD1 4.48Å; L331-L335 WeakPolarHBondContact O-CG 3.49Å; L331-L335 PolarHBondContact O-N 3.21Å; L331-L335 VanDerWaalsContact O-N 3.11Å; L331-F366 HydrophobicContact CD1-CD1 4.17Å; L331-F366 HydrophobicContact CD1-CE1 4.04Å; L331-A369 HydrophobicContact CB-CB 3.88Å; L331-Q371 HydrophobicContact CD1-CG 3.89Å
332	R	94	Very high	94.8	Very high	25 Å²	25	44.3 Å²	44.3	9%	0.094	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-47.5	176	173.9	-163.1	154.9	178.3	-8.7	110.8	M294 E298 M324 S329 A334 L335 L336	M294-R332 PolarHBondContact SD-NH1 3.34Å; M294-R332 PolarHBondContact SD-NH2 3.11Å; M294-R332 VanDerWaalsContact SD-NH2 3.42Å; E298-R332 VanDerWaalsContact CD-NH1 3.31Å; E298-R332 VanDerWaalsContact OE1-CD 3.32Å; E298-R332 WeakPolarHBondContact OE1-CD 3.48Å; E298-R332 IonicContact OE1-CZ 3.62Å; E298-R332 IonicContact OE1-NE 2.92Å; E298-R332 PolarHBondContact OE1-NE 2.98Å; E298-R332 IonicContact OE1-NH1 2.71Å; E298-R332 PolarHBondContact OE1-NH1 2.78Å; E298-R332 WeakPolarHBondContact OE2-CD 3.45Å; E298-R332 WeakPolarHBondContact OE2-CG 3.3Å; E298-R332 IonicContact OE2-CZ 3.89Å; E298-R332 IonicContact OE2-NE 3.67Å; E298-R332 PolarHBondContact OE2-NE 3.11Å; M324-R332 PolarHBondContact O-NE 3.43Å; M324-R332 PolarHBondContact O-NH2 2.87Å; S329-R332 WeakPolarHBondContact OG-CB 3.2Å; S329-R332 PolarHBondContact OG-N 2.91Å; R332-A334 VanDerWaalsContact C-N 3.26Å; R332-A334 PolarHBondContact O-N 3.4Å; R332-L335 PolarHBondContact O-N 2.96Å; R332-L336 HydrophobicContact CG-CD1 3.9Å; R332-L336 HydrophobicContact CG-CG 4.41Å; R332-L336 WeakPolarHBondContact O-CG 3.38Å; R332-L336 PolarHBondContact O-N 2.84Å
333	S	96.2	Very high	94.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.1	-37.7	178.8	-73.7	0	0	0	0	111.9	S326 S329 D330 L337	S326-S333 PolarHBondContact N-OG 2.84Å; S326-S333 PolarHBondContact O-OG 2.87Å; S329-S333 WeakPolarHBondContact O-CB 3.48Å; S329-S333 PolarHBondContact O-N 2.76Å; S329-S333 VanDerWaalsContact O-N 3.07Å; S329-S333 PolarHBondContact O-OG 3.03Å; D330-S333 PolarHBondContact O-N 2.85Å; S333-L337 WeakPolarHBondContact O-CB 3.42Å; S333-L337 WeakPolarHBondContact O-CD1 3.34Å; S333-L337 WeakPolarHBondContact O-CG 3.43Å; S333-L337 PolarHBondContact O-N 2.9Å
334	A	97.4	Very high	95	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.7	-48.6	174.4	0	0	0	0	0	112.5	D330 L331 R332 L336 L337 E338 A362 R365 F366	D330-A334 WeakPolarHBondContact O-CB 3.43Å; D330-A334 PolarHBondContact O-N 3.19Å; L331-A334 WeakPolarHBondContact O-CB 3.27Å; L331-A334 PolarHBondContact O-N 3.11Å; R332-A334 VanDerWaalsContact C-N 3.26Å; R332-A334 PolarHBondContact O-N 3.4Å; A334-L336 PolarHBondContact O-N 3.46Å; A334-L337 PolarHBondContact O-N 2.83Å; A334-E338 PolarHBondContact O-N 3.21Å; A334-A362 WeakPolarHBondContact O-CB 3.45Å; A334-R365 HydrophobicContact CB-CB 3.66Å; A334-F366 HydrophobicContact CB-CB 4.29Å; A334-F366 HydrophobicContact CB-CD1 3.46Å; A334-F366 VanDerWaalsContact CB-CD1 3.46Å; A334-F366 HydrophobicContact CB-CD2 3.75Å; A334-F366 HydrophobicContact CB-CE1 3.59Å; A334-F366 HydrophobicContact CB-CE2 3.86Å; A334-F366 HydrophobicContact CB-CG 3.54Å; A334-F366 HydrophobicContact CB-CZ 3.79Å
335	L	96.4	Very high	95.2	Very high	80 Å²	80	38.3 Å²	38.3	42%	0.419	20%	0.199	S	C	.	.	H	α-helix	trans	-59.4	-46.1	177.4	-70.1	166.6	0	0	0	111.9	L331 R332 L337 E338 Q339 F366	L331-L335 HydrophobicContact CG-CD1 4.48Å; L331-L335 WeakPolarHBondContact O-CG 3.49Å; L331-L335 PolarHBondContact O-N 3.21Å; L331-L335 VanDerWaalsContact O-N 3.11Å; R332-L335 PolarHBondContact O-N 2.96Å; L335-L337 PolarHBondContact O-N 3.06Å; L335-E338 PolarHBondContact O-N 2.83Å; L335-Q339 WeakPolarHBondContact O-CG 3.31Å; L335-Q339 PolarHBondContact O-N 3.28Å; L335-F366 HydrophobicContact CD2-CE1 4.2Å; L335-F366 HydrophobicContact CD2-CZ 4.04Å; L335-F366 HydrophobicContact CG-CE1 4.28Å; L335-F366 HydrophobicContact CG-CZ 4.35Å
336	L	97	Very high	95.3	Very high	10 Å²	10	40.7 Å²	40.7	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-65.2	-38	178.7	-66.9	173.6	0	0	0	112.3	L302 L321 M324 T325 R332 A334 A340	L302-L336 HydrophobicContact CD2-CD2 3.92Å; L321-L336 HydrophobicContact CD2-CD2 3.62Å; M324-L336 HydrophobicContact CB-CD1 3.78Å; M324-L336 VanDerWaalsContact O-CD1 3.24Å; M324-L336 WeakPolarHBondContact O-CD1 3.38Å; T325-L336 HydrophobicContact CG2-CB 4.12Å; R332-L336 HydrophobicContact CG-CD1 3.9Å; R332-L336 HydrophobicContact CG-CG 4.41Å; R332-L336 WeakPolarHBondContact O-CG 3.38Å; R332-L336 PolarHBondContact O-N 2.84Å; A334-L336 PolarHBondContact O-N 3.46Å; L336-A340 WeakPolarHBondContact O-CB 3.46Å; L336-A340 PolarHBondContact O-N 2.96Å
337	L	98.1	Very high	95.6	Very high	12 Å²	12	41 Å²	41	6%	0.063	21%	0.21	C	C	.	.	H	α-helix	trans	-67.7	-40.5	175.3	-73.9	166.1	0	0	0	112.5	T325 S333 A334 L335 A340 A341 L361 A362 R365	T325-L337 HydrophobicContact CG2-CD1 4.43Å; T325-L337 HydrophobicContact CG2-CD2 4.08Å; T325-L337 HydrophobicContact CG2-CG 3.81Å; S333-L337 WeakPolarHBondContact O-CB 3.42Å; S333-L337 WeakPolarHBondContact O-CD1 3.34Å; S333-L337 WeakPolarHBondContact O-CG 3.43Å; S333-L337 PolarHBondContact O-N 2.9Å; A334-L337 PolarHBondContact O-N 2.83Å; L335-L337 PolarHBondContact O-N 3.06Å; L337-A340 PolarHBondContact O-N 3.01Å; L337-A341 WeakPolarHBondContact O-CB 3.28Å; L337-A341 PolarHBondContact O-N 3.38Å; L337-L361 HydrophobicContact CD1-CB 3.93Å; L337-L361 HydrophobicContact CD2-CB 4.46Å; L337-A362 HydrophobicContact CB-CB 3.81Å; L337-R365 HydrophobicContact CD1-CG 4.06Å
338	E	97.8	Very high	95.9	Very high	8 Å²	8	46 Å²	46	4%	0.037	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-44.3	175.1	-178.1	169.1	-138.5	0	0	111	A334 L335 A340 A341 H342 M359 A362 F366 R377	A334-E338 PolarHBondContact O-N 3.21Å; L335-E338 PolarHBondContact O-N 2.83Å; E338-A340 VanDerWaalsContact C-N 3.34Å; E338-A340 PolarHBondContact O-N 3Å; E338-A341 WeakPolarHBondContact O-CB 3.33Å; E338-A341 PolarHBondContact O-N 3.3Å; E338-H342 PolarHBondContact O-CD2 2.98Å; E338-H342 PolarHBondContact O-N 2.84Å; E338-M359 HydrophobicContact CG-CE 4Å; E338-M359 HydrophobicContact CG-SD 4.11Å; E338-A362 HydrophobicContact CB-CB 4.07Å; E338-F366 HydrophobicContact CB-CE2 4.46Å; E338-R377 IonicContact OE1-CZ 3.75Å; E338-R377 IonicContact OE1-NE 3.27Å; E338-R377 PolarHBondContact OE1-NE 3.03Å; E338-R377 IonicContact OE1-NH2 2.91Å; E338-R377 PolarHBondContact OE1-NH2 2.78Å; E338-R377 IonicContact OE2-NH2 3.78Å; E338-R377 PolarHBondContact OE2-NH2 2.8Å
339	Q	97.4	Very high	96.2	Very high	72 Å²	72	45.1 Å²	45.1	34%	0.336	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-35.8	174.6	-66.8	-54.2	-52	0	0	112.6	L321 L335 H342 C343	L321-Q339 HydrophobicContact CD1-CB 3.82Å; L335-Q339 WeakPolarHBondContact O-CG 3.31Å; L335-Q339 PolarHBondContact O-N 3.28Å; Q339-H342 PolarHBondContact O-N 3.27Å; Q339-C343 PolarHBondContact O-N 3.18Å; Q339-C343 PolarHBondContact O-SG 2.88Å
340	A	98.1	Very high	96.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-38	172.3	0	0	0	0	0	112.1	A318 L321 I322 L336 L337 E338 C343 F344	A318-A340 HydrophobicContact CB-CB 4.39Å; L321-A340 HydrophobicContact CB-CB 4.09Å; L321-A340 HydrophobicContact CD1-CB 4.46Å; I322-A340 HydrophobicContact CD1-CB 4.1Å; I322-A340 HydrophobicContact CG1-CB 3.71Å; L336-A340 WeakPolarHBondContact O-CB 3.46Å; L336-A340 PolarHBondContact O-N 2.96Å; L337-A340 PolarHBondContact O-N 3.01Å; E338-A340 VanDerWaalsContact C-N 3.34Å; E338-A340 PolarHBondContact O-N 3Å; A340-C343 WeakPolarHBondContact O-CB 3.44Å; A340-C343 PolarHBondContact O-N 2.8Å; A340-F344 WeakPolarHBondContact O-CD2 3.36Å; A340-F344 PolarHBondContact O-N 2.62Å
341	A	98.1	Very high	96.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.6	-50.2	172	0	0	0	0	0	110.7	L337 E338 C343 F344 I345 F355 H358 M359	L337-A341 WeakPolarHBondContact O-CB 3.28Å; L337-A341 PolarHBondContact O-N 3.38Å; E338-A341 WeakPolarHBondContact O-CB 3.33Å; E338-A341 PolarHBondContact O-N 3.3Å; A341-C343 PolarHBondContact O-N 3.33Å; A341-F344 WeakPolarHBondContact O-CA 3.19Å; A341-F344 WeakPolarHBondContact O-CB 3.26Å; A341-F344 PolarHBondContact O-N 3.38Å; A341-I345 PolarHBondContact O-N 2.87Å; A341-F355 HydrophobicContact CB-CD2 3.84Å; A341-F355 HydrophobicContact CB-CE2 4.29Å; A341-F355 WeakPolarHBondContact O-CD2 3.31Å; A341-H358 HydrophobicContact CB-CB 3.74Å; A341-M359 HydrophobicContact CB-CG 3.88Å; A341-M359 HydrophobicContact CB-SD 3.43Å; A341-M359 WeakPolarHBondContact CB-SD 3.25Å
342	H	97.5	Very high	96.4	Very high	59 Å²	59	49.2 Å²	49.2	27%	0.273	24%	0.241	S	C	.	.	H	α-helix	trans	-61.8	-25.1	176.2	-73.5	-62.7	0	0	0	113.6	E338 Q339 I345 N346	E338-H342 PolarHBondContact O-CD2 2.98Å; E338-H342 PolarHBondContact O-N 2.84Å; Q339-H342 PolarHBondContact O-N 3.27Å; H342-I345 WeakPolarHBondContact O-CG2 3.34Å; H342-N346 PolarHBondContact O-N 2.81Å; H342-N346 PolarHBondContact O-ND2 3.35Å
343	C	97.8	Very high	96.4	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.007	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-41.2	168.5	-66.4	0	0	0	0	111.9	Y314 A318 Q339 A340 A341 I345 N346 M347	Y314-C343 WeakPolarHBondContact CB-O 3.36Å; Y314-C343 HydrophobicContact CD1-CB 4.38Å; Y314-C343 WeakPolarHBondContact O-CB 3.5Å; A318-C343 HydrophobicContact CB-CB 3.73Å; Q339-C343 PolarHBondContact O-N 3.18Å; Q339-C343 PolarHBondContact O-SG 2.88Å; A340-C343 WeakPolarHBondContact O-CB 3.44Å; A340-C343 PolarHBondContact O-N 2.8Å; A341-C343 PolarHBondContact O-N 3.33Å; C343-I345 PolarHBondContact O-N 3.33Å; C343-N346 PolarHBondContact O-N 2.96Å; C343-M347 WeakPolarHBondContact O-CG 3.33Å; C343-M347 PolarHBondContact O-N 2.96Å
344	F	98.1	Very high	96.4	Very high	13 Å²	13	60.4 Å²	60.4	6%	0.057	29%	0.286	C	S	.	.	H	α-helix	trans	-64.2	-35	179.2	-71.3	-60	0	0	0	114.3	A318 I322 A340 A341 M347 M351 K354 F355 H358	A318-F344 HydrophobicContact CB-CE1 4.12Å; A318-F344 HydrophobicContact CB-CE2 4.08Å; A318-F344 HydrophobicContact CB-CZ 3.8Å; I322-F344 HydrophobicContact CD1-CE2 4.08Å; I322-F344 HydrophobicContact CD1-CZ 4.13Å; A340-F344 WeakPolarHBondContact O-CD2 3.36Å; A340-F344 PolarHBondContact O-N 2.62Å; A341-F344 WeakPolarHBondContact O-CA 3.19Å; A341-F344 WeakPolarHBondContact O-CB 3.26Å; A341-F344 PolarHBondContact O-N 3.38Å; F344-M347 HydrophobicContact CD1-CE 3.34Å; F344-M347 HydrophobicContact CD1-SD 3.98Å; F344-M347 HydrophobicContact CE1-CE 3.69Å; F344-M347 HydrophobicContact CG-CE 4.3Å; F344-M351 HydrophobicContact CB-CB 4.18Å; F344-M351 HydrophobicContact CD1-CB 4.3Å; F344-M351 HydrophobicContact CD1-SD 4.29Å; F344-M351 PolarHBondContact O-N 2.77Å; F344-K354 HydrophobicContact CB-CB 4.05Å; F344-K354 HydrophobicContact CD1-CB 3.79Å; F344-K354 HydrophobicContact CD1-CD 3.64Å; F344-K354 HydrophobicContact CD1-CG 4.39Å; F344-K354 HydrophobicContact CD2-CB 3.85Å; F344-K354 HydrophobicContact CE1-CB 4.25Å; F344-K354 HydrophobicContact CE1-CD 3.46Å; F344-K354 VanDerWaalsContact CE1-CD 3.46Å; F344-K354 HydrophobicContact CE2-CB 4.28Å; F344-K354 HydrophobicContact CG-CB 3.61Å; F344-K354 HydrophobicContact CG-CD 4.32Å; F344-K354 HydrophobicContact CZ-CB 4.47Å; F344-K354 HydrophobicContact CZ-CD 3.96Å; F344-F355 HydrophobicContact CB-CB 4.34Å; F344-H358 AromaticContact CD2-ND1 3.77Å; F344-H358 AromaticContact CE2-CE1 3.37Å; F344-H358 WeakPolarHBondContact CE2-CE1 3.47Å; F344-H358 AromaticContact CE2-CG 3.89Å; F344-H358 AromaticContact CE2-ND1 3.44Å; F344-H358 WeakPolarHBondContact CE2-ND1 3.42Å; F344-H358 AromaticContact CE2-NE2 3.77Å; F344-H358 AromaticContact CZ-CE1 3.97Å
345	I	96.8	Very high	96.4	Very high	51 Å²	51	61.3 Å²	61.3	26%	0.262	29%	0.29	S	S	.	.	H	α-helix	trans	-75.6	-31.5	178.1	-162.8	69.1	0	0	0	112.4	A341 H342 C343 M347 P350 V352 F355	A341-I345 PolarHBondContact O-N 2.87Å; H342-I345 WeakPolarHBondContact O-CG2 3.34Å; C343-I345 PolarHBondContact O-N 3.33Å; I345-M347 VanDerWaalsContact C-N 3.33Å; I345-M347 PolarHBondContact O-N 2.82Å; I345-P350 HydrophobicContact CD1-CB 4.25Å; I345-P350 WeakPolarHBondContact O-CB 3.42Å; I345-V352 HydrophobicContact CD1-CB 4.46Å; I345-V352 HydrophobicContact CD1-CG1 3.44Å; I345-V352 VanDerWaalsContact CD1-CG1 3.44Å; I345-F355 HydrophobicContact CB-CB 4.26Å; I345-F355 HydrophobicContact CB-CD2 4.04Å; I345-F355 HydrophobicContact CB-CG 4.2Å; I345-F355 HydrophobicContact CG2-CD2 4.2Å
346	N	96.3	Very high	96.4	Very high	91 Å²	91	57.5 Å²	57.5	49%	0.487	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	2.7	179.9	-70.8	-51.8	0	0	0	114.4	Y314 H342 C343	Y314-N346 HydrophobicContact CD1-CB 3.92Å; Y314-N346 HydrophobicContact CD2-CB 4.46Å; Y314-N346 VanDerWaalsContact CD2-O 3.28Å; Y314-N346 WeakPolarHBondContact CD2-O 3.4Å; Y314-N346 HydrophobicContact CE1-CB 3.65Å; Y314-N346 HydrophobicContact CE2-CB 4.21Å; Y314-N346 WeakPolarHBondContact CE2-O 3.45Å; Y314-N346 HydrophobicContact CG-CB 4.33Å; H342-N346 PolarHBondContact O-N 2.81Å; H342-N346 PolarHBondContact O-ND2 3.35Å; C343-N346 PolarHBondContact O-N 2.96Å
347	M	95.8	Very high	96.4	Very high	25 Å²	25	62.3 Å²	62.3	12%	0.123	29%	0.291	C	S	.	.	S	Bend	trans	-62.2	148	171.9	-67.6	-173.9	177.5	0	0	111.4	S315 C343 F344 I345 N349 P350 M351	S315-M347 VanDerWaalsContact CA-CE 3.49Å; C343-M347 WeakPolarHBondContact O-CG 3.33Å; C343-M347 PolarHBondContact O-N 2.96Å; F344-M347 HydrophobicContact CD1-CE 3.34Å; F344-M347 HydrophobicContact CD1-SD 3.98Å; F344-M347 HydrophobicContact CE1-CE 3.69Å; F344-M347 HydrophobicContact CG-CE 4.3Å; I345-M347 VanDerWaalsContact C-N 3.33Å; I345-M347 PolarHBondContact O-N 2.82Å; M347-N349 CarbonylContact O-C 3.57Å; M347-N349 PolarHBondContact O-N 3.29Å; M347-P350 WeakPolarHBondContact O-CD 3.35Å; M347-M351 HydrophobicContact SD-CB 4.49Å; M347-M351 HydrophobicContact SD-CG 3.74Å; M347-M351 HydrophobicContact SD-SD 3.73Å
348	R	92.6	Very high	96.4	Very high	244 Å²	244	62.7 Å²	62.7	92%	0.921	29%	0.292	S	S	*	.	S	Bend	trans	-46.8	-36.9	174.9	-178.9	177.7	178.4	176.6	1.5	113.3
349	N	93.5	Very high	96.4	Very high	130 Å²	130	62.3 Å²	62.3	70%	0.695	29%	0.291	S	S	*	.	S	Bend	trans	-112.5	100.8	166	-64.8	-8.2	0	0	0	107.6	M347 M351	M347-N349 CarbonylContact O-C 3.57Å; M347-N349 PolarHBondContact O-N 3.29Å; N349-M351 PolarHBondContact O-N 3.27Å
350	P	94.9	Very high	96.4	Very high	78 Å²	78	60 Å²	60	51%	0.506	28%	0.28	S	S	.	.			trans	-57.8	118.9	-173	-30.7	37.7	0	0	0	113.6	I345 M347 V352	I345-P350 HydrophobicContact CD1-CB 4.25Å; I345-P350 WeakPolarHBondContact O-CB 3.42Å; M347-P350 WeakPolarHBondContact O-CD 3.35Å; P350-V352 VanDerWaalsContact C-N 3.28Å; P350-V352 PolarHBondContact O-N 2.58Å
351	M	96.1	Very high	96.4	Very high	75 Å²	75	62.9 Å²	62.9	37%	0.369	30%	0.295	S	S	.	.			trans	-88.2	60.7	-179.2	-59.3	-161	84.8	0	0	111.3	F344 M347 N349 R353 K354 F355	F344-M351 HydrophobicContact CB-CB 4.18Å; F344-M351 HydrophobicContact CD1-CB 4.3Å; F344-M351 HydrophobicContact CD1-SD 4.29Å; F344-M351 PolarHBondContact O-N 2.77Å; M347-M351 HydrophobicContact SD-CB 4.49Å; M347-M351 HydrophobicContact SD-CG 3.74Å; M347-M351 HydrophobicContact SD-SD 3.73Å; N349-M351 PolarHBondContact O-N 3.27Å; M351-R353 VanDerWaalsContact C-N 3.26Å; M351-R353 PolarHBondContact O-N 3.02Å; M351-R353 VanDerWaalsContact O-N 3.07Å; M351-K354 HydrophobicContact CB-CB 4.05Å; M351-K354 HydrophobicContact CB-CD 4.4Å; M351-K354 HydrophobicContact CB-CG 4.34Å; M351-K354 HydrophobicContact CE-CD 3.87Å; M351-K354 HydrophobicContact CE-CG 4.37Å; M351-K354 WeakPolarHBondContact O-CA 3.4Å; M351-K354 WeakPolarHBondContact O-CB 3.42Å; M351-K354 PolarHBondContact O-N 2.97Å; M351-K354 HydrophobicContact SD-CD 3.77Å; M351-F355 PolarHBondContact O-N 3.23Å
352	V	95.3	Very high	96.4	Very high	60 Å²	60	62.9 Å²	62.9	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-46.2	-40.2	-175.4	-80	0	0	0	0	115	I345 P350 F355 A356 V385	I345-V352 HydrophobicContact CD1-CB 4.46Å; I345-V352 HydrophobicContact CD1-CG1 3.44Å; I345-V352 VanDerWaalsContact CD1-CG1 3.44Å; P350-V352 VanDerWaalsContact C-N 3.28Å; P350-V352 PolarHBondContact O-N 2.58Å; V352-F355 WeakPolarHBondContact O-CB 3.31Å; V352-F355 PolarHBondContact O-N 2.86Å; V352-A356 PolarHBondContact O-N 3.3Å; V352-V385 HydrophobicContact CB-CG1 4.24Å
353	R	93.9	Very high	96.4	Very high	162 Å²	162	60.1 Å²	60.1	61%	0.611	28%	0.282	S	S	*	.	H	α-helix	trans	-68.5	-37.8	176.6	-68.1	-175.7	-175.8	154	1.7	112.8	M351 F357	M351-R353 VanDerWaalsContact C-N 3.26Å; M351-R353 PolarHBondContact O-N 3.02Å; M351-R353 VanDerWaalsContact O-N 3.07Å; R353-F357 WeakPolarHBondContact O-CB 3.44Å; R353-F357 PolarHBondContact O-N 3.06Å
354	K	95.8	Very high	96.3	Very high	97 Å²	97	64 Å²	64	42%	0.422	30%	0.3	S	S	.	.	H	α-helix	trans	-69.1	-39.1	173.9	-72	-166.6	-178.5	175.5	0	111.1	F344 M351 H358	F344-K354 HydrophobicContact CB-CB 4.05Å; F344-K354 HydrophobicContact CD1-CB 3.79Å; F344-K354 HydrophobicContact CD1-CD 3.64Å; F344-K354 HydrophobicContact CD1-CG 4.39Å; F344-K354 HydrophobicContact CD2-CB 3.85Å; F344-K354 HydrophobicContact CE1-CB 4.25Å; F344-K354 HydrophobicContact CE1-CD 3.46Å; F344-K354 VanDerWaalsContact CE1-CD 3.46Å; F344-K354 HydrophobicContact CE2-CB 4.28Å; F344-K354 HydrophobicContact CG-CB 3.61Å; F344-K354 HydrophobicContact CG-CD 4.32Å; F344-K354 HydrophobicContact CZ-CB 4.47Å; F344-K354 HydrophobicContact CZ-CD 3.96Å; M351-K354 HydrophobicContact CB-CB 4.05Å; M351-K354 HydrophobicContact CB-CD 4.4Å; M351-K354 HydrophobicContact CB-CG 4.34Å; M351-K354 HydrophobicContact CE-CD 3.87Å; M351-K354 HydrophobicContact CE-CG 4.37Å; M351-K354 WeakPolarHBondContact O-CA 3.4Å; M351-K354 WeakPolarHBondContact O-CB 3.42Å; M351-K354 PolarHBondContact O-N 2.97Å; M351-K354 HydrophobicContact SD-CD 3.77Å; K354-H358 PolarHBondContact O-N 2.91Å; K354-H358 PolarHBondContact O-ND1 3.06Å
355	F	97.9	Very high	96.3	Very high	20 Å²	20	65.4 Å²	65.4	9%	0.088	31%	0.305	C	S	.	.	H	α-helix	trans	-53.5	-59.6	170	163.7	-96.1	0	0	0	110.2	A341 F344 I345 M351 V352 F357 H358 M359 Q381 V385	A341-F355 HydrophobicContact CB-CD2 3.84Å; A341-F355 HydrophobicContact CB-CE2 4.29Å; A341-F355 WeakPolarHBondContact O-CD2 3.31Å; F344-F355 HydrophobicContact CB-CB 4.34Å; I345-F355 HydrophobicContact CB-CB 4.26Å; I345-F355 HydrophobicContact CB-CD2 4.04Å; I345-F355 HydrophobicContact CB-CG 4.2Å; I345-F355 HydrophobicContact CG2-CD2 4.2Å; M351-F355 PolarHBondContact O-N 3.23Å; V352-F355 WeakPolarHBondContact O-CB 3.31Å; V352-F355 PolarHBondContact O-N 2.86Å; F355-F357 VanDerWaalsContact C-N 3.33Å; F355-F357 PolarHBondContact O-N 3.39Å; F355-H358 PolarHBondContact O-N 3.49Å; F355-H358 VanDerWaalsContact O-N 3.1Å; F355-M359 HydrophobicContact CD1-CG 4.35Å; F355-M359 HydrophobicContact CD2-CG 4.03Å; F355-M359 HydrophobicContact CD2-SD 4.37Å; F355-M359 HydrophobicContact CE1-CG 3.97Å; F355-M359 HydrophobicContact CE2-CG 3.61Å; F355-M359 HydrophobicContact CE2-SD 3.74Å; F355-M359 HydrophobicContact CG-CG 4.37Å; F355-M359 HydrophobicContact CZ-CG 3.58Å; F355-M359 HydrophobicContact CZ-SD 4.1Å; F355-M359 WeakPolarHBondContact O-CG 3.19Å; F355-M359 PolarHBondContact O-N 2.89Å; F355-Q381 HydrophobicContact CZ-CB 4.23Å; F355-V385 HydrophobicContact CD1-CG2 4.21Å; F355-V385 HydrophobicContact CE1-CG2 4.41Å
356	A	96.8	Very high	96.3	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.1	-39	-176.7	0	0	0	0	0	113.3	V352 M359 I360 A382 V385 Y386	V352-A356 PolarHBondContact O-N 3.3Å; A356-M359 PolarHBondContact O-N 3.49Å; A356-I360 WeakPolarHBondContact O-CG1 3.39Å; A356-I360 PolarHBondContact O-N 2.85Å; A356-A382 HydrophobicContact CB-CB 4.27Å; A356-V385 HydrophobicContact CB-CB 3.71Å; A356-V385 HydrophobicContact CB-CG1 3.85Å; A356-V385 HydrophobicContact CB-CG2 3.95Å; A356-Y386 HydrophobicContact CB-CD2 4.22Å; A356-Y386 HydrophobicContact CB-CE2 3.56Å
357	F	96.6	Very high	96.3	Very high	110 Å²	110	60.7 Å²	60.7	48%	0.482	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-45.2	174.5	-179.9	-103.1	0	0	0	112.7	R353 F355 I360 L361	R353-F357 WeakPolarHBondContact O-CB 3.44Å; R353-F357 PolarHBondContact O-N 3.06Å; F355-F357 VanDerWaalsContact C-N 3.33Å; F355-F357 PolarHBondContact O-N 3.39Å; F357-I360 PolarHBondContact O-N 2.84Å; F357-L361 HydrophobicContact CD1-CD1 3.99Å; F357-L361 HydrophobicContact CE1-CD1 3.49Å; F357-L361 VanDerWaalsContact CE1-CD1 3.49Å; F357-L361 HydrophobicContact CE1-CG 4.34Å; F357-L361 HydrophobicContact CZ-CD1 3.89Å; F357-L361 HydrophobicContact CZ-CG 4.42Å; F357-L361 WeakPolarHBondContact O-CG 3.36Å; F357-L361 PolarHBondContact O-N 3.41Å; F357-L361 VanDerWaalsContact O-N 3.12Å
358	H	97.7	Very high	96.2	Very high	21 Å²	21	65 Å²	65	10%	0.097	30%	0.302	C	S	.	.	H	α-helix	trans	-73.1	-30	178.4	-69.1	79.1	0	0	0	112.3	I322 A341 F344 K354 F355 L361 A362	I322-H358 VanDerWaalsContact CD1-NE2 3.33Å; I322-H358 WeakPolarHBondContact CD1-NE2 3.41Å; A341-H358 HydrophobicContact CB-CB 3.74Å; F344-H358 AromaticContact CD2-ND1 3.77Å; F344-H358 AromaticContact CE2-CE1 3.37Å; F344-H358 WeakPolarHBondContact CE2-CE1 3.47Å; F344-H358 AromaticContact CE2-CG 3.89Å; F344-H358 AromaticContact CE2-ND1 3.44Å; F344-H358 WeakPolarHBondContact CE2-ND1 3.42Å; F344-H358 AromaticContact CE2-NE2 3.77Å; F344-H358 AromaticContact CZ-CE1 3.97Å; K354-H358 PolarHBondContact O-N 2.91Å; K354-H358 PolarHBondContact O-ND1 3.06Å; F355-H358 PolarHBondContact O-N 3.49Å; F355-H358 VanDerWaalsContact O-N 3.1Å; H358-L361 PolarHBondContact O-N 3.46Å; H358-A362 WeakPolarHBondContact O-CB 3.21Å; H358-A362 PolarHBondContact O-N 3.17Å
359	M	98	Very high	96.3	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-42.1	168.7	-66.5	-51.6	-59.8	0	0	111.7	E338 A341 F355 A356 A362 G363 C378 Q381 A382	E338-M359 HydrophobicContact CG-CE 4Å; E338-M359 HydrophobicContact CG-SD 4.11Å; A341-M359 HydrophobicContact CB-CG 3.88Å; A341-M359 HydrophobicContact CB-SD 3.43Å; A341-M359 WeakPolarHBondContact CB-SD 3.25Å; F355-M359 HydrophobicContact CD1-CG 4.35Å; F355-M359 HydrophobicContact CD2-CG 4.03Å; F355-M359 HydrophobicContact CD2-SD 4.37Å; F355-M359 HydrophobicContact CE1-CG 3.97Å; F355-M359 HydrophobicContact CE2-CG 3.61Å; F355-M359 HydrophobicContact CE2-SD 3.74Å; F355-M359 HydrophobicContact CG-CG 4.37Å; F355-M359 HydrophobicContact CZ-CG 3.58Å; F355-M359 HydrophobicContact CZ-SD 4.1Å; F355-M359 WeakPolarHBondContact O-CG 3.19Å; F355-M359 PolarHBondContact O-N 2.89Å; A356-M359 PolarHBondContact O-N 3.49Å; M359-A362 PolarHBondContact O-N 3.35Å; M359-G363 PolarHBondContact O-N 3.35Å; M359-C378 HydrophobicContact CE-CB 3.8Å; M359-C378 VanDerWaalsContact CE-SG 3.55Å; M359-C378 WeakPolarHBondContact O-CB 3.21Å; M359-Q381 HydrophobicContact CE-CB 4.46Å; M359-Q381 VanDerWaalsContact CE-OE1 3.25Å; M359-A382 HydrophobicContact CB-CB 4.35Å
360	I	97.6	Very high	96.4	Very high	24 Å²	24	50.5 Å²	50.5	12%	0.123	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-46.2	174.4	-70.6	161.3	0	0	0	111	A356 F357 A362 G363 H364 Y379 A382 Y386 I398	A356-I360 WeakPolarHBondContact O-CG1 3.39Å; A356-I360 PolarHBondContact O-N 2.85Å; F357-I360 PolarHBondContact O-N 2.84Å; I360-A362 PolarHBondContact O-N 3.15Å; I360-G363 PolarHBondContact O-N 3.44Å; I360-H364 PolarHBondContact O-N 3.11Å; I360-Y379 HydrophobicContact CB-CE1 4.4Å; I360-Y379 HydrophobicContact CG1-CD1 4.36Å; I360-Y379 HydrophobicContact CG1-CE1 4.34Å; I360-Y379 HydrophobicContact CG2-CE1 3.95Å; I360-A382 HydrophobicContact CD1-CB 4.14Å; I360-A382 HydrophobicContact CG1-CB 3.69Å; I360-Y386 HydrophobicContact CD1-CE2 3.87Å; I360-I398 HydrophobicContact CD1-CD1 3.98Å; I360-I398 HydrophobicContact CD1-CG1 4.09Å; I360-I398 HydrophobicContact CG1-CG1 4.32Å
361	L	97.2	Very high	96.4	Very high	60 Å²	60	49.1 Å²	49.1	31%	0.314	24%	0.243	S	C	.	.	H	α-helix	trans	-64	-41.1	177.9	-64	173.7	0	0	0	112.3	L337 F357 H358 H364 R365	L337-L361 HydrophobicContact CD1-CB 3.93Å; L337-L361 HydrophobicContact CD2-CB 4.46Å; F357-L361 HydrophobicContact CD1-CD1 3.99Å; F357-L361 HydrophobicContact CE1-CD1 3.49Å; F357-L361 VanDerWaalsContact CE1-CD1 3.49Å; F357-L361 HydrophobicContact CE1-CG 4.34Å; F357-L361 HydrophobicContact CZ-CD1 3.89Å; F357-L361 HydrophobicContact CZ-CG 4.42Å; F357-L361 WeakPolarHBondContact O-CG 3.36Å; F357-L361 PolarHBondContact O-N 3.41Å; F357-L361 VanDerWaalsContact O-N 3.12Å; H358-L361 PolarHBondContact O-N 3.46Å; L361-H364 PolarHBondContact O-N 3.43Å; L361-R365 WeakPolarHBondContact O-CG 3.32Å; L361-R365 PolarHBondContact O-N 3.29Å
362	A	98.1	Very high	96.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-45.8	172.9	0	0	0	0	0	110.9	A334 L337 E338 H358 M359 I360 H364 R365 F366	A334-A362 WeakPolarHBondContact O-CB 3.45Å; L337-A362 HydrophobicContact CB-CB 3.81Å; E338-A362 HydrophobicContact CB-CB 4.07Å; H358-A362 WeakPolarHBondContact O-CB 3.21Å; H358-A362 PolarHBondContact O-N 3.17Å; M359-A362 PolarHBondContact O-N 3.35Å; I360-A362 PolarHBondContact O-N 3.15Å; A362-H364 PolarHBondContact O-N 2.82Å; A362-R365 PolarHBondContact O-N 2.97Å; A362-F366 HydrophobicContact CB-CD2 4.41Å; A362-F366 HydrophobicContact CB-CE2 4.3Å; A362-F366 WeakPolarHBondContact O-CB 3.43Å; A362-F366 WeakPolarHBondContact O-CD2 3.44Å; A362-F366 PolarHBondContact O-N 2.86Å
363	G	97.4	Very high	96.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-40.2	178.4	0	0	0	0	0	113.4	M359 I360 S367 A375	M359-G363 PolarHBondContact O-N 3.35Å; I360-G363 PolarHBondContact O-N 3.44Å; G363-S367 WeakPolarHBondContact O-CB 3.35Å; G363-S367 PolarHBondContact O-N 3.32Å; G363-A375 VanDerWaalsContact O-CB 3.25Å; G363-A375 WeakPolarHBondContact O-CB 3.36Å
364	H	96.6	Very high	96.5	Very high	83 Å²	83	53 Å²	53	38%	0.384	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-47.4	172.2	173.8	-120.9	0	0	0	112.1	I360 L361 A362 S367 K368 Y379	I360-H364 PolarHBondContact O-N 3.11Å; L361-H364 PolarHBondContact O-N 3.43Å; A362-H364 PolarHBondContact O-N 2.82Å; H364-S367 WeakPolarHBondContact O-CB 3.18Å; H364-S367 PolarHBondContact O-N 3.11Å; H364-K368 PolarHBondContact O-N 2.9Å; H364-K368 VanDerWaalsContact O-N 3.07Å; H364-Y379 PolarHBondContact N-OH 3.18Å
365	R	97.1	Very high	96.5	Very high	42 Å²	42	48.3 Å²	48.3	16%	0.158	23%	0.229	C	C	.	.	H	α-helix	trans	-64.9	-41.7	177.2	-69.5	-71.1	-175.1	-170.8	-1.9	112.1	E327 D330 A334 L337 L361 A362 S367 K368 A369	E327-R365 IonicContact OE1-CZ 3.32Å; E327-R365 IonicContact OE1-NH1 3.98Å; E327-R365 PolarHBondContact OE1-NH1 2.91Å; E327-R365 IonicContact OE1-NH2 2.61Å; E327-R365 PolarHBondContact OE1-NH2 2.88Å; D330-R365 WeakPolarHBondContact OD1-CD 3.38Å; D330-R365 IonicContact OD1-CZ 3.29Å; D330-R365 IonicContact OD1-NE 2.98Å; D330-R365 IonicContact OD1-NH1 2.72Å; D330-R365 PolarHBondContact OD1-NH1 2.81Å; A334-R365 HydrophobicContact CB-CB 3.66Å; L337-R365 HydrophobicContact CD1-CG 4.06Å; L361-R365 WeakPolarHBondContact O-CG 3.32Å; L361-R365 PolarHBondContact O-N 3.29Å; A362-R365 PolarHBondContact O-N 2.97Å; R365-S367 VanDerWaalsContact C-N 3.31Å; R365-S367 PolarHBondContact O-N 3.38Å; R365-K368 PolarHBondContact O-N 2.88Å; R365-A369 PolarHBondContact O-N 3.23Å
366	F	97.6	Very high	96.5	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-59	-40.6	171.9	-79.9	-54.2	0	0	0	112.1	L331 A334 L335 E338 A362 A369 G370 Q371 H374 A375	L331-F366 HydrophobicContact CD1-CD1 4.17Å; L331-F366 HydrophobicContact CD1-CE1 4.04Å; A334-F366 HydrophobicContact CB-CB 4.29Å; A334-F366 HydrophobicContact CB-CD1 3.46Å; A334-F366 VanDerWaalsContact CB-CD1 3.46Å; A334-F366 HydrophobicContact CB-CD2 3.75Å; A334-F366 HydrophobicContact CB-CE1 3.59Å; A334-F366 HydrophobicContact CB-CE2 3.86Å; A334-F366 HydrophobicContact CB-CG 3.54Å; A334-F366 HydrophobicContact CB-CZ 3.79Å; L335-F366 HydrophobicContact CD2-CE1 4.2Å; L335-F366 HydrophobicContact CD2-CZ 4.04Å; L335-F366 HydrophobicContact CG-CE1 4.28Å; L335-F366 HydrophobicContact CG-CZ 4.35Å; E338-F366 HydrophobicContact CB-CE2 4.46Å; A362-F366 HydrophobicContact CB-CD2 4.41Å; A362-F366 HydrophobicContact CB-CE2 4.3Å; A362-F366 WeakPolarHBondContact O-CB 3.43Å; A362-F366 WeakPolarHBondContact O-CD2 3.44Å; A362-F366 PolarHBondContact O-N 2.86Å; F366-A369 CarbonylContact O-C 3.57Å; F366-A369 PolarHBondContact O-N 3.11Å; F366-G370 PolarHBondContact O-N 3.15Å; F366-Q371 HydrophobicContact CB-CB 4.12Å; F366-Q371 HydrophobicContact CD1-CB 3.88Å; F366-Q371 HydrophobicContact CD1-CG 4.36Å; F366-Q371 HydrophobicContact CG-CB 4.41Å; F366-Q371 WeakPolarHBondContact O-CA 3.43Å; F366-Q371 WeakPolarHBondContact O-CB 3.22Å; F366-Q371 PolarHBondContact O-N 3.43Å; F366-H374 HydrophobicContact CB-CB 4.13Å; F366-H374 HydrophobicContact CD1-CB 3.69Å; F366-H374 HydrophobicContact CD2-CB 3.82Å; F366-H374 HydrophobicContact CE1-CB 3.98Å; F366-H374 HydrophobicContact CE2-CB 4.1Å; F366-H374 HydrophobicContact CG-CB 3.62Å; F366-H374 HydrophobicContact CZ-CB 4.18Å; F366-A375 HydrophobicContact CB-CB 4.02Å
367	S	95.4	Very high	96.5	Very high	42 Å²	42	53.2 Å²	53.2	29%	0.294	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-39.3	176.7	-174.1	0	0	0	0	112.4	G363 H364 R365 A369 G370 Q405	G363-S367 WeakPolarHBondContact O-CB 3.35Å; G363-S367 PolarHBondContact O-N 3.32Å; H364-S367 WeakPolarHBondContact O-CB 3.18Å; H364-S367 PolarHBondContact O-N 3.11Å; R365-S367 VanDerWaalsContact C-N 3.31Å; R365-S367 PolarHBondContact O-N 3.38Å; S367-A369 VanDerWaalsContact C-N 3.35Å; S367-G370 PolarHBondContact O-N 3.15Å; S367-Q405 PolarHBondContact OG-NE2 3.11Å
368	K	94.7	Very high	96.5	Very high	115 Å²	115	48 Å²	48	50%	0.5	23%	0.225	S	C	.	.	H	α-helix	trans	-64.7	-39.7	174.1	-73.3	-170.8	166.9	-167.7	0	111.9	D330 H364 R365 G370	D330-K368 HydrophobicContact CB-CB 4.1Å; D330-K368 VanDerWaalsContact OD2-CB 3.22Å; D330-K368 WeakPolarHBondContact OD2-CB 3.36Å; D330-K368 WeakPolarHBondContact OD2-CD 3.33Å; H364-K368 PolarHBondContact O-N 2.9Å; H364-K368 VanDerWaalsContact O-N 3.07Å; R365-K368 PolarHBondContact O-N 2.88Å; K368-G370 PolarHBondContact O-N 3.26Å; K368-G370 VanDerWaalsContact O-N 3.11Å
369	A	95.2	Very high	96.5	Very high	33 Å²	33	47.3 Å²	47.3	27%	0.273	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	11.3	173.7	0	0	0	0	0	114.8	D330 L331 R365 F366 S367 Q371	D330-A369 HydrophobicContact CB-CB 4.07Å; L331-A369 HydrophobicContact CB-CB 3.88Å; R365-A369 PolarHBondContact O-N 3.23Å; F366-A369 CarbonylContact O-C 3.57Å; F366-A369 PolarHBondContact O-N 3.11Å; S367-A369 VanDerWaalsContact C-N 3.35Å; A369-Q371 HydrophobicContact CB-CG 4.37Å; A369-Q371 PolarHBondContact O-N 2.99Å; A369-Q371 VanDerWaalsContact O-N 3.12Å
370	G	93.9	Very high	96.4	Very high	36 Å²	36	49.5 Å²	49.5	37%	0.371	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	-1.4	-178.8	0	0	0	0	0	115.6	F366 S367 K368 R372	F366-G370 PolarHBondContact O-N 3.15Å; S367-G370 PolarHBondContact O-N 3.15Å; K368-G370 PolarHBondContact O-N 3.26Å; K368-G370 VanDerWaalsContact O-N 3.11Å; G370-R372 PolarHBondContact O-N 2.85Å
371	Q	95.4	Very high	96.4	Very high	50 Å²	50	50.7 Å²	50.7	23%	0.234	24%	0.242	C	C	.	.			trans	-81	58.7	-175.1	-63	-58.8	-34.9	0	0	112.5	L331 F366 A369 R373 H374 A375	L331-Q371 HydrophobicContact CD1-CG 3.89Å; F366-Q371 HydrophobicContact CB-CB 4.12Å; F366-Q371 HydrophobicContact CD1-CB 3.88Å; F366-Q371 HydrophobicContact CD1-CG 4.36Å; F366-Q371 HydrophobicContact CG-CB 4.41Å; F366-Q371 WeakPolarHBondContact O-CA 3.43Å; F366-Q371 WeakPolarHBondContact O-CB 3.22Å; F366-Q371 PolarHBondContact O-N 3.43Å; A369-Q371 HydrophobicContact CB-CG 4.37Å; A369-Q371 PolarHBondContact O-N 2.99Å; A369-Q371 VanDerWaalsContact O-N 3.12Å; Q371-R373 VanDerWaalsContact C-N 3.31Å; Q371-R373 PolarHBondContact O-N 3.07Å; Q371-H374 HydrophobicContact CB-CB 4.13Å; Q371-H374 WeakPolarHBondContact O-CB 3.36Å; Q371-H374 PolarHBondContact O-N 2.97Å; Q371-A375 PolarHBondContact O-N 2.98Å
372	R	94	Very high	96.3	Very high	112 Å²	112	47.8 Å²	47.8	42%	0.423	23%	0.227	S	C	.	.	H	α-helix	trans	-55.4	-38.1	-172.8	-61.2	-178	-172.3	83.4	-7.3	114.2	G370 A375 L376 L409	G370-R372 PolarHBondContact O-N 2.85Å; R372-A375 WeakPolarHBondContact O-CB 3.35Å; R372-A375 PolarHBondContact O-N 2.88Å; R372-L376 WeakPolarHBondContact O-CB 3.37Å; R372-L376 PolarHBondContact O-N 3.11Å; R372-L409 HydrophobicContact CB-CD1 4.22Å; R372-L409 HydrophobicContact CB-CD2 3.97Å; R372-L409 HydrophobicContact CB-CG 4.11Å
373	R	95.9	Very high	96.2	Very high	200 Å²	200	48.9 Å²	48.9	76%	0.755	23%	0.232	S	C	*	.	H	α-helix	trans	-62.8	-42.6	176.1	-65.2	-177.9	-176.3	160.1	1.3	112	Q371 R377 L409	Q371-R373 VanDerWaalsContact C-N 3.31Å; Q371-R373 PolarHBondContact O-N 3.07Å; R373-R377 PolarHBondContact O-N 3.04Å; R373-L409 HydrophobicContact CG-CD1 4.31Å; R373-L409 HydrophobicContact CG-CD2 3.85Å
374	H	96.7	Very high	96	Very high	65 Å²	65	55.9 Å²	55.9	30%	0.301	27%	0.265	S	S	.	.	H	α-helix	trans	-67.9	-41.7	175.3	-69.1	101	0	0	0	111.3	F366 Q371 R377 C378	F366-H374 HydrophobicContact CB-CB 4.13Å; F366-H374 HydrophobicContact CD1-CB 3.69Å; F366-H374 HydrophobicContact CD2-CB 3.82Å; F366-H374 HydrophobicContact CE1-CB 3.98Å; F366-H374 HydrophobicContact CE2-CB 4.1Å; F366-H374 HydrophobicContact CG-CB 3.62Å; F366-H374 HydrophobicContact CZ-CB 4.18Å; Q371-H374 HydrophobicContact CB-CB 4.13Å; Q371-H374 WeakPolarHBondContact O-CB 3.36Å; Q371-H374 PolarHBondContact O-N 2.97Å; H374-R377 PolarHBondContact O-N 3.41Å; H374-C378 PolarHBondContact O-N 2.78Å; H374-C378 PolarHBondContact O-SG 2.97Å
375	A	96.9	Very high	95.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57	-52.6	174	0	0	0	0	0	111.7	G363 F366 Q371 R372 R377 C378 Y379	G363-A375 VanDerWaalsContact O-CB 3.25Å; G363-A375 WeakPolarHBondContact O-CB 3.36Å; F366-A375 HydrophobicContact CB-CB 4.02Å; Q371-A375 PolarHBondContact O-N 2.98Å; R372-A375 WeakPolarHBondContact O-CB 3.35Å; R372-A375 PolarHBondContact O-N 2.88Å; A375-R377 PolarHBondContact O-N 3.31Å; A375-C378 WeakPolarHBondContact O-CB 3.43Å; A375-C378 PolarHBondContact O-N 3.36Å; A375-C378 VanDerWaalsContact O-N 3.11Å; A375-Y379 WeakPolarHBondContact O-CD2 3.4Å; A375-Y379 PolarHBondContact O-N 2.79Å
376	L	96.6	Very high	95.6	Very high	21 Å²	21	51.9 Å²	51.9	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-56.4	-47.6	177.6	179.8	59.6	0	0	0	111.6	R372 C378 Y379 S380 I402 Q405 L409	R372-L376 WeakPolarHBondContact O-CB 3.37Å; R372-L376 PolarHBondContact O-N 3.11Å; L376-C378 VanDerWaalsContact C-N 3.3Å; L376-C378 PolarHBondContact O-N 3.38Å; L376-Y379 PolarHBondContact O-N 3.18Å; L376-S380 WeakPolarHBondContact O-CB 3.4Å; L376-S380 PolarHBondContact O-N 2.9Å; L376-S380 PolarHBondContact O-OG 3.37Å; L376-S380 VanDerWaalsContact O-OG 3.08Å; L376-I402 HydrophobicContact CD1-CB 4.28Å; L376-I402 HydrophobicContact CD1-CG1 4.17Å; L376-I402 HydrophobicContact CD1-CG2 3.92Å; L376-Q405 HydrophobicContact CB-CB 4.35Å; L376-Q405 HydrophobicContact CD1-CB 4.44Å; L376-L409 HydrophobicContact CB-CD1 4.33Å; L376-L409 HydrophobicContact CD2-CD1 3.79Å
377	R	97.1	Very high	95.2	Very high	101 Å²	101	56.9 Å²	56.9	38%	0.381	27%	0.271	S	S	.	.	H	α-helix	trans	-52.6	-47.5	174.3	-179.4	-179.6	77.9	-154.3	3.4	111.8	E338 R373 H374 A375 S380 Q381	E338-R377 IonicContact OE1-CZ 3.75Å; E338-R377 IonicContact OE1-NE 3.27Å; E338-R377 PolarHBondContact OE1-NE 3.03Å; E338-R377 IonicContact OE1-NH2 2.91Å; E338-R377 PolarHBondContact OE1-NH2 2.78Å; E338-R377 IonicContact OE2-NH2 3.78Å; E338-R377 PolarHBondContact OE2-NH2 2.8Å; R373-R377 PolarHBondContact O-N 3.04Å; H374-R377 PolarHBondContact O-N 3.41Å; A375-R377 PolarHBondContact O-N 3.31Å; R377-S380 PolarHBondContact O-N 3.24Å; R377-Q381 WeakPolarHBondContact O-CG 3.14Å; R377-Q381 PolarHBondContact O-N 3.22Å
378	C	97.8	Very high	94.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-45.5	-177.6	-65.7	0	0	0	0	112.3	M359 H374 A375 L376 Q381 A382	M359-C378 HydrophobicContact CE-CB 3.8Å; M359-C378 VanDerWaalsContact CE-SG 3.55Å; M359-C378 WeakPolarHBondContact O-CB 3.21Å; H374-C378 PolarHBondContact O-N 2.78Å; H374-C378 PolarHBondContact O-SG 2.97Å; A375-C378 WeakPolarHBondContact O-CB 3.43Å; A375-C378 PolarHBondContact O-N 3.36Å; A375-C378 VanDerWaalsContact O-N 3.11Å; L376-C378 VanDerWaalsContact C-N 3.3Å; L376-C378 PolarHBondContact O-N 3.38Å; C378-Q381 PolarHBondContact O-N 2.88Å; C378-A382 PolarHBondContact O-N 3.05Å
379	Y	97.7	Very high	94.3	Very high	7 Å²	7	62.5 Å²	62.5	3%	0.027	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-40.6	176	-75.8	-71.7	0	0	0	112.2	I360 H364 A375 L376 Q381 A382 M383 I398 T401	I360-Y379 HydrophobicContact CB-CE1 4.4Å; I360-Y379 HydrophobicContact CG1-CD1 4.36Å; I360-Y379 HydrophobicContact CG1-CE1 4.34Å; I360-Y379 HydrophobicContact CG2-CE1 3.95Å; H364-Y379 PolarHBondContact N-OH 3.18Å; A375-Y379 WeakPolarHBondContact O-CD2 3.4Å; A375-Y379 PolarHBondContact O-N 2.79Å; L376-Y379 PolarHBondContact O-N 3.18Å; Y379-Q381 PolarHBondContact O-N 3.48Å; Y379-A382 PolarHBondContact O-N 3.16Å; Y379-M383 PolarHBondContact O-N 3.01Å; Y379-I398 HydrophobicContact CD1-CG1 4.42Å; Y379-I398 HydrophobicContact CD1-CG2 4.14Å; Y379-I398 WeakPolarHBondContact O-CG2 3.48Å; Y379-T401 HydrophobicContact CD1-CG2 4.33Å; Y379-T401 HydrophobicContact CD2-CG2 3.73Å; Y379-T401 HydrophobicContact CE1-CG2 4Å; Y379-T401 HydrophobicContact CE2-CG2 3.4Å; Y379-T401 HydrophobicContact CG-CG2 4.21Å
380	S	96.4	Very high	93.8	Very high	47 Å²	47	64 Å²	64	33%	0.329	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-37.4	175.5	-63.4	0	0	0	0	112.9	L376 R377 M383	L376-S380 WeakPolarHBondContact O-CB 3.4Å; L376-S380 PolarHBondContact O-N 2.9Å; L376-S380 PolarHBondContact O-OG 3.37Å; L376-S380 VanDerWaalsContact O-OG 3.08Å; R377-S380 PolarHBondContact O-N 3.24Å; S380-M383 PolarHBondContact O-N 3.19Å
381	Q	96.4	Very high	93.6	Very high	48 Å²	48	68.2 Å²	68.2	22%	0.224	32%	0.315	C	S	.	.	H	α-helix	trans	-68.6	-37.9	172.7	-72.8	-177.5	13.7	0	0	112.3	F355 M359 R377 C378 Y379 Q384	F355-Q381 HydrophobicContact CZ-CB 4.23Å; M359-Q381 HydrophobicContact CE-CB 4.46Å; M359-Q381 VanDerWaalsContact CE-OE1 3.25Å; R377-Q381 WeakPolarHBondContact O-CG 3.14Å; R377-Q381 PolarHBondContact O-N 3.22Å; C378-Q381 PolarHBondContact O-N 2.88Å; Y379-Q381 PolarHBondContact O-N 3.48Å; Q381-Q384 PolarHBondContact O-N 3.35Å
382	A	96.4	Very high	93.3	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.7	-38.1	174.6	0	0	0	0	0	112.3	A356 M359 I360 C378 Y379 Q384 V385 Y386 I398	A356-A382 HydrophobicContact CB-CB 4.27Å; M359-A382 HydrophobicContact CB-CB 4.35Å; I360-A382 HydrophobicContact CD1-CB 4.14Å; I360-A382 HydrophobicContact CG1-CB 3.69Å; C378-A382 PolarHBondContact O-N 3.05Å; Y379-A382 PolarHBondContact O-N 3.16Å; A382-Q384 VanDerWaalsContact C-N 3.28Å; A382-Q384 PolarHBondContact O-N 2.95Å; A382-V385 PolarHBondContact O-N 3.2Å; A382-Y386 WeakPolarHBondContact O-CD2 3.2Å; A382-Y386 PolarHBondContact O-N 3.01Å; A382-I398 HydrophobicContact CB-CD1 4.34Å
383	M	95	Very high	93.2	Very high	22 Å²	22	65.8 Å²	65.8	11%	0.108	31%	0.313	C	S	.	.	H	α-helix	trans	-57.3	-39.1	177.8	-178.6	53.9	71.6	0	0	112.3	Y379 S380 V385 Y386 K387 I398 N399 I402	Y379-M383 PolarHBondContact O-N 3.01Å; S380-M383 PolarHBondContact O-N 3.19Å; M383-V385 PolarHBondContact O-N 3.28Å; M383-Y386 PolarHBondContact O-N 3.34Å; M383-Y386 VanDerWaalsContact O-N 3.11Å; M383-K387 HydrophobicContact CG-CB 4.33Å; M383-K387 VanDerWaalsContact O-CB 3.25Å; M383-K387 WeakPolarHBondContact O-CB 3.3Å; M383-K387 PolarHBondContact O-N 3.39Å; M383-K387 HydrophobicContact SD-CB 3.84Å; M383-I398 HydrophobicContact CB-CG2 4.03Å; M383-I398 HydrophobicContact CE-CB 3.71Å; M383-I398 HydrophobicContact CE-CG2 3.6Å; M383-N399 HydrophobicContact CE-CB 4.29Å; M383-N399 VanDerWaalsContact CE-CG 3.41Å; M383-N399 WeakPolarHBondContact CE-ND2 3.4Å; M383-N399 WeakPolarHBondContact CE-OD1 3.27Å; M383-I402 HydrophobicContact CB-CD1 4.32Å
384	Q	94.1	Very high	93	Very high	147 Å²	147	57.6 Å²	57.6	69%	0.687	29%	0.288	S	S	*	.	H	α-helix	trans	-59	-20.9	177.2	-63	174.2	29.5	0	0	113.8	Q381 A382	Q381-Q384 PolarHBondContact O-N 3.35Å; A382-Q384 VanDerWaalsContact C-N 3.28Å; A382-Q384 PolarHBondContact O-N 2.95Å
385	V	93.8	Very high	92.8	Very high	17 Å²	17	55 Å²	55	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-92.9	-30.8	178.3	-179.5	0	0	0	0	112.5	V352 F355 A356 A382 M383 R389	V352-V385 HydrophobicContact CB-CG1 4.24Å; F355-V385 HydrophobicContact CD1-CG2 4.21Å; F355-V385 HydrophobicContact CE1-CG2 4.41Å; A356-V385 HydrophobicContact CB-CB 3.71Å; A356-V385 HydrophobicContact CB-CG1 3.85Å; A356-V385 HydrophobicContact CB-CG2 3.95Å; A382-V385 PolarHBondContact O-N 3.2Å; M383-V385 PolarHBondContact O-N 3.28Å; V385-R389 WeakPolarHBondContact O-CD 3.16Å; V385-R389 PolarHBondContact O-NE 3.44Å
386	Y	91.1	Very high	92.7	Very high	25 Å²	25	55.1 Å²	55.1	10%	0.098	28%	0.277	C	S	.	.	H	α-helix	trans	-96.5	-33.3	-176.2	-71	-70.1	0	0	0	114.3	A356 I360 A382 M383 D388 R389 W391 A394 I398	A356-Y386 HydrophobicContact CB-CD2 4.22Å; A356-Y386 HydrophobicContact CB-CE2 3.56Å; I360-Y386 HydrophobicContact CD1-CE2 3.87Å; A382-Y386 WeakPolarHBondContact O-CD2 3.2Å; A382-Y386 PolarHBondContact O-N 3.01Å; M383-Y386 PolarHBondContact O-N 3.34Å; M383-Y386 VanDerWaalsContact O-N 3.11Å; Y386-D388 PolarHBondContact O-N 2.95Å; Y386-R389 WeakPolarHBondContact O-CB 3.46Å; Y386-R389 PolarHBondContact O-N 2.99Å; Y386-R389 VanDerWaalsContact O-N 3.11Å; Y386-W391 HydrophobicContact CD1-CB 3.82Å; Y386-W391 AromaticContact CD1-CG 3.91Å; Y386-W391 HydrophobicContact CD1-CG 3.91Å; Y386-W391 HydrophobicContact CE1-CG 4.35Å; Y386-A394 HydrophobicContact CD1-CB 4.2Å; Y386-A394 HydrophobicContact CE1-CB 4.39Å; Y386-A394 HydrophobicContact CG-CB 4.37Å; Y386-I398 HydrophobicContact CD2-CD1 3.5Å; Y386-I398 VanDerWaalsContact CD2-CD1 3.5Å; Y386-I398 HydrophobicContact CE2-CD1 4.17Å; Y386-I398 HydrophobicContact CG-CD1 4.19Å
387	K	89.3	Confident	92.5	Very high	107 Å²	107	58.2 Å²	58.2	47%	0.465	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	130.9	-176.5	-177.3	-179.6	177.2	-170.6	0	112.4	M383 R389	M383-K387 HydrophobicContact CG-CB 4.33Å; M383-K387 VanDerWaalsContact O-CB 3.25Å; M383-K387 WeakPolarHBondContact O-CB 3.3Å; M383-K387 PolarHBondContact O-N 3.39Å; M383-K387 HydrophobicContact SD-CB 3.84Å; K387-R389 VanDerWaalsContact O-CG 3.32Å; K387-R389 WeakPolarHBondContact O-CG 3.47Å; K387-R389 PolarHBondContact O-N 3.29Å
388	D	84.9	Confident	92.4	Very high	124 Å²	124	53.4 Å²	53.4	66%	0.663	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	20.1	176	-49.4	-34.2	0	0	0	113.7	Y386 E395	Y386-D388 PolarHBondContact O-N 2.95Å; D388-E395 PolarHBondContact N-OE2 2.81Å
389	R	86.4	Confident	92.3	Very high	151 Å²	151	54.1 Å²	54.1	57%	0.57	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	9	179.9	-50.3	-157.1	-167	-170.6	7.4	114.2	V385 Y386 K387 W391	V385-R389 WeakPolarHBondContact O-CD 3.16Å; V385-R389 PolarHBondContact O-NE 3.44Å; Y386-R389 WeakPolarHBondContact O-CB 3.46Å; Y386-R389 PolarHBondContact O-N 2.99Å; Y386-R389 VanDerWaalsContact O-N 3.11Å; K387-R389 VanDerWaalsContact O-CG 3.32Å; K387-R389 WeakPolarHBondContact O-CG 3.47Å; K387-R389 PolarHBondContact O-N 3.29Å; R389-W391 VanDerWaalsContact O-CD1 3.25Å
390	G	84.4	Confident	92.2	Very high	65 Å²	65	55.3 Å²	55.3	67%	0.67	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	22	175.8	0	0	0	0	0	114.5	S392	G390-S392 PolarHBondContact O-N 2.83Å
391	W	88.4	Confident	92.1	Very high	123 Å²	123	54 Å²	54	47%	0.466	27%	0.271	S	S	.	.			trans	-100.5	50.3	178.7	-68.7	82.8	0	0	0	110.2	Y386 R389 L393 A394 E395	Y386-W391 HydrophobicContact CD1-CB 3.82Å; Y386-W391 AromaticContact CD1-CG 3.91Å; Y386-W391 HydrophobicContact CD1-CG 3.91Å; Y386-W391 HydrophobicContact CE1-CG 4.35Å; R389-W391 VanDerWaalsContact O-CD1 3.25Å; W391-L393 VanDerWaalsContact C-N 3.29Å; W391-L393 PolarHBondContact O-N 2.94Å; W391-L393 VanDerWaalsContact O-N 3.07Å; W391-A394 HydrophobicContact CB-CB 4.26Å; W391-A394 WeakPolarHBondContact O-CA 3.4Å; W391-A394 WeakPolarHBondContact O-CB 3.46Å; W391-A394 PolarHBondContact O-N 3.5Å; W391-E395 PolarHBondContact N-OE1 3.43Å; W391-E395 PolarHBondContact O-N 3.3Å
392	S	89.8	Confident	92.1	Very high	21 Å²	21	52.5 Å²	52.5	15%	0.147	27%	0.265	C	S	.	.	H	α-helix	trans	-51.9	-40.7	-166.2	57.2	0	0	0	0	114.2	G390 A394 E395 D396 R428	G390-S392 PolarHBondContact O-N 2.83Å; S392-A394 VanDerWaalsContact C-N 3.3Å; S392-A394 PolarHBondContact O-N 2.87Å; S392-E395 PolarHBondContact O-N 2.86Å; S392-D396 VanDerWaalsContact O-CB 3.28Å; S392-D396 WeakPolarHBondContact O-CB 3.22Å; S392-D396 PolarHBondContact O-N 3.36Å; S392-R428 WeakPolarHBondContact OG-CG 3.23Å
393	L	91.8	Very high	92.1	Very high	91 Å²	91	52.5 Å²	52.5	48%	0.476	27%	0.265	S	S	.	.	H	α-helix	trans	-60.8	-34.7	176.2	-60.6	178.9	0	0	0	114	W391 H397 R428 Q429	W391-L393 VanDerWaalsContact C-N 3.29Å; W391-L393 PolarHBondContact O-N 2.94Å; W391-L393 VanDerWaalsContact O-N 3.07Å; L393-H397 WeakPolarHBondContact O-CB 3.5Å; L393-H397 PolarHBondContact O-N 2.96Å; L393-R428 HydrophobicContact CD2-CB 3.82Å; L393-R428 HydrophobicContact CG-CB 4.34Å; L393-Q429 HydrophobicContact CD2-CG 3.95Å
394	A	91.6	Very high	92.1	Very high	27 Å²	27	57.8 Å²	57.8	22%	0.223	28%	0.284	C	S	.	.	H	α-helix	trans	-78.1	-42.1	175.3	0	0	0	0	0	111	Y386 W391 S392 D396 H397 I398	Y386-A394 HydrophobicContact CD1-CB 4.2Å; Y386-A394 HydrophobicContact CE1-CB 4.39Å; Y386-A394 HydrophobicContact CG-CB 4.37Å; W391-A394 HydrophobicContact CB-CB 4.26Å; W391-A394 WeakPolarHBondContact O-CA 3.4Å; W391-A394 WeakPolarHBondContact O-CB 3.46Å; W391-A394 PolarHBondContact O-N 3.5Å; S392-A394 VanDerWaalsContact C-N 3.3Å; S392-A394 PolarHBondContact O-N 2.87Å; A394-D396 VanDerWaalsContact C-N 3.35Å; A394-D396 PolarHBondContact O-N 2.95Å; A394-H397 PolarHBondContact O-N 3.46Å; A394-I398 WeakPolarHBondContact O-CB 3.31Å; A394-I398 WeakPolarHBondContact O-CD1 3.37Å; A394-I398 WeakPolarHBondContact O-CG1 3.28Å; A394-I398 PolarHBondContact O-N 3.12Å
395	E	93.2	Very high	92	Very high	12 Å²	12	51.6 Å²	51.6	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-59.7	-44.4	175.6	-64.4	174.4	-117.9	0	0	111	D388 W391 S392 I398 N399	D388-E395 PolarHBondContact N-OE2 2.81Å; W391-E395 PolarHBondContact N-OE1 3.43Å; W391-E395 PolarHBondContact O-N 3.3Å; S392-E395 PolarHBondContact O-N 2.86Å; E395-I398 PolarHBondContact O-N 3.31Å; E395-N399 VanDerWaalsContact O-CB 3.27Å; E395-N399 WeakPolarHBondContact O-CB 3.4Å; E395-N399 PolarHBondContact O-N 3.05Å; E395-N399 PolarHBondContact O-ND2 2.92Å
396	D	93.9	Very high	92.1	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.011	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-49.4	174.2	-67.9	-11.6	0	0	0	111.3	S392 A394 F400 I422 S427 Q429 F437	S392-D396 VanDerWaalsContact O-CB 3.28Å; S392-D396 WeakPolarHBondContact O-CB 3.22Å; S392-D396 PolarHBondContact O-N 3.36Å; A394-D396 VanDerWaalsContact C-N 3.35Å; A394-D396 PolarHBondContact O-N 2.95Å; D396-F400 WeakPolarHBondContact O-CB 3.46Å; D396-F400 PolarHBondContact O-N 3.2Å; D396-I422 HydrophobicContact CB-CG2 4.21Å; D396-S427 VanDerWaalsContact OD2-CB 3.31Å; D396-S427 WeakPolarHBondContact OD2-CB 3.4Å; D396-S427 PolarHBondContact OD2-OG 2.94Å; D396-Q429 HydrophobicContact CB-CG 4.21Å; D396-Q429 WeakPolarHBondContact OD2-CG 3.47Å; D396-F437 HydrophobicContact CB-CE2 4.25Å; D396-F437 HydrophobicContact CB-CZ 4.13Å
397	H	93.4	Very high	92.3	Very high	85 Å²	85	52.7 Å²	52.7	39%	0.394	26%	0.259	S	S	.	.	H	α-helix	trans	-63.6	-42.7	179.6	173.2	62.5	0	0	0	112.6	L393 A394 T401	L393-H397 WeakPolarHBondContact O-CB 3.5Å; L393-H397 PolarHBondContact O-N 2.96Å; A394-H397 PolarHBondContact O-N 3.46Å; H397-T401 WeakPolarHBondContact O-CB 3.4Å; H397-T401 PolarHBondContact O-N 2.87Å; H397-T401 PolarHBondContact O-OG1 2.76Å
398	I	95.1	Very high	92.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69.2	-47.9	179	-62	158.5	0	0	0	110.1	I360 Y379 A382 M383 Y386 A394 E395 F400 T401 I402	I360-I398 HydrophobicContact CD1-CD1 3.98Å; I360-I398 HydrophobicContact CD1-CG1 4.09Å; I360-I398 HydrophobicContact CG1-CG1 4.32Å; Y379-I398 HydrophobicContact CD1-CG1 4.42Å; Y379-I398 HydrophobicContact CD1-CG2 4.14Å; Y379-I398 WeakPolarHBondContact O-CG2 3.48Å; A382-I398 HydrophobicContact CB-CD1 4.34Å; M383-I398 HydrophobicContact CB-CG2 4.03Å; M383-I398 HydrophobicContact CE-CB 3.71Å; M383-I398 HydrophobicContact CE-CG2 3.6Å; Y386-I398 HydrophobicContact CD2-CD1 3.5Å; Y386-I398 VanDerWaalsContact CD2-CD1 3.5Å; Y386-I398 HydrophobicContact CE2-CD1 4.17Å; Y386-I398 HydrophobicContact CG-CD1 4.19Å; A394-I398 WeakPolarHBondContact O-CB 3.31Å; A394-I398 WeakPolarHBondContact O-CD1 3.37Å; A394-I398 WeakPolarHBondContact O-CG1 3.28Å; A394-I398 PolarHBondContact O-N 3.12Å; E395-I398 PolarHBondContact O-N 3.31Å; I398-F400 VanDerWaalsContact C-N 3.34Å; I398-F400 PolarHBondContact O-N 3.46Å; I398-T401 PolarHBondContact O-N 3.41Å; I398-I402 HydrophobicContact CG2-CD1 3.76Å; I398-I402 HydrophobicContact CG2-CG1 4.24Å; I398-I402 WeakPolarHBondContact O-CB 3.37Å; I398-I402 VanDerWaalsContact O-CG1 3.32Å; I398-I402 WeakPolarHBondContact O-CG1 3.19Å; I398-I402 PolarHBondContact O-N 3.19Å
399	N	95.5	Very high	92.8	Very high	15 Å²	15	48 Å²	48	8%	0.08	24%	0.242	C	C	.	.	H	α-helix	trans	-59.6	-43	176.5	-82.7	-48.4	0	0	0	111.7	M383 E395 T401 I402 G403 I422	M383-N399 HydrophobicContact CE-CB 4.29Å; M383-N399 VanDerWaalsContact CE-CG 3.41Å; M383-N399 WeakPolarHBondContact CE-ND2 3.4Å; M383-N399 WeakPolarHBondContact CE-OD1 3.27Å; E395-N399 VanDerWaalsContact O-CB 3.27Å; E395-N399 WeakPolarHBondContact O-CB 3.4Å; E395-N399 PolarHBondContact O-N 3.05Å; E395-N399 PolarHBondContact O-ND2 2.92Å; N399-T401 VanDerWaalsContact C-N 3.29Å; N399-T401 PolarHBondContact O-N 3.25Å; N399-I402 PolarHBondContact O-N 3.17Å; N399-G403 PolarHBondContact O-N 2.89Å; N399-I422 HydrophobicContact CB-CD1 3.78Å; N399-I422 HydrophobicContact CB-CG1 3.48Å; N399-I422 VanDerWaalsContact CB-CG1 3.48Å
400	F	95.3	Very high	93.1	Very high	33 Å²	33	43.9 Å²	43.9	15%	0.145	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-41.9	177	-176.7	-111.1	0	0	0	111.6	D396 I398 G403 R404 F419 I422 F437 E440	D396-F400 WeakPolarHBondContact O-CB 3.46Å; D396-F400 PolarHBondContact O-N 3.2Å; I398-F400 VanDerWaalsContact C-N 3.34Å; I398-F400 PolarHBondContact O-N 3.46Å; F400-G403 PolarHBondContact O-N 3.02Å; F400-R404 WeakPolarHBondContact O-CG 3.23Å; F400-R404 PolarHBondContact O-N 3.42Å; F400-R404 VanDerWaalsContact O-N 3.11Å; F400-F419 HydrophobicContact CD2-CD1 4.24Å; F400-F419 AromaticContact CD2-CE1 3.65Å; F400-F419 HydrophobicContact CD2-CE1 3.65Å; F400-F419 HydrophobicContact CE2-CE1 4.1Å; F400-F419 HydrophobicContact CG-CE1 4.45Å; F400-I422 HydrophobicContact CB-CD1 3.89Å; F400-I422 HydrophobicContact CD2-CD1 4.5Å; F400-F437 HydrophobicContact CB-CD1 4.42Å; F400-F437 HydrophobicContact CB-CE1 3.85Å; F400-F437 HydrophobicContact CD1-CE1 4.41Å; F400-F437 AromaticContact CD2-CD1 3.32Å; F400-F437 HydrophobicContact CD2-CD1 3.32Å; F400-F437 AromaticContact CD2-CE1 3.45Å; F400-F437 HydrophobicContact CD2-CE1 3.45Å; F400-F437 VanDerWaalsContact CD2-CE1 3.45Å; F400-F437 AromaticContact CE2-CD1 3.68Å; F400-F437 HydrophobicContact CE2-CD1 3.68Å; F400-F437 HydrophobicContact CE2-CE1 4.01Å; F400-F437 HydrophobicContact CG-CD1 4.04Å; F400-F437 AromaticContact CG-CE1 3.66Å; F400-F437 HydrophobicContact CG-CE1 3.66Å; F400-E440 HydrophobicContact CE2-CB 4.46Å; F400-E440 HydrophobicContact CE2-CG 3.99Å; F400-E440 HydrophobicContact CZ-CG 4.43Å
401	T	95.2	Very high	93.6	Very high	18 Å²	18	44.6 Å²	44.6	11%	0.11	23%	0.232	C	C	.	.	H	α-helix	trans	-72.2	-41.7	179.6	-51.5	0	0	0	0	111.6	Y379 H397 I398 N399 G403 R404 Q405	Y379-T401 HydrophobicContact CD1-CG2 4.33Å; Y379-T401 HydrophobicContact CD2-CG2 3.73Å; Y379-T401 HydrophobicContact CE1-CG2 4Å; Y379-T401 HydrophobicContact CE2-CG2 3.4Å; Y379-T401 HydrophobicContact CG-CG2 4.21Å; H397-T401 WeakPolarHBondContact O-CB 3.4Å; H397-T401 PolarHBondContact O-N 2.87Å; H397-T401 PolarHBondContact O-OG1 2.76Å; I398-T401 PolarHBondContact O-N 3.41Å; N399-T401 VanDerWaalsContact C-N 3.29Å; N399-T401 PolarHBondContact O-N 3.25Å; T401-G403 VanDerWaalsContact C-N 3.31Å; T401-G403 PolarHBondContact O-N 3.19Å; T401-R404 PolarHBondContact O-N 2.74Å; T401-Q405 HydrophobicContact CG2-CG 4.2Å; T401-Q405 WeakPolarHBondContact O-CB 3.37Å; T401-Q405 WeakPolarHBondContact O-CG 3.25Å; T401-Q405 PolarHBondContact O-N 3.21Å
402	I	96.3	Very high	93.7	Very high	18 Å²	18	40.6 Å²	40.6	9%	0.092	22%	0.222	C	C	.	.	H	α-helix	trans	-55.2	-49.6	171.1	-72.5	173.3	0	0	0	109.5	L376 M383 I398 N399 R404 Q405 S406 A418	L376-I402 HydrophobicContact CD1-CB 4.28Å; L376-I402 HydrophobicContact CD1-CG1 4.17Å; L376-I402 HydrophobicContact CD1-CG2 3.92Å; M383-I402 HydrophobicContact CB-CD1 4.32Å; I398-I402 HydrophobicContact CG2-CD1 3.76Å; I398-I402 HydrophobicContact CG2-CG1 4.24Å; I398-I402 WeakPolarHBondContact O-CB 3.37Å; I398-I402 VanDerWaalsContact O-CG1 3.32Å; I398-I402 WeakPolarHBondContact O-CG1 3.19Å; I398-I402 PolarHBondContact O-N 3.19Å; N399-I402 PolarHBondContact O-N 3.17Å; I402-R404 PolarHBondContact O-N 3.19Å; I402-Q405 PolarHBondContact O-N 3.1Å; I402-S406 WeakPolarHBondContact O-CB 3.32Å; I402-S406 PolarHBondContact O-N 3.03Å; I402-S406 PolarHBondContact O-OG 3.27Å; I402-A418 HydrophobicContact CB-CB 4.25Å; I402-A418 HydrophobicContact CG2-CB 3.77Å
403	G	95.6	Very high	93.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-53.8	-53.5	179.7	0	0	0	0	0	112.9	N399 F400 T401 Q405 F407 A415	N399-G403 PolarHBondContact O-N 2.89Å; F400-G403 PolarHBondContact O-N 3.02Å; T401-G403 VanDerWaalsContact C-N 3.31Å; T401-G403 PolarHBondContact O-N 3.19Å; G403-Q405 PolarHBondContact O-N 3.49Å; G403-F407 WeakPolarHBondContact O-CB 3.39Å; G403-F407 PolarHBondContact O-N 3.3Å; G403-A415 WeakPolarHBondContact O-CB 3.25Å
404	R	94.1	Very high	93.8	Very high	133 Å²	133	44.5 Å²	44.5	50%	0.502	24%	0.238	S	C	.	.	H	α-helix	trans	-63.9	-39.9	178.8	-66.8	-175.7	71.4	-156.2	0.8	113.4	F400 T401 I402 T408 F419	F400-R404 WeakPolarHBondContact O-CG 3.23Å; F400-R404 PolarHBondContact O-N 3.42Å; F400-R404 VanDerWaalsContact O-N 3.11Å; T401-R404 PolarHBondContact O-N 2.74Å; I402-R404 PolarHBondContact O-N 3.19Å; R404-T408 WeakPolarHBondContact O-CB 3.1Å; R404-T408 PolarHBondContact O-N 3.42Å; R404-T408 VanDerWaalsContact O-N 3.09Å; R404-T408 PolarHBondContact O-OG1 2.88Å; R404-F419 HydrophobicContact CG-CE1 4.34Å; R404-F419 HydrophobicContact CG-CZ 3.88Å
405	Q	93.8	Very high	93.9	Very high	17 Å²	17	43.2 Å²	43.2	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-70.7	-44.6	179.4	-64.2	-67.8	-16.8	0	0	111.8	S367 L376 T401 I402 G403 T408 L409	S367-Q405 PolarHBondContact OG-NE2 3.11Å; L376-Q405 HydrophobicContact CB-CB 4.35Å; L376-Q405 HydrophobicContact CD1-CB 4.44Å; T401-Q405 HydrophobicContact CG2-CG 4.2Å; T401-Q405 WeakPolarHBondContact O-CB 3.37Å; T401-Q405 WeakPolarHBondContact O-CG 3.25Å; T401-Q405 PolarHBondContact O-N 3.21Å; I402-Q405 PolarHBondContact O-N 3.1Å; G403-Q405 PolarHBondContact O-N 3.49Å; Q405-T408 PolarHBondContact O-N 3.48Å; Q405-L409 WeakPolarHBondContact O-CB 3.41Å; Q405-L409 VanDerWaalsContact O-CG 3.28Å; Q405-L409 WeakPolarHBondContact O-CG 3.45Å; Q405-L409 PolarHBondContact O-N 3.45Å
406	S	95.4	Very high	93.9	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.014	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-44.2	175.3	-74.6	0	0	0	0	111.5	I402 T408 L409 G410 Q411	I402-S406 WeakPolarHBondContact O-CB 3.32Å; I402-S406 PolarHBondContact O-N 3.03Å; I402-S406 PolarHBondContact O-OG 3.27Å; S406-T408 PolarHBondContact O-N 2.76Å; S406-L409 PolarHBondContact O-N 3.48Å; S406-L409 VanDerWaalsContact O-N 3.14Å; S406-G410 PolarHBondContact O-N 2.82Å; S406-Q411 CarbonylContact C-O 3.48Å; S406-Q411 WeakPolarHBondContact O-CA 3.48Å; S406-Q411 WeakPolarHBondContact O-CB 3.44Å; S406-Q411 PolarHBondContact O-N 2.87Å
407	F	94.2	Very high	93.8	Very high	62 Å²	62	49.8 Å²	49.8	27%	0.272	26%	0.259	S	S	.	.	H	α-helix	trans	-60.2	-48	176.1	-174.8	-105.1	0	0	0	112	G403 L409 G410 P412 A415 Y443 V444 S447	G403-F407 WeakPolarHBondContact O-CB 3.39Å; G403-F407 PolarHBondContact O-N 3.3Å; F407-L409 PolarHBondContact O-N 3.17Å; F407-L409 VanDerWaalsContact O-N 3.16Å; F407-G410 PolarHBondContact O-N 3.3Å; F407-P412 HydrophobicContact CD2-CB 4.29Å; F407-A415 HydrophobicContact CB-CB 3.85Å; F407-Y443 HydrophobicContact CE1-CD1 4.35Å; F407-Y443 AromaticContact CE1-CE1 3.67Å; F407-Y443 HydrophobicContact CE1-CE1 3.67Å; F407-Y443 HydrophobicContact CZ-CD1 4.39Å; F407-Y443 AromaticContact CZ-CE1 3.78Å; F407-Y443 HydrophobicContact CZ-CE1 3.78Å; F407-V444 HydrophobicContact CB-CG2 4.41Å; F407-V444 HydrophobicContact CD2-CB 4.34Å; F407-V444 HydrophobicContact CD2-CG1 3.88Å; F407-V444 HydrophobicContact CD2-CG2 3.66Å; F407-V444 HydrophobicContact CE2-CG1 4.21Å; F407-V444 HydrophobicContact CE2-CG2 4.12Å; F407-V444 HydrophobicContact CG-CG2 3.99Å; F407-S447 VanDerWaalsContact CE2-OG 3.25Å; F407-S447 WeakPolarHBondContact CE2-OG 3.48Å
408	T	92.1	Very high	93.8	Very high	83 Å²	83	46 Å²	46	51%	0.509	24%	0.242	S	C	.	.	H	α-helix	trans	-64.4	-20.4	178	-49.1	0	0	0	0	113.1	R404 Q405 S406	R404-T408 WeakPolarHBondContact O-CB 3.1Å; R404-T408 PolarHBondContact O-N 3.42Å; R404-T408 VanDerWaalsContact O-N 3.09Å; R404-T408 PolarHBondContact O-OG1 2.88Å; Q405-T408 PolarHBondContact O-N 3.48Å; S406-T408 PolarHBondContact O-N 2.76Å
409	L	93.7	Very high	93.8	Very high	51 Å²	51	46.1 Å²	46.1	27%	0.267	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	7	176.4	-74.9	169.3	0	0	0	113.5	R372 R373 L376 Q405 S406 F407	R372-L409 HydrophobicContact CB-CD1 4.22Å; R372-L409 HydrophobicContact CB-CD2 3.97Å; R372-L409 HydrophobicContact CB-CG 4.11Å; R373-L409 HydrophobicContact CG-CD1 4.31Å; R373-L409 HydrophobicContact CG-CD2 3.85Å; L376-L409 HydrophobicContact CB-CD1 4.33Å; L376-L409 HydrophobicContact CD2-CD1 3.79Å; Q405-L409 WeakPolarHBondContact O-CB 3.41Å; Q405-L409 VanDerWaalsContact O-CG 3.28Å; Q405-L409 WeakPolarHBondContact O-CG 3.45Å; Q405-L409 PolarHBondContact O-N 3.45Å; S406-L409 PolarHBondContact O-N 3.48Å; S406-L409 VanDerWaalsContact O-N 3.14Å; F407-L409 PolarHBondContact O-N 3.17Å; F407-L409 VanDerWaalsContact O-N 3.16Å
410	G	93.1	Very high	93.7	Very high	63 Å²	63	48.6 Å²	48.6	65%	0.649	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	25.5	-177.6	0	0	0	0	0	113.6	S406 F407 P412	S406-G410 PolarHBondContact O-N 2.82Å; F407-G410 PolarHBondContact O-N 3.3Å; G410-P412 VanDerWaalsContact C-CD 3.42Å; G410-P412 VanDerWaalsContact O-CD 3.28Å; G410-P412 WeakPolarHBondContact O-CD 3.44Å
411	Q	93.6	Very high	93.5	Very high	80 Å²	80	50 Å²	50	37%	0.374	26%	0.258	S	S	.	.			trans	-115.9	70.4	178.7	-58.9	-178	-7.6	0	0	110.6	S406 E413 N414 A415	S406-Q411 CarbonylContact C-O 3.48Å; S406-Q411 WeakPolarHBondContact O-CA 3.48Å; S406-Q411 WeakPolarHBondContact O-CB 3.44Å; S406-Q411 PolarHBondContact O-N 2.87Å; Q411-E413 PolarHBondContact O-N 2.93Å; Q411-N414 HydrophobicContact CB-CB 4.2Å; Q411-N414 PolarHBondContact O-N 2.77Å; Q411-N414 PolarHBondContact OE1-ND2 3.01Å; Q411-A415 PolarHBondContact O-N 3.13Å
412	P	90.8	Very high	93.3	Very high	40 Å²	40	49.2 Å²	49.2	26%	0.26	25%	0.253	S	S	.	.	H	α-helix	trans	-70.7	-32.1	-171.2	31	-37.2	0	0	0	112.9	F407 G410 N414 A415 L416 V444 V448	F407-P412 HydrophobicContact CD2-CB 4.29Å; G410-P412 VanDerWaalsContact C-CD 3.42Å; G410-P412 VanDerWaalsContact O-CD 3.28Å; G410-P412 WeakPolarHBondContact O-CD 3.44Å; P412-N414 PolarHBondContact O-N 3.04Å; P412-A415 CarbonylContact O-C 3.5Å; P412-A415 WeakPolarHBondContact O-CA 3.38Å; P412-A415 WeakPolarHBondContact O-CB 3.45Å; P412-A415 PolarHBondContact O-N 3.05Å; P412-L416 WeakPolarHBondContact O-CG 3.47Å; P412-L416 PolarHBondContact O-N 3.37Å; P412-V444 HydrophobicContact CB-CG1 4.05Å; P412-V448 HydrophobicContact CB-CG2 3.47Å; P412-V448 VanDerWaalsContact CB-CG2 3.47Å; P412-V448 HydrophobicContact CG-CG2 3.89Å
413	E	91.1	Very high	93.1	Very high	116 Å²	116	48.4 Å²	48.4	54%	0.542	25%	0.249	S	C	.	.	H	α-helix	trans	-59.3	-45	174.6	-66.6	-53.3	135.4	0	0	112.6	Q411 A415 L416 Q417	Q411-E413 PolarHBondContact O-N 2.93Å; E413-A415 PolarHBondContact O-N 3.44Å; E413-L416 PolarHBondContact O-N 3.35Å; E413-Q417 PolarHBondContact O-N 2.8Å
414	N	92.2	Very high	92.6	Very high	77 Å²	77	51.1 Å²	51.1	41%	0.412	26%	0.263	S	S	.	.	H	α-helix	trans	-62	-34.1	174.4	-70.7	-16.5	0	0	0	111.2	Q411 P412 A418	Q411-N414 HydrophobicContact CB-CB 4.2Å; Q411-N414 PolarHBondContact O-N 2.77Å; Q411-N414 PolarHBondContact OE1-ND2 3.01Å; P412-N414 PolarHBondContact O-N 3.04Å; N414-A418 WeakPolarHBondContact O-CB 3.37Å; N414-A418 PolarHBondContact O-N 3.41Å; N414-A418 VanDerWaalsContact O-N 3.11Å
415	A	94.9	Very high	92	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-72.1	-44.1	176.7	0	0	0	0	0	112.8	G403 F407 Q411 P412 E413 Q417 A418 F419 V444	G403-A415 WeakPolarHBondContact O-CB 3.25Å; F407-A415 HydrophobicContact CB-CB 3.85Å; Q411-A415 PolarHBondContact O-N 3.13Å; P412-A415 CarbonylContact O-C 3.5Å; P412-A415 WeakPolarHBondContact O-CA 3.38Å; P412-A415 WeakPolarHBondContact O-CB 3.45Å; P412-A415 PolarHBondContact O-N 3.05Å; E413-A415 PolarHBondContact O-N 3.44Å; A415-Q417 VanDerWaalsContact C-N 3.34Å; A415-Q417 PolarHBondContact O-N 3.26Å; A415-A418 PolarHBondContact O-N 2.92Å; A415-F419 HydrophobicContact CB-CE2 4.4Å; A415-F419 VanDerWaalsContact O-CD2 3.23Å; A415-F419 WeakPolarHBondContact O-CD2 3.21Å; A415-F419 WeakPolarHBondContact O-CG 3.27Å; A415-F419 PolarHBondContact O-N 3.11Å; A415-V444 HydrophobicContact CB-CG1 4.23Å; A415-V444 HydrophobicContact CB-CG2 4.41Å
416	L	92.4	Very high	91.3	Very high	25 Å²	25	51.6 Å²	51.6	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-47.2	173	-73.4	-178	0	0	0	111.2	P412 E413 A418 R420 Y441 V444 V445 V448	P412-L416 WeakPolarHBondContact O-CG 3.47Å; P412-L416 PolarHBondContact O-N 3.37Å; E413-L416 PolarHBondContact O-N 3.35Å; L416-A418 PolarHBondContact O-N 3.22Å; L416-R420 WeakPolarHBondContact O-CB 3.28Å; L416-R420 PolarHBondContact O-N 2.85Å; L416-Y441 HydrophobicContact CD2-CD2 4.34Å; L416-Y441 HydrophobicContact CD2-CE2 4.01Å; L416-V444 HydrophobicContact CD2-CB 3.8Å; L416-V444 HydrophobicContact CD2-CG1 3.56Å; L416-V444 HydrophobicContact CG-CB 4.46Å; L416-V444 HydrophobicContact CG-CG1 3.68Å; L416-V445 HydrophobicContact CD2-CB 4.31Å; L416-V445 HydrophobicContact CD2-CG2 3.39Å; L416-V448 HydrophobicContact CD1-CB 4.42Å; L416-V448 HydrophobicContact CD1-CG1 4.48Å; L416-V448 HydrophobicContact CD1-CG2 3.99Å
417	Q	92.7	Very high	90.9	Very high	128 Å²	128	52 Å²	52	60%	0.598	28%	0.278	S	S	*	.	H	α-helix	trans	-60.4	-47.2	178.4	-169.1	179.9	31.9	0	0	111.3	E413 A415 R420 Q421	E413-Q417 PolarHBondContact O-N 2.8Å; A415-Q417 VanDerWaalsContact C-N 3.34Å; A415-Q417 PolarHBondContact O-N 3.26Å; Q417-R420 PolarHBondContact O-N 2.95Å; Q417-Q421 WeakPolarHBondContact O-CG 3.39Å; Q417-Q421 PolarHBondContact O-N 3.41Å; Q417-Q421 VanDerWaalsContact O-N 3.17Å
418	A	93.9	Very high	90.7	Very high	6 Å²	6	57.9 Å²	57.9	5%	0.05	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-49.8	-179.6	0	0	0	0	0	112.2	I402 N414 A415 L416 R420 Q421 I422	I402-A418 HydrophobicContact CB-CB 4.25Å; I402-A418 HydrophobicContact CG2-CB 3.77Å; N414-A418 WeakPolarHBondContact O-CB 3.37Å; N414-A418 PolarHBondContact O-N 3.41Å; N414-A418 VanDerWaalsContact O-N 3.11Å; A415-A418 PolarHBondContact O-N 2.92Å; L416-A418 PolarHBondContact O-N 3.22Å; A418-R420 VanDerWaalsContact C-N 3.35Å; A418-R420 PolarHBondContact O-N 3.48Å; A418-Q421 PolarHBondContact O-N 3.23Å; A418-I422 WeakPolarHBondContact O-CG1 3.47Å
419	F	94.5	Very high	90.8	Very high	1 Å²	1	56 Å²	56	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-64.5	-37.6	177.3	-67.7	-46.2	0	0	0	112.4	F400 R404 A415 Q421 I422 L423 E440 Y441 V444	F400-F419 HydrophobicContact CD2-CD1 4.24Å; F400-F419 AromaticContact CD2-CE1 3.65Å; F400-F419 HydrophobicContact CD2-CE1 3.65Å; F400-F419 HydrophobicContact CE2-CE1 4.1Å; F400-F419 HydrophobicContact CG-CE1 4.45Å; R404-F419 HydrophobicContact CG-CE1 4.34Å; R404-F419 HydrophobicContact CG-CZ 3.88Å; A415-F419 HydrophobicContact CB-CE2 4.4Å; A415-F419 VanDerWaalsContact O-CD2 3.23Å; A415-F419 WeakPolarHBondContact O-CD2 3.21Å; A415-F419 WeakPolarHBondContact O-CG 3.27Å; A415-F419 PolarHBondContact O-N 3.11Å; F419-Q421 VanDerWaalsContact C-N 3.3Å; F419-Q421 PolarHBondContact O-N 3.1Å; F419-I422 HydrophobicContact CD1-CD1 4.01Å; F419-I422 WeakPolarHBondContact O-CB 3.26Å; F419-I422 PolarHBondContact O-N 3.48Å; F419-I422 VanDerWaalsContact O-N 3.11Å; F419-L423 PolarHBondContact O-N 2.51Å; F419-E440 HydrophobicContact CE1-CB 4.16Å; F419-E440 HydrophobicContact CE2-CB 4.19Å; F419-E440 HydrophobicContact CZ-CB 3.9Å; F419-Y441 HydrophobicContact CB-CD2 3.93Å; F419-Y441 HydrophobicContact CB-CG 4.49Å; F419-V444 HydrophobicContact CD2-CG2 4.11Å; F419-V444 HydrophobicContact CE2-CG2 3.74Å
420	R	92.8	Very high	90.8	Very high	67 Å²	67	57.8 Å²	57.8	25%	0.253	30%	0.297	S	S	.	.	H	α-helix	trans	-59.5	-36.3	175.8	178.6	168.4	-175.4	141.1	-1.8	112.8	L416 Q417 A418 I422 L423 I424 Y441 Q458 P460	L416-R420 WeakPolarHBondContact O-CB 3.28Å; L416-R420 PolarHBondContact O-N 2.85Å; Q417-R420 PolarHBondContact O-N 2.95Å; A418-R420 VanDerWaalsContact C-N 3.35Å; A418-R420 PolarHBondContact O-N 3.48Å; R420-I422 VanDerWaalsContact C-N 3.31Å; R420-I422 PolarHBondContact O-N 3.03Å; R420-L423 PolarHBondContact O-N 3.43Å; R420-I424 HydrophobicContact CG-CD1 3.57Å; R420-I424 HydrophobicContact CG-CG1 4.31Å; R420-I424 WeakPolarHBondContact O-CG1 3.43Å; R420-I424 PolarHBondContact O-N 2.92Å; R420-I424 VanDerWaalsContact O-N 3.15Å; R420-Y441 HydrophobicContact CB-CE2 4.19Å; R420-Q458 PolarHBondContact NH1-O 2.85Å; R420-P460 HydrophobicContact CG-CB 4.02Å; R420-P460 HydrophobicContact CG-CG 4.44Å
421	Q	90.7	Very high	90.7	Very high	64 Å²	64	56.7 Å²	56.7	30%	0.299	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-37.9	175.3	-66.2	-56.3	-75.6	0	0	112.4	Q417 A418 F419 L423 N425	Q417-Q421 WeakPolarHBondContact O-CG 3.39Å; Q417-Q421 PolarHBondContact O-N 3.41Å; Q417-Q421 VanDerWaalsContact O-N 3.17Å; A418-Q421 PolarHBondContact O-N 3.23Å; F419-Q421 VanDerWaalsContact C-N 3.3Å; F419-Q421 PolarHBondContact O-N 3.1Å; Q421-L423 VanDerWaalsContact C-N 3.29Å; Q421-L423 PolarHBondContact O-N 2.98Å; Q421-N425 WeakPolarHBondContact O-CB 3.49Å; Q421-N425 VanDerWaalsContact O-CG 3.25Å; Q421-N425 PolarHBondContact O-N 3Å; Q421-N425 VanDerWaalsContact O-N 3.11Å
422	I	91.8	Very high	90.6	Very high	1 Å²	1	58 Å²	58	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-67.2	-33	-179.7	-45.9	171.2	0	0	0	111.6	D396 N399 F400 A418 F419 R420 F437	D396-I422 HydrophobicContact CB-CG2 4.21Å; N399-I422 HydrophobicContact CB-CD1 3.78Å; N399-I422 HydrophobicContact CB-CG1 3.48Å; N399-I422 VanDerWaalsContact CB-CG1 3.48Å; F400-I422 HydrophobicContact CB-CD1 3.89Å; F400-I422 HydrophobicContact CD2-CD1 4.5Å; A418-I422 WeakPolarHBondContact O-CG1 3.47Å; F419-I422 HydrophobicContact CD1-CD1 4.01Å; F419-I422 WeakPolarHBondContact O-CB 3.26Å; F419-I422 PolarHBondContact O-N 3.48Å; F419-I422 VanDerWaalsContact O-N 3.11Å; R420-I422 VanDerWaalsContact C-N 3.31Å; R420-I422 PolarHBondContact O-N 3.03Å; I422-F437 HydrophobicContact CB-CD2 4.43Å; I422-F437 HydrophobicContact CD1-CD1 4.35Å; I422-F437 HydrophobicContact CG2-CB 4.34Å; I422-F437 HydrophobicContact CG2-CD1 4.4Å; I422-F437 HydrophobicContact CG2-CD2 3.23Å; I422-F437 HydrophobicContact CG2-CE1 4.49Å; I422-F437 HydrophobicContact CG2-CE2 3.36Å; I422-F437 HydrophobicContact CG2-CG 3.78Å; I422-F437 HydrophobicContact CG2-CZ 4.01Å
423	L	90.9	Very high	90.7	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-82.1	-29.4	-178.6	-63.8	-179	0	0	0	113.5	F419 R420 Q421 F437 L438 Y441 P460 L461 L559	F419-L423 PolarHBondContact O-N 2.51Å; R420-L423 PolarHBondContact O-N 3.43Å; Q421-L423 VanDerWaalsContact C-N 3.29Å; Q421-L423 PolarHBondContact O-N 2.98Å; L423-F437 HydrophobicContact CD2-CB 4.12Å; L423-L438 HydrophobicContact CD1-CD1 4.33Å; L423-L438 HydrophobicContact CD2-CB 4.35Å; L423-Y441 HydrophobicContact CD1-CD1 3.76Å; L423-Y441 HydrophobicContact CD1-CD2 4.2Å; L423-Y441 HydrophobicContact CD1-CG 3.58Å; L423-P460 HydrophobicContact CB-CG 4.47Å; L423-P460 HydrophobicContact CD1-CG 4.1Å; L423-L461 HydrophobicContact CB-CD1 3.94Å; L423-L461 HydrophobicContact CB-CG 4.2Å; L423-L461 HydrophobicContact CD1-CD1 4.08Å; L423-L461 HydrophobicContact CD2-CD1 4.03Å; L423-L461 HydrophobicContact CG-CD1 4.23Å; L423-L559 HydrophobicContact CD2-CD1 4.33Å; L423-L559 HydrophobicContact CD2-CD2 4.42Å
424	I	85.3	Confident	90.8	Very high	57 Å²	57	53.8 Å²	53.8	29%	0.292	27%	0.273	S	S	.	.	H	α-helix	trans	-85.6	-35.4	-179.1	-68	174.8	0	0	0	111.9	R420 P460 H463	R420-I424 HydrophobicContact CG-CD1 3.57Å; R420-I424 HydrophobicContact CG-CG1 4.31Å; R420-I424 WeakPolarHBondContact O-CG1 3.43Å; R420-I424 PolarHBondContact O-N 2.92Å; R420-I424 VanDerWaalsContact O-N 3.15Å; I424-P460 HydrophobicContact CD1-CB 4.01Å; I424-P460 HydrophobicContact CG1-CB 3.86Å; I424-H463 PolarHBondContact O-CE1 3.39Å
425	N	81.3	Confident	90.8	Very high	54 Å²	54	50.6 Å²	50.6	29%	0.289	26%	0.257	S	S	.	.	S	Bend	trans	-75.9	150.2	179.1	-67.3	-5.6	0	0	0	110.7	Q421 S427	Q421-N425 WeakPolarHBondContact O-CB 3.49Å; Q421-N425 VanDerWaalsContact O-CG 3.25Å; Q421-N425 PolarHBondContact O-N 3Å; Q421-N425 VanDerWaalsContact O-N 3.11Å; N425-S427 PolarHBondContact O-N 2.77Å
426	D	80.8	Confident	90.6	Very high	105 Å²	105	51.6 Å²	51.6	56%	0.561	27%	0.266	S	S	*	.			trans	-70.1	76.9	175.9	-65	-55.4	0	0	0	111.1	R428 R556	D426-R428 PolarHBondContact O-N 3.07Å; D426-R556 IonicContact OD1-NH1 2.69Å; D426-R556 IonicContact OD1-NH2 3.33Å
427	S	87.1	Confident	90.7	Very high	10 Å²	10	50.6 Å²	50.6	7%	0.07	26%	0.26	C	S	.	.			trans	-61.2	130.5	179.3	170.5	0	0	0	0	110.6	D396 N425 Q429 Q434	D396-S427 VanDerWaalsContact OD2-CB 3.31Å; D396-S427 WeakPolarHBondContact OD2-CB 3.4Å; D396-S427 PolarHBondContact OD2-OG 2.94Å; N425-S427 PolarHBondContact O-N 2.77Å; S427-Q429 VanDerWaalsContact C-N 3.31Å; S427-Q429 WeakPolarHBondContact OG-CB 3.44Å; S427-Q429 WeakPolarHBondContact OG-CG 3.31Å; S427-Q429 PolarHBondContact OG-N 3.29Å; S427-Q434 PolarHBondContact O-NE2 3.37Å; S427-Q434 PolarHBondContact OG-NE2 3.14Å
428	R	90.1	Very high	90.7	Very high	186 Å²	186	44.7 Å²	44.7	70%	0.702	23%	0.233	S	C	*	.			trans	-88.6	2	178.9	-70.1	-177	-179.2	-172	0.6	113.7	S392 L393 D426 K560	S392-R428 WeakPolarHBondContact OG-CG 3.23Å; L393-R428 HydrophobicContact CD2-CB 3.82Å; L393-R428 HydrophobicContact CG-CB 4.34Å; D426-R428 PolarHBondContact O-N 3.07Å; R428-K560 PolarHBondContact O-NZ 3.34Å
429	Q	92.8	Very high	90.6	Very high	45 Å²	45	48.7 Å²	48.7	21%	0.21	25%	0.246	C	C	.	.	S	Bend	trans	-64.9	172.6	-176.4	-65.7	-76.7	23.6	0	0	113.2	L393 D396 S427 Q433 Q434 F437 K560	L393-Q429 HydrophobicContact CD2-CG 3.95Å; D396-Q429 HydrophobicContact CB-CG 4.21Å; D396-Q429 WeakPolarHBondContact OD2-CG 3.47Å; S427-Q429 VanDerWaalsContact C-N 3.31Å; S427-Q429 WeakPolarHBondContact OG-CB 3.44Å; S427-Q429 WeakPolarHBondContact OG-CG 3.31Å; S427-Q429 PolarHBondContact OG-N 3.29Å; Q429-Q433 HydrophobicContact CB-CB 4.13Å; Q429-Q433 HydrophobicContact CB-CG 4.11Å; Q429-Q433 HydrophobicContact CG-CG 4.24Å; Q429-Q434 HydrophobicContact CB-CG 4.27Å; Q429-F437 HydrophobicContact CB-CE2 4.29Å; Q429-F437 HydrophobicContact CG-CE2 3.95Å; Q429-F437 HydrophobicContact CG-CZ 4.23Å; Q429-K560 PolarHBondContact O-NZ 2.9Å
430	T	93.6	Very high	90.5	Very high	87 Å²	87	51.5 Å²	51.5	53%	0.534	26%	0.26	S	S	.	.			trans	-72.5	155.7	174.1	60.7	0	0	0	0	111.3	T432 Q433 Q434	T430-T432 VanDerWaalsContact C-N 3.26Å; T430-T432 PolarHBondContact O-N 3.1Å; T430-Q433 PolarHBondContact O-N 3.05Å; T430-Q433 WeakPolarHBondContact OG1-CB 3.36Å; T430-Q433 PolarHBondContact OG1-N 2.86Å; T430-Q434 PolarHBondContact O-N 3.3Å
431	A	91.6	Very high	90.5	Very high	41 Å²	41	48.7 Å²	48.7	34%	0.339	25%	0.249	S	C	.	.	H	α-helix	trans	-55.1	-42.1	176.1	0	0	0	0	0	111.9	Q433 Q434 A435 K560 V561	A431-Q433 VanDerWaalsContact C-N 3.31Å; A431-Q433 PolarHBondContact O-N 3.44Å; A431-Q434 PolarHBondContact O-N 3.39Å; A431-A435 WeakPolarHBondContact O-CB 3.16Å; A431-A435 PolarHBondContact O-N 2.84Å; A431-K560 HydrophobicContact CB-CB 4.04Å; A431-K560 WeakPolarHBondContact CB-O 3.41Å; A431-V561 HydrophobicContact CB-CG2 4.06Å; A431-V561 WeakPolarHBondContact O-CG2 3.39Å
432	T	92.2	Very high	90.6	Very high	108 Å²	108	45.7 Å²	45.7	66%	0.663	24%	0.235	S	C	*	.	H	α-helix	trans	-56.7	-41.6	175.1	-41.3	0	0	0	0	112.8	T430 A436	T430-T432 VanDerWaalsContact C-N 3.26Å; T430-T432 PolarHBondContact O-N 3.1Å; T432-A436 PolarHBondContact O-N 3.32Å; T432-A436 VanDerWaalsContact O-N 3.16Å
433	Q	92.6	Very high	90.5	Very high	64 Å²	64	51.6 Å²	51.6	30%	0.299	26%	0.258	S	S	.	.	H	α-helix	trans	-75.7	-37	-179.4	-174	60.5	65.8	0	0	111.8	Q429 T430 A431 A436 F437	Q429-Q433 HydrophobicContact CB-CB 4.13Å; Q429-Q433 HydrophobicContact CB-CG 4.11Å; Q429-Q433 HydrophobicContact CG-CG 4.24Å; T430-Q433 PolarHBondContact O-N 3.05Å; T430-Q433 WeakPolarHBondContact OG1-CB 3.36Å; T430-Q433 PolarHBondContact OG1-N 2.86Å; A431-Q433 VanDerWaalsContact C-N 3.31Å; A431-Q433 PolarHBondContact O-N 3.44Å; Q433-A436 WeakPolarHBondContact O-CB 3.33Å; Q433-A436 PolarHBondContact O-N 3.27Å; Q433-F437 HydrophobicContact CG-CE1 3.96Å; Q433-F437 HydrophobicContact CG-CE2 3.95Å; Q433-F437 HydrophobicContact CG-CZ 3.56Å; Q433-F437 WeakPolarHBondContact O-CD1 3.44Å; Q433-F437 WeakPolarHBondContact O-CD2 3.26Å; Q433-F437 VanDerWaalsContact O-CG 3.23Å; Q433-F437 WeakPolarHBondContact O-CG 3.36Å; Q433-F437 PolarHBondContact O-N 2.85Å
434	Q	92.9	Very high	90.6	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.009	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-38.4	172.4	-70.3	-178.3	-12.5	0	0	112.2	S427 Q429 T430 A431 A436 F437 L438 V561	S427-Q434 PolarHBondContact O-NE2 3.37Å; S427-Q434 PolarHBondContact OG-NE2 3.14Å; Q429-Q434 HydrophobicContact CB-CG 4.27Å; T430-Q434 PolarHBondContact O-N 3.3Å; A431-Q434 PolarHBondContact O-N 3.39Å; Q434-A436 VanDerWaalsContact C-N 3.3Å; Q434-A436 PolarHBondContact O-N 3.44Å; Q434-F437 HydrophobicContact CG-CD2 4.44Å; Q434-F437 WeakPolarHBondContact O-CB 3.18Å; Q434-F437 PolarHBondContact O-N 3.37Å; Q434-L438 PolarHBondContact O-N 2.92Å; Q434-V561 HydrophobicContact CB-CG2 4.1Å
435	A	91.3	Very high	90.8	Very high	10 Å²	10	49 Å²	49	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-37.5	173	0	0	0	0	0	111.9	A431 R439 V561	A431-A435 WeakPolarHBondContact O-CB 3.16Å; A431-A435 PolarHBondContact O-N 2.84Å; A435-R439 WeakPolarHBondContact O-CB 3.34Å; A435-R439 PolarHBondContact O-N 3.41Å; A435-V561 HydrophobicContact CB-CG1 4.29Å; A435-V561 HydrophobicContact CB-CG2 4.02Å
436	A	92	Very high	91.1	Very high	22 Å²	22	51.6 Å²	51.6	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-40.7	172.9	0	0	0	0	0	112.2	T432 Q433 Q434 R439 E440	T432-A436 PolarHBondContact O-N 3.32Å; T432-A436 VanDerWaalsContact O-N 3.16Å; Q433-A436 WeakPolarHBondContact O-CB 3.33Å; Q433-A436 PolarHBondContact O-N 3.27Å; Q434-A436 VanDerWaalsContact C-N 3.3Å; Q434-A436 PolarHBondContact O-N 3.44Å; A436-R439 PolarHBondContact O-N 3.45Å; A436-E440 VanDerWaalsContact O-CG 3.3Å; A436-E440 WeakPolarHBondContact O-CG 3.37Å; A436-E440 PolarHBondContact O-N 3.01Å
437	F	93.4	Very high	91.4	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-44.7	174.4	-58.5	-30.7	0	0	0	112.4	D396 F400 I422 L423 Q429 Q433 Q434 E440 Y441	D396-F437 HydrophobicContact CB-CE2 4.25Å; D396-F437 HydrophobicContact CB-CZ 4.13Å; F400-F437 HydrophobicContact CB-CD1 4.42Å; F400-F437 HydrophobicContact CB-CE1 3.85Å; F400-F437 HydrophobicContact CD1-CE1 4.41Å; F400-F437 AromaticContact CD2-CD1 3.32Å; F400-F437 HydrophobicContact CD2-CD1 3.32Å; F400-F437 AromaticContact CD2-CE1 3.45Å; F400-F437 HydrophobicContact CD2-CE1 3.45Å; F400-F437 VanDerWaalsContact CD2-CE1 3.45Å; F400-F437 AromaticContact CE2-CD1 3.68Å; F400-F437 HydrophobicContact CE2-CD1 3.68Å; F400-F437 HydrophobicContact CE2-CE1 4.01Å; F400-F437 HydrophobicContact CG-CD1 4.04Å; F400-F437 AromaticContact CG-CE1 3.66Å; F400-F437 HydrophobicContact CG-CE1 3.66Å; I422-F437 HydrophobicContact CB-CD2 4.43Å; I422-F437 HydrophobicContact CD1-CD1 4.35Å; I422-F437 HydrophobicContact CG2-CB 4.34Å; I422-F437 HydrophobicContact CG2-CD1 4.4Å; I422-F437 HydrophobicContact CG2-CD2 3.23Å; I422-F437 HydrophobicContact CG2-CE1 4.49Å; I422-F437 HydrophobicContact CG2-CE2 3.36Å; I422-F437 HydrophobicContact CG2-CG 3.78Å; I422-F437 HydrophobicContact CG2-CZ 4.01Å; L423-F437 HydrophobicContact CD2-CB 4.12Å; Q429-F437 HydrophobicContact CB-CE2 4.29Å; Q429-F437 HydrophobicContact CG-CE2 3.95Å; Q429-F437 HydrophobicContact CG-CZ 4.23Å; Q433-F437 HydrophobicContact CG-CE1 3.96Å; Q433-F437 HydrophobicContact CG-CE2 3.95Å; Q433-F437 HydrophobicContact CG-CZ 3.56Å; Q433-F437 WeakPolarHBondContact O-CD1 3.44Å; Q433-F437 WeakPolarHBondContact O-CD2 3.26Å; Q433-F437 VanDerWaalsContact O-CG 3.23Å; Q433-F437 WeakPolarHBondContact O-CG 3.36Å; Q433-F437 PolarHBondContact O-N 2.85Å; Q434-F437 HydrophobicContact CG-CD2 4.44Å; Q434-F437 WeakPolarHBondContact O-CB 3.18Å; Q434-F437 PolarHBondContact O-N 3.37Å; F437-E440 PolarHBondContact O-N 3.49Å; F437-Y441 WeakPolarHBondContact O-CB 3.34Å; F437-Y441 PolarHBondContact O-N 3.35Å
438	L	92.6	Very high	91.3	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-44.8	176	177.4	59.2	0	0	0	111.2	L423 Q434 Y441 L442 L461 L559 L563 L647	L423-L438 HydrophobicContact CD1-CD1 4.33Å; L423-L438 HydrophobicContact CD2-CB 4.35Å; Q434-L438 PolarHBondContact O-N 2.92Å; L438-Y441 PolarHBondContact O-N 3.24Å; L438-L442 HydrophobicContact CD1-CD1 4.32Å; L438-L442 HydrophobicContact CD1-CD2 4.5Å; L438-L442 HydrophobicContact CD1-CG 4.15Å; L438-L442 HydrophobicContact CG-CD1 4.39Å; L438-L442 WeakPolarHBondContact O-CG 3.48Å; L438-L442 PolarHBondContact O-N 3.01Å; L438-L461 HydrophobicContact CD1-CD1 4.27Å; L438-L559 HydrophobicContact CD2-CD1 4.48Å; L438-L563 HydrophobicContact CD2-CD2 3.84Å; L438-L647 HydrophobicContact CD1-CD2 4.18Å
439	R	91.7	Very high	90.9	Very high	89 Å²	89	45.4 Å²	45.4	34%	0.336	24%	0.24	S	C	.	.	H	α-helix	trans	-62.8	-44.7	179.6	-163.3	-168.8	-50.8	137.4	10.9	112.6	A435 A436 L442 Y443 H651	A435-R439 WeakPolarHBondContact O-CB 3.34Å; A435-R439 PolarHBondContact O-N 3.41Å; A436-R439 PolarHBondContact O-N 3.45Å; R439-L442 PolarHBondContact O-N 3.45Å; R439-Y443 WeakPolarHBondContact O-CB 3.33Å; R439-Y443 PolarHBondContact O-N 2.84Å; R439-H651 PolarHBondContact NE-NE2 3.46Å; R439-H651 PolarHBondContact NH2-CE1 3.49Å; R439-H651 PolarHBondContact NH2-NE2 3.32Å
440	E	92.5	Very high	89.6	Confident	61 Å²	61	46 Å²	46	29%	0.285	26%	0.259	S	S	.	.	H	α-helix	trans	-67.7	-37.9	177.9	-65.2	-86.1	151.4	0	0	111.4	F400 F419 A436 F437 Y443 V444	F400-E440 HydrophobicContact CE2-CB 4.46Å; F400-E440 HydrophobicContact CE2-CG 3.99Å; F400-E440 HydrophobicContact CZ-CG 4.43Å; F419-E440 HydrophobicContact CE1-CB 4.16Å; F419-E440 HydrophobicContact CE2-CB 4.19Å; F419-E440 HydrophobicContact CZ-CB 3.9Å; A436-E440 VanDerWaalsContact O-CG 3.3Å; A436-E440 WeakPolarHBondContact O-CG 3.37Å; A436-E440 PolarHBondContact O-N 3.01Å; F437-E440 PolarHBondContact O-N 3.49Å; E440-Y443 PolarHBondContact O-N 3.24Å; E440-V444 PolarHBondContact O-N 2.82Å
441	Y	93.5	Very high	87.8	Confident	8 Å²	8	51 Å²	51	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-58.8	-52.4	172	174.9	-100.3	0	0	0	111.5	L416 F419 R420 L423 F437 L438 Y443 V444 V445 L459 P460	L416-Y441 HydrophobicContact CD2-CD2 4.34Å; L416-Y441 HydrophobicContact CD2-CE2 4.01Å; F419-Y441 HydrophobicContact CB-CD2 3.93Å; F419-Y441 HydrophobicContact CB-CG 4.49Å; R420-Y441 HydrophobicContact CB-CE2 4.19Å; L423-Y441 HydrophobicContact CD1-CD1 3.76Å; L423-Y441 HydrophobicContact CD1-CD2 4.2Å; L423-Y441 HydrophobicContact CD1-CG 3.58Å; F437-Y441 WeakPolarHBondContact O-CB 3.34Å; F437-Y441 PolarHBondContact O-N 3.35Å; L438-Y441 PolarHBondContact O-N 3.24Å; Y441-Y443 VanDerWaalsContact C-N 3.28Å; Y441-Y443 PolarHBondContact O-N 3.39Å; Y441-V444 PolarHBondContact O-N 3.31Å; Y441-V445 HydrophobicContact CD1-CG2 4.29Å; Y441-V445 HydrophobicContact CE1-CG2 3.71Å; Y441-V445 HydrophobicContact CE2-CG2 3.98Å; Y441-V445 WeakPolarHBondContact O-CG2 3.42Å; Y441-V445 PolarHBondContact O-N 3.41Å; Y441-L459 HydrophobicContact CE1-CD2 4.27Å; Y441-P460 HydrophobicContact CD1-CG 4.49Å; Y441-P460 HydrophobicContact CE1-CG 3.9Å; Y441-P460 HydrophobicContact CE2-CG 4.42Å; Y441-P460 WeakPolarHBondContact OH-CD 3.27Å
442	L	91.8	Very high	85.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-41.5	176.8	-64.3	-178.9	0	0	0	110.4	L438 R439 V444 V445 K446 L647 M668 I670	L438-L442 HydrophobicContact CD1-CD1 4.32Å; L438-L442 HydrophobicContact CD1-CD2 4.5Å; L438-L442 HydrophobicContact CD1-CG 4.15Å; L438-L442 HydrophobicContact CG-CD1 4.39Å; L438-L442 WeakPolarHBondContact O-CG 3.48Å; L438-L442 PolarHBondContact O-N 3.01Å; R439-L442 PolarHBondContact O-N 3.45Å; L442-V444 VanDerWaalsContact C-N 3.33Å; L442-V444 PolarHBondContact O-N 3.37Å; L442-V445 PolarHBondContact O-N 2.98Å; L442-V445 VanDerWaalsContact O-N 3.1Å; L442-K446 PolarHBondContact O-N 3.43Å; L442-L647 HydrophobicContact CD2-CD2 4.16Å; L442-L647 HydrophobicContact CD2-CG 4.43Å; L442-M668 VanDerWaalsContact C-SD 3.56Å; L442-M668 HydrophobicContact CB-CG 4Å; L442-M668 HydrophobicContact CB-SD 3.84Å; L442-I670 HydrophobicContact CB-CD1 3.72Å; L442-I670 HydrophobicContact CB-CG1 4.37Å; L442-I670 HydrophobicContact CD2-CB 4.15Å; L442-I670 HydrophobicContact CD2-CD1 3.84Å; L442-I670 HydrophobicContact CD2-CG1 4.11Å; L442-I670 HydrophobicContact CG-CD1 4.34Å; L442-I670 WeakPolarHBondContact O-CD1 3.21Å
443	Y	91.2	Very high	84.2	Confident	125 Å²	125	57.2 Å²	57.2	49%	0.49	30%	0.295	S	S	.	.	H	α-helix	trans	-54.8	-47.3	178.2	-176.3	-97.4	0	0	0	112.8	F407 R439 E440 Y441 K446 S447 M668	F407-Y443 HydrophobicContact CE1-CD1 4.35Å; F407-Y443 AromaticContact CE1-CE1 3.67Å; F407-Y443 HydrophobicContact CE1-CE1 3.67Å; F407-Y443 HydrophobicContact CZ-CD1 4.39Å; F407-Y443 AromaticContact CZ-CE1 3.78Å; F407-Y443 HydrophobicContact CZ-CE1 3.78Å; R439-Y443 WeakPolarHBondContact O-CB 3.33Å; R439-Y443 PolarHBondContact O-N 2.84Å; E440-Y443 PolarHBondContact O-N 3.24Å; Y441-Y443 VanDerWaalsContact C-N 3.28Å; Y441-Y443 PolarHBondContact O-N 3.39Å; Y443-K446 WeakPolarHBondContact O-CA 3.49Å; Y443-K446 PolarHBondContact O-N 3.48Å; Y443-S447 PolarHBondContact O-N 3.11Å; Y443-M668 VanDerWaalsContact CA-SD 3.5Å; Y443-M668 HydrophobicContact CD2-CE 4.38Å; Y443-M668 PolarHBondContact N-SD 2.91Å; Y443-M668 VanDerWaalsContact N-SD 3.38Å
444	V	91.7	Very high	82.6	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	32%	0.315	C	S	.	.	H	α-helix	trans	-67.4	-41	176.7	-177.4	0	0	0	0	111.7	F407 P412 A415 L416 F419 E440 Y441 L442 K446 S447 V448	F407-V444 HydrophobicContact CB-CG2 4.41Å; F407-V444 HydrophobicContact CD2-CB 4.34Å; F407-V444 HydrophobicContact CD2-CG1 3.88Å; F407-V444 HydrophobicContact CD2-CG2 3.66Å; F407-V444 HydrophobicContact CE2-CG1 4.21Å; F407-V444 HydrophobicContact CE2-CG2 4.12Å; F407-V444 HydrophobicContact CG-CG2 3.99Å; P412-V444 HydrophobicContact CB-CG1 4.05Å; A415-V444 HydrophobicContact CB-CG1 4.23Å; A415-V444 HydrophobicContact CB-CG2 4.41Å; L416-V444 HydrophobicContact CD2-CB 3.8Å; L416-V444 HydrophobicContact CD2-CG1 3.56Å; L416-V444 HydrophobicContact CG-CB 4.46Å; L416-V444 HydrophobicContact CG-CG1 3.68Å; F419-V444 HydrophobicContact CD2-CG2 4.11Å; F419-V444 HydrophobicContact CE2-CG2 3.74Å; E440-V444 PolarHBondContact O-N 2.82Å; Y441-V444 PolarHBondContact O-N 3.31Å; L442-V444 VanDerWaalsContact C-N 3.33Å; L442-V444 PolarHBondContact O-N 3.37Å; V444-K446 VanDerWaalsContact C-N 3.33Å; V444-K446 PolarHBondContact O-N 3.13Å; V444-S447 WeakPolarHBondContact CA-OG 3.32Å; V444-S447 PolarHBondContact O-N 3.01Å; V444-S447 PolarHBondContact O-OG 3.16Å; V444-V448 HydrophobicContact CG1-CG2 4.3Å; V444-V448 WeakPolarHBondContact O-CG2 3.47Å; V444-V448 PolarHBondContact O-N 2.96Å; V444-V448 VanDerWaalsContact O-N 3.07Å
445	V	89.9	Confident	81.7	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.024	34%	0.336	C	S	.	.	H	α-helix	trans	-59.3	-44.7	176	177.3	0	0	0	0	111	L416 Y441 L442 S447 V448 L449 P457 I670	L416-V445 HydrophobicContact CD2-CB 4.31Å; L416-V445 HydrophobicContact CD2-CG2 3.39Å; Y441-V445 HydrophobicContact CD1-CG2 4.29Å; Y441-V445 HydrophobicContact CE1-CG2 3.71Å; Y441-V445 HydrophobicContact CE2-CG2 3.98Å; Y441-V445 WeakPolarHBondContact O-CG2 3.42Å; Y441-V445 PolarHBondContact O-N 3.41Å; L442-V445 PolarHBondContact O-N 2.98Å; L442-V445 VanDerWaalsContact O-N 3.1Å; V445-S447 VanDerWaalsContact C-N 3.31Å; V445-S447 PolarHBondContact O-N 2.83Å; V445-V448 PolarHBondContact O-N 3.44Å; V445-L449 HydrophobicContact CG1-CD1 3.89Å; V445-L449 PolarHBondContact O-N 3.31Å; V445-P457 HydrophobicContact CG1-CB 4.14Å; V445-P457 HydrophobicContact CG1-CG 4.16Å; V445-I670 HydrophobicContact CB-CD1 3.69Å; V445-I670 HydrophobicContact CG1-CD1 3.83Å; V445-I670 HydrophobicContact CG1-CG2 3.8Å
446	K	88.1	Confident	81.4	Confident	108 Å²	108	62.7 Å²	62.7	47%	0.47	34%	0.337	S	S	.	.	H	α-helix	trans	-32.3	-63.4	162.1	173.3	-95.1	-164.5	173.1	0	111.9	L442 Y443 V444 M668 I670	L442-K446 PolarHBondContact O-N 3.43Å; Y443-K446 WeakPolarHBondContact O-CA 3.49Å; Y443-K446 PolarHBondContact O-N 3.48Å; V444-K446 VanDerWaalsContact C-N 3.33Å; V444-K446 PolarHBondContact O-N 3.13Å; K446-M668 HydrophobicContact CB-CE 3.95Å; K446-M668 HydrophobicContact CD-CE 3.29Å; K446-M668 HydrophobicContact CG-CE 4.12Å; K446-I670 HydrophobicContact CB-CD1 3.93Å; K446-I670 HydrophobicContact CB-CG1 4.43Å
447	S	87.1	Confident	81.3	Confident	60 Å²	60	62.8 Å²	62.8	42%	0.42	34%	0.336	S	S	.	.	H	α-helix	trans	-73.7	-23.8	-171	68.5	0	0	0	0	115.4	F407 Y443 V444 V445	F407-S447 VanDerWaalsContact CE2-OG 3.25Å; F407-S447 WeakPolarHBondContact CE2-OG 3.48Å; Y443-S447 PolarHBondContact O-N 3.11Å; V444-S447 WeakPolarHBondContact CA-OG 3.32Å; V444-S447 PolarHBondContact O-N 3.01Å; V444-S447 PolarHBondContact O-OG 3.16Å; V445-S447 VanDerWaalsContact C-N 3.31Å; V445-S447 PolarHBondContact O-N 2.83Å
448	V	85.4	Confident	81.2	Confident	53 Å²	53	65.9 Å²	65.9	32%	0.321	35%	0.35	S	S	.	.	H	α-helix	trans	-83.1	-39.4	-179.9	172	0	0	0	0	111.9	P412 L416 V444 V445 G450	P412-V448 HydrophobicContact CB-CG2 3.47Å; P412-V448 VanDerWaalsContact CB-CG2 3.47Å; P412-V448 HydrophobicContact CG-CG2 3.89Å; L416-V448 HydrophobicContact CD1-CB 4.42Å; L416-V448 HydrophobicContact CD1-CG1 4.48Å; L416-V448 HydrophobicContact CD1-CG2 3.99Å; V444-V448 HydrophobicContact CG1-CG2 4.3Å; V444-V448 WeakPolarHBondContact O-CG2 3.47Å; V444-V448 PolarHBondContact O-N 2.96Å; V444-V448 VanDerWaalsContact O-N 3.07Å; V445-V448 PolarHBondContact O-N 3.44Å; V448-G450 VanDerWaalsContact C-N 3.32Å; V448-G450 PolarHBondContact O-N 3.25Å
449	L	80.3	Confident	81.2	Confident	58 Å²	58	65.7 Å²	65.7	30%	0.304	35%	0.349	S	S	.	.	H	α-helix	trans	-64.2	-34.6	-177.1	-112.4	152.1	0	0	0	112.9	V445 P457	V445-L449 HydrophobicContact CG1-CD1 3.89Å; V445-L449 PolarHBondContact O-N 3.31Å; L449-P457 HydrophobicContact CD1-CB 4.37Å; L449-P457 HydrophobicContact CD1-CG 3.76Å; L449-P457 HydrophobicContact CD2-CB 4.26Å; L449-P457 HydrophobicContact CD2-CG 4.4Å
450	G	65.5	Low	81.2	Confident	58 Å²	58	61.8 Å²	61.8	60%	0.598	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	-149.3	-174.1	0	0	0	0	0	111.9	V448	V448-G450 VanDerWaalsContact C-N 3.32Å; V448-G450 PolarHBondContact O-N 3.25Å
451	E	56.9	Low	81.2	Confident	190 Å²	190	58.9 Å²	58.9	89%	0.888	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-0.6	173	-62.5	-172.5	159.2	0	0	113.1	E453	E451-E453 PolarHBondContact O-N 3.27Å
452	N	51.9	Low	81.3	Confident	137 Å²	137	58.5 Å²	58.5	73%	0.733	32%	0.321	S	S	*	.			trans	-90.1	82.7	-174.7	-75.2	-28.5	0	0	0	111.5	S454	N452-S454 PolarHBondContact O-N 3.39Å
453	E	56.4	Low	81.4	Confident	143 Å²	143	60.7 Å²	60.7	67%	0.668	33%	0.331	S	S	*	.			trans	-69.7	35.2	178.3	-60	-161	142.4	0	0	115.3	E451 C455	E451-E453 PolarHBondContact O-N 3.27Å; E453-C455 PolarHBondContact O-N 3.01Å
454	S	59.3	Low	81.6	Confident	105 Å²	105	56.1 Å²	56.1	73%	0.734	31%	0.314	S	S	*	.	S	Bend	trans	-76.9	-14.4	-173	63.3	0	0	0	0	115.5	N452	N452-S454 PolarHBondContact O-N 3.39Å
455	C	72.8	Confident	81.7	Confident	65 Å²	65	59.6 Å²	59.6	44%	0.439	33%	0.33	S	S	.	.	S	Bend	trans	-157.9	141.9	170	-175.3	0	0	0	0	110.9	E453 E597 R673	E453-C455 PolarHBondContact O-N 3.01Å; C455-E597 PolarHBondContact SG-OE1 2.69Å; C455-R673 PolarHBondContact SG-NH2 3.39Å; C455-R673 VanDerWaalsContact SG-NH2 3.35Å
456	L	85.8	Confident	81.8	Confident	22 Å²	22	60.2 Å²	60.2	12%	0.115	34%	0.335	C	S	.	.			trans	-75.9	135.7	-178.6	-69.1	179.1	0	0	0	112	E597 I644 R671 R673	L456-E597 HydrophobicContact CB-CG 4.43Å; L456-E597 HydrophobicContact CD1-CG 4.05Å; L456-E597 HydrophobicContact CG-CG 4.07Å; L456-E597 PolarHBondContact N-OE1 2.89Å; L456-I644 HydrophobicContact CD1-CB 4.49Å; L456-I644 HydrophobicContact CD1-CD1 3.92Å; L456-I644 HydrophobicContact CD1-CG1 3.74Å; L456-I644 HydrophobicContact CD1-CG2 3.9Å; L456-R671 HydrophobicContact CD1-CG 4.48Å; L456-R671 HydrophobicContact CD2-CB 4.29Å; L456-R671 HydrophobicContact CD2-CG 3.88Å; L456-R673 HydrophobicContact CB-CB 4.33Å; L456-R673 HydrophobicContact CB-CG 4Å
457	P	89.6	Confident	82	Confident	23 Å²	23	58.8 Å²	58.8	15%	0.149	34%	0.339	C	S	.	.			trans	-66.1	141.4	180	29.6	-37.7	0	0	0	111.4	V445 L449 L459 I670 R671 G672 R673	V445-P457 HydrophobicContact CG1-CB 4.14Å; V445-P457 HydrophobicContact CG1-CG 4.16Å; L449-P457 HydrophobicContact CD1-CB 4.37Å; L449-P457 HydrophobicContact CD1-CG 3.76Å; L449-P457 HydrophobicContact CD2-CB 4.26Å; L449-P457 HydrophobicContact CD2-CG 4.4Å; P457-L459 PolarHBondContact O-N 3.19Å; P457-I670 HydrophobicContact CG-CG2 4.17Å; P457-R671 VanDerWaalsContact CD-O 3.31Å; P457-R671 WeakPolarHBondContact CD-O 3.31Å; P457-R671 VanDerWaalsContact CG-O 3.3Å; P457-R671 WeakPolarHBondContact CG-O 3.34Å; P457-G672 VanDerWaalsContact O-CA 3.31Å; P457-G672 WeakPolarHBondContact O-CA 3.08Å; P457-R673 PolarHBondContact O-N 2.93Å
458	Q	90.3	Very high	82.3	Confident	69 Å²	69	58.1 Å²	58.1	32%	0.322	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-80.3	100.5	174.9	-167.3	-167.7	70.2	0	0	110.8	R420 R673 D675	R420-Q458 PolarHBondContact NH1-O 2.85Å; Q458-R673 VanDerWaalsContact CA-O 3.32Å; Q458-R673 WeakPolarHBondContact CA-O 3.34Å; Q458-D675 PolarHBondContact NE2-OD2 2.9Å
459	L	93	Very high	82.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	32%	0.321	C	S	.	.			trans	-72.7	147.4	-178	-63.5	175.2	0	0	0	111.7	Y441 P457 Y645 L647 I670 R673 Q674	Y441-L459 HydrophobicContact CE1-CD2 4.27Å; P457-L459 PolarHBondContact O-N 3.19Å; L459-Y645 HydrophobicContact CB-CE2 4.43Å; L459-Y645 HydrophobicContact CD1-CD2 4.16Å; L459-Y645 HydrophobicContact CD1-CE2 3.54Å; L459-L647 HydrophobicContact CD1-CB 3.87Å; L459-L647 HydrophobicContact CD1-CD2 4.34Å; L459-I670 HydrophobicContact CD2-CG2 4.3Å; L459-R673 PolarHBondContact N-O 3.48Å; L459-R673 VanDerWaalsContact N-O 3.11Å; L459-Q674 VanDerWaalsContact O-CG 3.25Å; L459-Q674 WeakPolarHBondContact O-CG 3.44Å; L459-Q674 PolarHBondContact O-NE2 2.85Å
460	P	92.6	Very high	83.5	Confident	6 Å²	6	54.8 Å²	54.8	4%	0.039	31%	0.314	C	S	.	.			trans	-86.5	-14.8	178.8	32.9	-35	0	0	0	114	R420 L423 I424 Y441 H463	R420-P460 HydrophobicContact CG-CB 4.02Å; R420-P460 HydrophobicContact CG-CG 4.44Å; L423-P460 HydrophobicContact CB-CG 4.47Å; L423-P460 HydrophobicContact CD1-CG 4.1Å; I424-P460 HydrophobicContact CD1-CB 4.01Å; I424-P460 HydrophobicContact CG1-CB 3.86Å; Y441-P460 HydrophobicContact CD1-CG 4.49Å; Y441-P460 HydrophobicContact CE1-CG 3.9Å; Y441-P460 HydrophobicContact CE2-CG 4.42Å; Y441-P460 WeakPolarHBondContact OH-CD 3.27Å; P460-H463 PolarHBondContact O-CD2 3.44Å
461	L	93.1	Very high	84.9	Confident	1 Å²	1	52 Å²	52	1%	0.005	29%	0.286	C	S	.	.			trans	-134.1	138.6	-170.3	-69.1	-179.4	0	0	0	111.7	L423 L438 P558 L559 L563 Y645 L647	L423-L461 HydrophobicContact CB-CD1 3.94Å; L423-L461 HydrophobicContact CB-CG 4.2Å; L423-L461 HydrophobicContact CD1-CD1 4.08Å; L423-L461 HydrophobicContact CD2-CD1 4.03Å; L423-L461 HydrophobicContact CG-CD1 4.23Å; L438-L461 HydrophobicContact CD1-CD1 4.27Å; L461-P558 HydrophobicContact CD2-CG 3.3Å; L461-L559 HydrophobicContact CD1-CD1 3.6Å; L461-L559 HydrophobicContact CD1-CD2 4.45Å; L461-L559 HydrophobicContact CD1-CG 3.98Å; L461-L563 HydrophobicContact CB-CD1 4.18Å; L461-Y645 PolarHBondContact O-OH 2.92Å; L461-L647 HydrophobicContact CB-CD2 4.38Å
462	P	94.5	Very high	86.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.246	C	C	.	.	S	Bend	cis	-69.8	177	-2.1	33.3	-41.6	0	0	0	112.8	F555 R556 L563 L565 L618 Q674	P462-F555 HydrophobicContact CB-CB 4.35Å; P462-F555 HydrophobicContact CG-CB 4.18Å; P462-F555 HydrophobicContact CG-CD1 3.57Å; P462-F555 HydrophobicContact CG-CE1 4.38Å; P462-F555 HydrophobicContact CG-CG 4.26Å; P462-R556 WeakPolarHBondContact CB-O 3.33Å; P462-L563 HydrophobicContact CB-CD1 4.35Å; P462-L565 HydrophobicContact CG-CD1 3.92Å; P462-L618 HydrophobicContact CB-CD1 4.28Å; P462-L618 HydrophobicContact CG-CD1 4.3Å; P462-Q674 PolarHBondContact O-NE2 3.33Å; P462-Q674 PolarHBondContact O-OE1 2.91Å; P462-Q674 VanDerWaalsContact O-OE1 3.11Å
463	H	93.9	Very high	88.7	Confident	46 Å²	46	37.9 Å²	37.9	21%	0.213	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	131.4	167.6	-69.2	177.4	0	0	0	110	I424 P460 F555 R556	I424-H463 PolarHBondContact O-CE1 3.39Å; P460-H463 PolarHBondContact O-CD2 3.44Å; H463-F555 CarbonylContact O-C 3.5Å; H463-F555 WeakPolarHBondContact O-CA 3.35Å; H463-R556 HydrophobicContact CB-CB 4.43Å; H463-R556 PolarHBondContact N-O 3.13Å; H463-R556 PolarHBondContact O-N 3.14Å
464	I	95.3	Very high	90.1	Very high	28 Å²	28	31.6 Å²	31.6	14%	0.144	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.9	174.4	-61.9	175.1	0	0	0	110	S466 V553 F555 V643 Q674 L676	I464-S466 VanDerWaalsContact C-N 3.32Å; I464-S466 PolarHBondContact O-N 3.41Å; I464-S466 VanDerWaalsContact O-N 3.16Å; I464-V553 HydrophobicContact CG2-CG1 3.7Å; I464-F555 HydrophobicContact CD1-CD1 4.38Å; I464-F555 HydrophobicContact CD1-CE1 3.87Å; I464-F555 HydrophobicContact CG1-CD1 3.72Å; I464-F555 HydrophobicContact CG1-CE1 3.72Å; I464-V643 HydrophobicContact CD1-CG2 3.57Å; I464-Q674 HydrophobicContact CD1-CB 3.66Å; I464-Q674 VanDerWaalsContact CD1-OE1 3.29Å; I464-L676 HydrophobicContact CG2-CD2 3.79Å
465	H	94.3	Very high	91.1	Very high	74 Å²	74	30.4 Å²	30.4	34%	0.343	17%	0.171	S	C	.	.			trans	-87.1	69	173.7	-66.6	179.2	0	0	0	110.4	S467 A468 T554	H465-S467 PolarHBondContact O-N 2.89Å; H465-A468 HydrophobicContact CB-CB 4.36Å; H465-A468 WeakPolarHBondContact O-CB 3.35Å; H465-A468 PolarHBondContact O-N 3.3Å; H465-T554 HydrophobicContact CB-CG2 4.33Å; H465-T554 PolarHBondContact N-O 2.87Å
466	S	92.6	Very high	91	Very high	18 Å²	18	32.1 Å²	32.1	13%	0.126	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-56.3	-26.2	-169.1	-52.5	0	0	0	0	115.4	I464 A468 T469 K677	I464-S466 VanDerWaalsContact C-N 3.32Å; I464-S466 PolarHBondContact O-N 3.41Å; I464-S466 VanDerWaalsContact O-N 3.16Å; S466-A468 VanDerWaalsContact C-N 3.33Å; S466-T469 WeakPolarHBondContact O-CB 3.4Å; S466-T469 PolarHBondContact O-N 3.32Å; S466-T469 PolarHBondContact O-OG1 3.08Å; S466-T469 VanDerWaalsContact O-OG1 3.13Å; S466-K677 WeakPolarHBondContact CB-O 3.5Å
467	S	90.6	Very high	90.3	Very high	78 Å²	78	36.7 Å²	36.7	55%	0.545	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-68.1	-32.6	176.1	52.8	0	0	0	0	112.8	H465 T469 S533 R700	H465-S467 PolarHBondContact O-N 2.89Å; S467-T469 VanDerWaalsContact C-N 3.28Å; S467-T469 PolarHBondContact O-N 3.11Å; S467-S533 WeakPolarHBondContact O-CB 3.35Å; S467-R700 PolarHBondContact O-NH1 2.67Å; S467-R700 VanDerWaalsContact O-NH1 3.16Å
468	A	93.1	Very high	89.5	Confident	45 Å²	45	42.1 Å²	42.1	37%	0.372	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-79.1	-6.4	178.7	0	0	0	0	0	113.6	H465 S466 R470	H465-A468 HydrophobicContact CB-CB 4.36Å; H465-A468 WeakPolarHBondContact O-CB 3.35Å; H465-A468 PolarHBondContact O-N 3.3Å; S466-A468 VanDerWaalsContact C-N 3.33Å; A468-R470 PolarHBondContact O-N 3.02Å
469	T	95.4	Very high	88.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.			trans	-59.8	124.8	-179.8	-59.3	0	0	0	0	111.6	S466 S467 V551 E552 V553 I678 R700 L701	S466-T469 WeakPolarHBondContact O-CB 3.4Å; S466-T469 PolarHBondContact O-N 3.32Å; S466-T469 PolarHBondContact O-OG1 3.08Å; S466-T469 VanDerWaalsContact O-OG1 3.13Å; S467-T469 VanDerWaalsContact C-N 3.28Å; S467-T469 PolarHBondContact O-N 3.11Å; T469-V551 HydrophobicContact CG2-CG1 3.59Å; T469-E552 VanDerWaalsContact CA-O 3.29Å; T469-E552 WeakPolarHBondContact CA-O 3.32Å; T469-V553 HydrophobicContact CG2-CG2 4.43Å; T469-I678 HydrophobicContact CG2-CD1 4.41Å; T469-R700 PolarHBondContact O-NH1 3.03Å; T469-L701 HydrophobicContact CG2-CD2 4.42Å
470	R	95.4	Very high	87.8	Confident	41 Å²	41	48.3 Å²	48.3	16%	0.155	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	149.5	175	-59.4	167.6	59.5	-160.7	11.8	110	A468 L492 Q494 L531 N532 V551 E552	A468-R470 PolarHBondContact O-N 3.02Å; R470-L492 VanDerWaalsContact CZ-O 3.27Å; R470-L492 PolarHBondContact NH1-O 3.03Å; R470-L492 PolarHBondContact NH2-O 3.4Å; R470-Q494 PolarHBondContact NH2-O 3.21Å; R470-L531 CarbonylContact C-O 3.53Å; R470-L531 VanDerWaalsContact CA-O 3.27Å; R470-L531 WeakPolarHBondContact CA-O 3.21Å; R470-N532 HydrophobicContact CG-CB 3.9Å; R470-V551 CarbonylContact O-C 3.36Å; R470-V551 WeakPolarHBondContact O-CA 3.46Å; R470-E552 HydrophobicContact CB-CB 4.13Å; R470-E552 WeakPolarHBondContact CD-OE1 3.49Å; R470-E552 IonicContact CZ-OE1 3.52Å; R470-E552 PolarHBondContact N-O 3.4Å; R470-E552 IonicContact NE-OE1 2.67Å; R470-E552 IonicContact NH1-OE1 3.43Å; R470-E552 PolarHBondContact NH1-OE1 3.26Å; R470-E552 PolarHBondContact O-N 2.9Å
471	V	96	Very high	87.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.9	178	-169.2	0	0	0	0	108.3	F473 C530 L531 I549 I550 V551 R700 L701	V471-F473 HydrophobicContact CB-CE2 4.16Å; V471-F473 HydrophobicContact CB-CZ 4.34Å; V471-F473 HydrophobicContact CG1-CD2 4.36Å; V471-F473 HydrophobicContact CG1-CE1 4.02Å; V471-F473 HydrophobicContact CG1-CE2 3.59Å; V471-F473 HydrophobicContact CG1-CZ 3.39Å; V471-C530 CarbonylContact O-C 3.49Å; V471-C530 WeakPolarHBondContact O-CA 3.17Å; V471-L531 PolarHBondContact N-O 3.07Å; V471-L531 PolarHBondContact O-N 3.33Å; V471-I549 HydrophobicContact CG1-CG2 3.94Å; V471-I550 CarbonylContact C-O 3.35Å; V471-I550 WeakPolarHBondContact CA-O 3.22Å; V471-V551 HydrophobicContact CG1-CG2 4.38Å; V471-V551 HydrophobicContact CG2-CG1 4.49Å; V471-R700 HydrophobicContact CG2-CB 4.45Å; V471-R700 HydrophobicContact CG2-CG 4.05Å; V471-L701 HydrophobicContact CG2-CD2 3.7Å
472	Y	95.4	Very high	86.6	Confident	13 Å²	13	59.2 Å²	59.2	5%	0.051	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.6	175.8	173.5	-98.5	0	0	0	110.6	G474 H475 V490 L492 C529 C530 I549 I550	Y472-G474 VanDerWaalsContact CE1-O 3.23Å; Y472-G474 WeakPolarHBondContact CE1-O 3.32Å; Y472-H475 PolarHBondContact OH-O 2.93Å; Y472-V490 HydrophobicContact CE2-CB 4.44Å; Y472-V490 HydrophobicContact CE2-CG1 4.36Å; Y472-L492 HydrophobicContact CG-CG 4.22Å; Y472-C529 CarbonylContact C-O 3.57Å; Y472-C529 VanDerWaalsContact CA-O 3.3Å; Y472-C529 WeakPolarHBondContact CA-O 3.32Å; Y472-C529 HydrophobicContact CD2-CB 4.41Å; Y472-C529 HydrophobicContact CE2-CB 4.16Å; Y472-C530 HydrophobicContact CD2-CB 4.37Å; Y472-I549 WeakPolarHBondContact O-CA 3.43Å; Y472-I550 HydrophobicContact CD1-CD1 4.1Å; Y472-I550 HydrophobicContact CD1-CG1 4.43Å; Y472-I550 PolarHBondContact N-O 3.47Å; Y472-I550 PolarHBondContact O-N 3.02Å
473	F	93.6	Very high	85.9	Confident	18 Å²	18	66.9 Å²	66.9	8%	0.079	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.5	177.5	-59.7	-79	0	0	0	109.1	V471 C529 L531 P541 A543 I549 P703	V471-F473 HydrophobicContact CB-CE2 4.16Å; V471-F473 HydrophobicContact CB-CZ 4.34Å; V471-F473 HydrophobicContact CG1-CD2 4.36Å; V471-F473 HydrophobicContact CG1-CE1 4.02Å; V471-F473 HydrophobicContact CG1-CE2 3.59Å; V471-F473 HydrophobicContact CG1-CZ 3.39Å; F473-C529 PolarHBondContact N-O 3.28Å; F473-L531 HydrophobicContact CE2-CD1 3.94Å; F473-L531 HydrophobicContact CE2-CG 4.23Å; F473-P541 HydrophobicContact CD2-CB 4.2Å; F473-P541 HydrophobicContact CE1-CB 4.29Å; F473-P541 HydrophobicContact CE1-CG 4.41Å; F473-P541 HydrophobicContact CE2-CB 3.49Å; F473-P541 VanDerWaalsContact CE2-CB 3.49Å; F473-P541 HydrophobicContact CE2-CG 3.8Å; F473-P541 HydrophobicContact CZ-CB 3.55Å; F473-P541 HydrophobicContact CZ-CG 3.5Å; F473-P541 VanDerWaalsContact CZ-CG 3.5Å; F473-A543 HydrophobicContact CD1-CB 3.8Å; F473-A543 HydrophobicContact CE1-CB 4.17Å; F473-I549 HydrophobicContact CD1-CB 4.47Å; F473-I549 HydrophobicContact CD1-CD1 4.43Å; F473-I549 HydrophobicContact CD1-CG1 3.99Å; F473-I549 HydrophobicContact CD1-CG2 3.97Å; F473-I549 HydrophobicContact CE1-CB 4.47Å; F473-I549 HydrophobicContact CE1-CD1 4.21Å; F473-I549 HydrophobicContact CE1-CG1 4.14Å; F473-I549 HydrophobicContact CE1-CG2 3.62Å; F473-I549 HydrophobicContact CZ-CG2 4.39Å; F473-P703 HydrophobicContact CE1-CB 3.62Å; F473-P703 HydrophobicContact CE1-CG 3.95Å; F473-P703 HydrophobicContact CZ-CB 4.02Å; F473-P703 HydrophobicContact CZ-CG 4.34Å
474	G	85.2	Confident	85.5	Confident	11 Å²	11	67.8 Å²	67.8	11%	0.113	36%	0.36	C	S	.	.	S	Bend	trans	135	174.8	173.7	0	0	0	0	0	112.7	Y472 P548	Y472-G474 VanDerWaalsContact CE1-O 3.23Å; Y472-G474 WeakPolarHBondContact CE1-O 3.32Å; G474-P548 PolarHBondContact N-O 3.32Å; G474-P548 WeakPolarHBondContact O-CG 3.44Å
475	H	79.6	Confident	85.2	Confident	79 Å²	79	70.2 Å²	70.2	37%	0.366	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-71.8	152.3	-173.4	-132.3	75.4	0	0	0	113.2	Y472 L711	Y472-H475 PolarHBondContact OH-O 2.93Å; H475-L711 HydrophobicContact CB-CD2 3.77Å
476	E	71.2	Confident	85	Confident	102 Å²	102	68.1 Å²	68.1	48%	0.477	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-70.9	138.5	162.1	-82	164.2	-142.3	0	0	109.3	R478 I550 K629	E476-R478 PolarHBondContact O-N 3.42Å; E476-I550 HydrophobicContact CG-CD1 4.39Å; E476-K629 WeakPolarHBondContact OE1-CE 3.47Å; E476-K629 IonicContact OE1-NZ 2.61Å; E476-K629 PolarHBondContact OE1-NZ 3.04Å; E476-K629 IonicContact OE2-NZ 3.99Å
477	R	70.8	Confident	84.9	Confident	117 Å²	117	67.6 Å²	67.6	44%	0.442	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-73.5	129.8	-177.9	-79.6	178.2	-98.9	162.6	-26.6	110.8	T488 H489 V490	R477-T488 PolarHBondContact NH1-O 3.16Å; R477-T488 PolarHBondContact NH2-O 3.42Å; R477-H489 PolarHBondContact NH2-O 2.8Å; R477-V490 VanDerWaalsContact NH2-C 3.3Å; R477-V490 PolarHBondContact NH2-O 3.44Å
478	R	72.5	Confident	84.6	Confident	137 Å²	137	66.3 Å²	66.3	52%	0.517	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-59.5	138.2	160.9	-89.1	-176.3	-79.8	-124.8	-31.9	110.3	E476 E713 V738	E476-R478 PolarHBondContact O-N 3.42Å; R478-E713 IonicContact CZ-OE1 2.86Å; R478-E713 VanDerWaalsContact CZ-OE1 3.29Å; R478-E713 IonicContact CZ-OE2 3.39Å; R478-E713 VanDerWaalsContact NE-CD 3.35Å; R478-E713 IonicContact NE-OE1 3.18Å; R478-E713 PolarHBondContact NE-OE1 3.47Å; R478-E713 IonicContact NE-OE2 3.27Å; R478-E713 PolarHBondContact NE-OE2 2.83Å; R478-E713 IonicContact NH2-OE1 2.67Å; R478-E713 PolarHBondContact NH2-OE1 3.34Å; R478-E713 IonicContact NH2-OE2 2.71Å; R478-V738 VanDerWaalsContact NH2-CG1 3.27Å
479	L	73.2	Confident	84.3	Confident	164 Å²	164	65.5 Å²	65.5	86%	0.859	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-66.1	138.1	167.7	-63.8	175.5	0	0	0	108.8
480	A	76.1	Confident	83.9	Confident	37 Å²	37	66.2 Å²	66.2	31%	0.306	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-74.4	135.5	178.8	0	0	0	0	0	110.6	K484 A486 F715	A480-K484 HydrophobicContact CB-CB 4.02Å; A480-K484 WeakPolarHBondContact CB-O 3.36Å; A480-A486 HydrophobicContact CB-CB 4.14Å; A480-F715 HydrophobicContact CB-CD1 4.12Å; A480-F715 HydrophobicContact CB-CE1 4.18Å
481	E	77.3	Confident	83.4	Confident	160 Å²	160	65.7 Å²	65.7	75%	0.748	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-91.5	131.7	-179.2	-64.9	179.3	173.7	0	0	111.8	K484	E481-K484 WeakPolarHBondContact O-CB 3.14Å; E481-K484 WeakPolarHBondContact O-CG 3.37Å
482	G	81.5	Confident	82.9	Confident	75 Å²	75	66.3 Å²	66.3	77%	0.773	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	-138.2	178.1	0	0	0	0	0	113.1	K484	G482-K484 PolarHBondContact O-N 3.35Å; G482-K484 VanDerWaalsContact O-N 3.1Å
483	D	80.3	Confident	82.4	Confident	162 Å²	162	71.5 Å²	71.5	87%	0.866	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	14.8	-178.1	-56	-28.6	0	0	0	114
484	K	86.4	Confident	82	Confident	64 Å²	64	74.9 Å²	74.9	28%	0.278	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	138.4	178.4	-65.3	-173.3	-171.9	-167.7	0	110.3	A480 E481 G482 F715 L717 E734	A480-K484 HydrophobicContact CB-CB 4.02Å; A480-K484 WeakPolarHBondContact CB-O 3.36Å; E481-K484 WeakPolarHBondContact O-CB 3.14Å; E481-K484 WeakPolarHBondContact O-CG 3.37Å; G482-K484 PolarHBondContact O-N 3.35Å; G482-K484 VanDerWaalsContact O-N 3.1Å; K484-F715 HydrophobicContact CB-CB 4.3Å; K484-F715 HydrophobicContact CB-CD1 4.27Å; K484-F715 HydrophobicContact CD-CB 4.13Å; K484-F715 HydrophobicContact CD-CD1 4.33Å; K484-F715 HydrophobicContact CD-CG 4.2Å; K484-F715 HydrophobicContact CG-CB 4.5Å; K484-L717 HydrophobicContact CG-CD2 3.97Å; K484-L717 HydrophobicContact CG-CG 4.1Å; K484-E734 WeakPolarHBondContact CE-OE2 3.38Å; K484-E734 IonicContact NZ-OE1 3.43Å; K484-E734 IonicContact NZ-OE2 3.16Å; K484-E734 PolarHBondContact NZ-OE2 3.13Å
485	Q	88.8	Confident	82.1	Confident	80 Å²	80	82.7 Å²	82.7	37%	0.374	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	116.3	167.6	179.9	179.6	1.6	0	0	109	F715 F716	Q485-F715 CarbonylContact O-C 3.58Å; Q485-F715 WeakPolarHBondContact O-CA 3.24Å; Q485-F716 HydrophobicContact CB-CB 4.4Å; Q485-F716 PolarHBondContact N-O 3.47Å; Q485-F716 PolarHBondContact O-N 3.47Å
486	A	90.4	Very high	82.5	Confident	30 Å²	30	81.5 Å²	81.5	25%	0.248	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	149.9	173.6	0	0	0	0	0	111.6	A480 F715	A480-A486 HydrophobicContact CB-CB 4.14Å; A486-F715 HydrophobicContact CB-CD1 4.05Å; A486-F715 HydrophobicContact CB-CE1 3.98Å
487	A	89.9	Confident	83.5	Confident	6 Å²	6	80 Å²	80	5%	0.05	42%	0.417	C	S	.	.			trans	-54.8	142	169.8	0	0	0	0	0	111.6	V714 F716 L862 H864	A487-V714 HydrophobicContact CB-CB 4.18Å; A487-V714 PolarHBondContact N-O 3.4Å; A487-F716 HydrophobicContact CB-CE2 4.23Å; A487-L862 HydrophobicContact CB-CD2 3.76Å; A487-L862 HydrophobicContact CB-CG 4.25Å; A487-H864 HydrophobicContact CB-CB 4.15Å
488	T	85.1	Confident	84.4	Confident	51 Å²	51	79.1 Å²	79.1	31%	0.313	42%	0.417	S	S	.	.			trans	-72.3	-34.3	-168	46.7	0	0	0	0	113.7	R477 H864 T865	R477-T488 PolarHBondContact NH1-O 3.16Å; R477-T488 PolarHBondContact NH2-O 3.42Å; T488-H864 PolarHBondContact N-ND1 3.42Å; T488-H864 VanDerWaalsContact N-ND1 3.16Å; T488-H864 VanDerWaalsContact OG1-CA 3.3Å; T488-H864 WeakPolarHBondContact OG1-CA 3.33Å; T488-H864 PolarHBondContact OG1-ND1 2.93Å; T488-T865 PolarHBondContact OG1-N 3.22Å
489	H	86.8	Confident	85.2	Confident	29 Å²	29	78.9 Å²	78.9	13%	0.134	43%	0.427	C	S	.	.			trans	46.7	-179.8	179	-155.4	-107.8	0	0	0	116.6	R477 L862 R863	R477-H489 PolarHBondContact NH2-O 2.8Å; H489-L862 HydrophobicContact CB-CD1 4.45Å; H489-L862 VanDerWaalsContact CD2-CD1 3.49Å; H489-L862 WeakPolarHBondContact CD2-CD1 3.15Å; H489-R863 WeakPolarHBondContact CA-O 3.39Å; H489-R863 PolarHBondContact N-O 3.42Å
490	V	86	Confident	86.1	Confident	14 Å²	14	73.2 Å²	73.2	9%	0.085	40%	0.397	C	S	.	.			trans	-73.2	147.4	167.4	-175.1	0	0	0	0	109.6	Y472 R477 C529 C530	Y472-V490 HydrophobicContact CE2-CB 4.44Å; Y472-V490 HydrophobicContact CE2-CG1 4.36Å; R477-V490 VanDerWaalsContact NH2-C 3.3Å; R477-V490 PolarHBondContact NH2-O 3.44Å; V490-C529 HydrophobicContact CB-CB 4.45Å; V490-C529 HydrophobicContact CG2-CB 4.42Å; V490-C530 HydrophobicContact CG1-CB 4.02Å
491	S	85.4	Confident	86.8	Confident	31 Å²	31	72 Å²	72	22%	0.217	39%	0.387	C	S	.	.			trans	-135	161.4	166.8	58.1	0	0	0	0	110.7	D493 Q494	S491-D493 VanDerWaalsContact C-N 3.3Å; S491-Q494 PolarHBondContact OG-N 2.99Å
492	L	84.5	Confident	87.5	Confident	12 Å²	12	67.5 Å²	67.5	6%	0.063	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-26.4	170	-79.9	168.4	0	0	0	112.5	R470 Y472 Q494 I550 R627	R470-L492 VanDerWaalsContact CZ-O 3.27Å; R470-L492 PolarHBondContact NH1-O 3.03Å; R470-L492 PolarHBondContact NH2-O 3.4Å; Y472-L492 HydrophobicContact CG-CG 4.22Å; L492-Q494 PolarHBondContact O-N 3.26Å; L492-I550 HydrophobicContact CD1-CB 4.04Å; L492-I550 HydrophobicContact CD1-CD1 4.43Å; L492-I550 HydrophobicContact CD1-CG2 3.58Å; L492-R627 HydrophobicContact CD1-CG 4.46Å
493	D	85.8	Confident	88	Confident	123 Å²	123	66.1 Å²	66.1	66%	0.658	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.6	179.1	-49.3	-57.6	0	0	0	113.1	S491 R627	S491-D493 VanDerWaalsContact C-N 3.3Å; D493-R627 IonicContact OD1-CZ 3.54Å; D493-R627 IonicContact OD1-NH1 3.6Å; D493-R627 PolarHBondContact OD1-NH1 2.97Å; D493-R627 IonicContact OD1-NH2 2.74Å; D493-R627 PolarHBondContact OD1-NH2 3.19Å; D493-R627 IonicContact OD2-NH1 2.87Å
494	Q	85.5	Confident	88.7	Confident	89 Å²	89	59 Å²	59	42%	0.416	31%	0.305	S	S	.	.	S	Bend	trans	-82.4	133.6	172.7	-165.5	-179.9	3.4	0	0	110.5	R470 S491 L492	R470-Q494 PolarHBondContact NH2-O 3.21Å; S491-Q494 PolarHBondContact OG-N 2.99Å; L492-Q494 PolarHBondContact O-N 3.26Å
495	E	87.2	Confident	89.1	Confident	175 Å²	175	57.5 Å²	57.5	82%	0.818	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-70.6	160.2	168.8	-64.5	-169.9	169.1	0	0	111.4
496	Y	88.8	Confident	89.3	Confident	53 Å²	53	58.2 Å²	58.2	21%	0.208	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-83.2	122.3	178	177.7	-93.3	0	0	0	110.9	Q498 S501 N532 Q534 T535	Y496-Q498 HydrophobicContact CE1-CB 4.22Å; Y496-Q498 PolarHBondContact OH-OE1 3.25Å; Y496-S501 PolarHBondContact OH-OG 2.95Å; Y496-N532 WeakPolarHBondContact CB-ND2 3.4Å; Y496-Q534 HydrophobicContact CD1-CB 4Å; Y496-Q534 VanDerWaalsContact CD1-OE1 3.26Å; Y496-Q534 HydrophobicContact CE1-CB 3.97Å; Y496-T535 HydrophobicContact CD2-CG2 4.1Å; Y496-T535 HydrophobicContact CE2-CG2 3.64Å
497	D	90.4	Very high	89.4	Confident	72 Å²	72	57.1 Å²	57.1	39%	0.385	30%	0.295	S	S	.	.			trans	-111.5	121.3	175.1	-177.6	-40.8	0	0	0	109.3	D499 L500 S501	D497-D499 PolarHBondContact OD1-N 3.25Å; D497-L500 HydrophobicContact CB-CB 3.99Å; D497-L500 HydrophobicContact CB-CD1 3.95Å; D497-L500 HydrophobicContact CB-CG 4.17Å; D497-L500 PolarHBondContact OD1-N 2.89Å; D497-S501 VanDerWaalsContact O-CB 3.29Å; D497-S501 WeakPolarHBondContact O-CB 3.45Å; D497-S501 PolarHBondContact O-N 3.21Å
498	Q	89.9	Confident	89.7	Confident	97 Å²	97	56.8 Å²	56.8	45%	0.453	29%	0.293	S	S	.	.	H	α-helix	trans	-70.6	-36.9	-176.6	-178.1	59.3	73.4	0	0	112.7	Y496 S501 V502	Y496-Q498 HydrophobicContact CE1-CB 4.22Å; Y496-Q498 PolarHBondContact OH-OE1 3.25Å; Q498-S501 PolarHBondContact O-N 3.27Å; Q498-V502 WeakPolarHBondContact O-CG2 3.37Å; Q498-V502 PolarHBondContact O-N 3.47Å; Q498-V502 VanDerWaalsContact O-N 3.1Å
499	D	90.9	Very high	90.1	Very high	133 Å²	133	58.6 Å²	58.6	71%	0.711	30%	0.298	S	S	*	.	H	α-helix	trans	-76.9	-42.4	-176.4	-69.9	-29.1	0	0	0	110.1	D497 S501 V502 L503	D497-D499 PolarHBondContact OD1-N 3.25Å; D499-S501 VanDerWaalsContact C-N 3.31Å; D499-S501 PolarHBondContact O-N 3.13Å; D499-V502 PolarHBondContact O-N 2.89Å; D499-L503 PolarHBondContact O-N 2.7Å
500	L	90.1	Very high	90.3	Very high	45 Å²	45	59.7 Å²	59.7	24%	0.236	30%	0.303	C	S	.	.	H	α-helix	trans	-61.5	-39.5	169.3	-70.2	178.1	0	0	0	111.4	D497 V502 L503 W504	D497-L500 HydrophobicContact CB-CB 3.99Å; D497-L500 HydrophobicContact CB-CD1 3.95Å; D497-L500 HydrophobicContact CB-CG 4.17Å; D497-L500 PolarHBondContact OD1-N 2.89Å; L500-V502 VanDerWaalsContact C-N 3.32Å; L500-V502 PolarHBondContact O-N 3.44Å; L500-L503 HydrophobicContact CD2-CD2 4.35Å; L500-L503 PolarHBondContact O-N 3.45Å; L500-W504 PolarHBondContact O-N 2.68Å
501	S	91.2	Very high	90.6	Very high	12 Å²	12	59 Å²	59	8%	0.084	30%	0.299	C	S	.	.	H	α-helix	trans	-59.2	-43.3	175.8	-167.9	0	0	0	0	111.8	Y496 D497 Q498 D499 W504 C505	Y496-S501 PolarHBondContact OH-OG 2.95Å; D497-S501 VanDerWaalsContact O-CB 3.29Å; D497-S501 WeakPolarHBondContact O-CB 3.45Å; D497-S501 PolarHBondContact O-N 3.21Å; Q498-S501 PolarHBondContact O-N 3.27Å; D499-S501 VanDerWaalsContact C-N 3.31Å; D499-S501 PolarHBondContact O-N 3.13Å; S501-W504 PolarHBondContact O-N 3.21Å; S501-C505 PolarHBondContact O-N 3.4Å; S501-C505 VanDerWaalsContact O-N 3.15Å; S501-C505 PolarHBondContact O-SG 3.02Å
502	V	92.7	Very high	91	Very high	64 Å²	64	57.6 Å²	57.6	39%	0.388	29%	0.289	S	S	.	.	H	α-helix	trans	-65.3	-42.2	176.4	170.4	0	0	0	0	111.3	Q498 D499 L500 W504 C505 Q506	Q498-V502 WeakPolarHBondContact O-CG2 3.37Å; Q498-V502 PolarHBondContact O-N 3.47Å; Q498-V502 VanDerWaalsContact O-N 3.1Å; D499-V502 PolarHBondContact O-N 2.89Å; L500-V502 VanDerWaalsContact C-N 3.32Å; L500-V502 PolarHBondContact O-N 3.44Å; V502-W504 PolarHBondContact O-N 2.77Å; V502-C505 PolarHBondContact O-N 3.16Å; V502-Q506 WeakPolarHBondContact O-CG 3.24Å; V502-Q506 PolarHBondContact O-N 3.02Å
503	L	92.9	Very high	91.3	Very high	46 Å²	46	58 Å²	58	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-46.1	176.1	176.1	62.6	0	0	0	112.2	D499 L500 Q506 L507 T751	D499-L503 PolarHBondContact O-N 2.7Å; L500-L503 HydrophobicContact CD2-CD2 4.35Å; L500-L503 PolarHBondContact O-N 3.45Å; L503-Q506 PolarHBondContact O-N 2.92Å; L503-L507 HydrophobicContact CG-CD1 4.49Å; L503-L507 WeakPolarHBondContact O-CG 3.42Å; L503-L507 PolarHBondContact O-N 3.07Å; L503-L507 VanDerWaalsContact O-N 3.11Å; L503-T751 HydrophobicContact CD1-CG2 3.97Å; L503-T751 HydrophobicContact CD2-CG2 4.1Å
504	W	94.4	Very high	91.5	Very high	14 Å²	14	53.9 Å²	53.9	5%	0.053	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-41.9	178.2	-69.8	118.1	0	0	0	112	L500 S501 V502 Q506 L507 E508 N843 F844 L845 R863	L500-W504 PolarHBondContact O-N 2.68Å; S501-W504 PolarHBondContact O-N 3.21Å; V502-W504 PolarHBondContact O-N 2.77Å; W504-Q506 PolarHBondContact O-N 2.74Å; W504-L507 HydrophobicContact CE3-CD1 3.99Å; W504-L507 HydrophobicContact CZ3-CD1 4.07Å; W504-L507 PolarHBondContact O-N 3.23Å; W504-E508 WeakPolarHBondContact O-CB 3.36Å; W504-E508 PolarHBondContact O-N 3.38Å; W504-N843 HydrophobicContact CH2-CB 3.69Å; W504-N843 WeakPolarHBondContact CH2-OD1 3.25Å; W504-N843 HydrophobicContact CZ2-CB 4.19Å; W504-N843 VanDerWaalsContact CZ2-OD1 3.29Å; W504-N843 WeakPolarHBondContact CZ2-OD1 3.44Å; W504-N843 HydrophobicContact CZ3-CB 4.2Å; W504-F844 WeakPolarHBondContact CZ3-O 3.18Å; W504-L845 HydrophobicContact CE3-CB 4.21Å; W504-L845 HydrophobicContact CE3-CD1 3.9Å; W504-L845 HydrophobicContact CE3-CG 4.46Å; W504-L845 HydrophobicContact CZ3-CB 4.01Å; W504-L845 HydrophobicContact CZ3-CD1 4.12Å; W504-R863 VanDerWaalsContact CD1-NH1 3.27Å; W504-R863 HydrophobicContact CD2-CB 4.47Å; W504-R863 HydrophobicContact CD2-CG 3.9Å; W504-R863 HydrophobicContact CE3-CB 4.28Å; W504-R863 HydrophobicContact CE3-CG 3.76Å; W504-R863 HydrophobicContact CH2-CB 3.8Å; W504-R863 HydrophobicContact CH2-CG 4.21Å; W504-R863 HydrophobicContact CZ2-CB 4Å; W504-R863 HydrophobicContact CZ2-CG 4.34Å; W504-R863 HydrophobicContact CZ3-CB 3.94Å; W504-R863 HydrophobicContact CZ3-CG 3.92Å
505	C	93.7	Very high	91.6	Very high	32 Å²	32	50.9 Å²	50.9	22%	0.216	27%	0.265	C	S	.	.	H	α-helix	trans	-59.7	-44.1	174.1	-66	0	0	0	0	112.2	S501 V502 L507 E508 E509 A526	S501-C505 PolarHBondContact O-N 3.4Å; S501-C505 VanDerWaalsContact O-N 3.15Å; S501-C505 PolarHBondContact O-SG 3.02Å; V502-C505 PolarHBondContact O-N 3.16Å; C505-L507 VanDerWaalsContact C-N 3.33Å; C505-L507 PolarHBondContact O-N 3.41Å; C505-E508 PolarHBondContact O-N 2.68Å; C505-E508 VanDerWaalsContact O-N 3.14Å; C505-E509 WeakPolarHBondContact O-CG 3.43Å; C505-E509 PolarHBondContact O-N 2.83Å; C505-A526 HydrophobicContact CB-CB 4.2Å; C505-A526 VanDerWaalsContact SG-CB 3.6Å
506	Q	93.1	Very high	91.7	Very high	95 Å²	95	46 Å²	46	44%	0.444	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-35.1	178.8	-71.7	176.3	12.5	0	0	113.2	V502 L503 W504 Q510	V502-Q506 WeakPolarHBondContact O-CG 3.24Å; V502-Q506 PolarHBondContact O-N 3.02Å; L503-Q506 PolarHBondContact O-N 2.92Å; W504-Q506 PolarHBondContact O-N 2.74Å; Q506-Q510 VanDerWaalsContact O-CG 3.3Å; Q506-Q510 WeakPolarHBondContact O-CG 3.44Å; Q506-Q510 PolarHBondContact O-N 3.15Å; Q506-Q510 PolarHBondContact O-NE2 2.7Å
507	L	93.4	Very high	91.5	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-70	-37.2	173.5	-69.6	174.1	0	0	0	111.2	L503 W504 C505 Q510 L511 A749 L845	L503-L507 HydrophobicContact CG-CD1 4.49Å; L503-L507 WeakPolarHBondContact O-CG 3.42Å; L503-L507 PolarHBondContact O-N 3.07Å; L503-L507 VanDerWaalsContact O-N 3.11Å; W504-L507 HydrophobicContact CE3-CD1 3.99Å; W504-L507 HydrophobicContact CZ3-CD1 4.07Å; W504-L507 PolarHBondContact O-N 3.23Å; C505-L507 VanDerWaalsContact C-N 3.33Å; C505-L507 PolarHBondContact O-N 3.41Å; L507-Q510 PolarHBondContact O-N 3.41Å; L507-L511 WeakPolarHBondContact O-CD1 3.4Å; L507-L511 WeakPolarHBondContact O-CG 3.49Å; L507-L511 PolarHBondContact O-N 3.18Å; L507-L511 VanDerWaalsContact O-N 3.12Å; L507-A749 HydrophobicContact CD2-CB 4.05Å; L507-L845 HydrophobicContact CB-CB 4.07Å; L507-L845 HydrophobicContact CB-CD2 3.61Å; L507-L845 HydrophobicContact CD1-CB 4.32Å
508	E	95.4	Very high	91.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-69.4	-43	179.3	-164.4	168.9	168.8	0	0	111.8	W504 C505 Q510 L511 A512 F524 T527 L845 H859 V861	W504-E508 WeakPolarHBondContact O-CB 3.36Å; W504-E508 PolarHBondContact O-N 3.38Å; C505-E508 PolarHBondContact O-N 2.68Å; C505-E508 VanDerWaalsContact O-N 3.14Å; E508-Q510 VanDerWaalsContact C-N 3.32Å; E508-Q510 PolarHBondContact O-N 3.24Å; E508-L511 PolarHBondContact O-N 2.98Å; E508-L511 VanDerWaalsContact O-N 3.17Å; E508-A512 WeakPolarHBondContact O-CB 3.42Å; E508-A512 PolarHBondContact O-N 3.04Å; E508-F524 HydrophobicContact CB-CZ 4.29Å; E508-F524 HydrophobicContact CG-CE2 4.17Å; E508-F524 HydrophobicContact CG-CZ 3.95Å; E508-T527 WeakPolarHBondContact OE1-CB 3.27Å; E508-T527 PolarHBondContact OE1-N 3.33Å; E508-T527 PolarHBondContact OE1-OG1 3.18Å; E508-T527 PolarHBondContact OE2-N 3.06Å; E508-L845 HydrophobicContact CB-CD2 3.76Å; E508-L845 HydrophobicContact CG-CD2 4.43Å; E508-L845 VanDerWaalsContact N-CD2 3.32Å; E508-H859 IonicContact OE1-CE1 3.21Å; E508-H859 IonicContact OE1-NE2 2.7Å; E508-H859 PolarHBondContact OE1-NE2 3.02Å; E508-H859 VanDerWaalsContact OE1-NE2 3.16Å; E508-V861 HydrophobicContact CG-CG1 3.98Å
509	E	93.8	Very high	90.9	Very high	89 Å²	89	55.8 Å²	55.8	42%	0.416	30%	0.298	S	S	.	.	H	α-helix	trans	-56.8	-43.5	172.3	-75.5	173.6	-179.9	0	0	112	C505 A513 L520 F524	C505-E509 WeakPolarHBondContact O-CG 3.43Å; C505-E509 PolarHBondContact O-N 2.83Å; E509-A513 WeakPolarHBondContact O-CB 3.5Å; E509-A513 PolarHBondContact O-N 3.18Å; E509-L520 HydrophobicContact CB-CD1 4.46Å; E509-L520 HydrophobicContact CG-CD2 4.26Å; E509-F524 HydrophobicContact CG-CD1 4.37Å; E509-F524 HydrophobicContact CG-CE1 3.54Å; E509-F524 HydrophobicContact CG-CZ 4Å
510	Q	91.3	Very high	90.8	Very high	52 Å²	52	52.8 Å²	52.8	24%	0.243	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-41.9	176.4	-74.3	166.2	60.4	0	0	111.7	Q506 L507 E508 S514 V809	Q506-Q510 VanDerWaalsContact O-CG 3.3Å; Q506-Q510 WeakPolarHBondContact O-CG 3.44Å; Q506-Q510 PolarHBondContact O-N 3.15Å; Q506-Q510 PolarHBondContact O-NE2 2.7Å; L507-Q510 PolarHBondContact O-N 3.41Å; E508-Q510 VanDerWaalsContact C-N 3.32Å; E508-Q510 PolarHBondContact O-N 3.24Å; Q510-S514 WeakPolarHBondContact O-CB 3.41Å; Q510-S514 PolarHBondContact O-N 2.96Å; Q510-V809 HydrophobicContact CB-CG2 4.37Å
511	L	92.9	Very high	90.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.7	-49.4	177.4	-73.2	159	0	0	0	111.8	L507 E508 A513 S514 A515 R747 A749 V809 L845 Y847	L507-L511 WeakPolarHBondContact O-CD1 3.4Å; L507-L511 WeakPolarHBondContact O-CG 3.49Å; L507-L511 PolarHBondContact O-N 3.18Å; L507-L511 VanDerWaalsContact O-N 3.12Å; E508-L511 PolarHBondContact O-N 2.98Å; E508-L511 VanDerWaalsContact O-N 3.17Å; L511-A513 PolarHBondContact O-N 3.35Å; L511-S514 WeakPolarHBondContact O-CB 3.46Å; L511-S514 PolarHBondContact O-N 2.82Å; L511-S514 VanDerWaalsContact O-N 3.15Å; L511-S514 PolarHBondContact O-OG 2.85Å; L511-A515 PolarHBondContact O-N 3.07Å; L511-R747 HydrophobicContact CD2-CB 3.78Å; L511-A749 HydrophobicContact CD1-CB 3.75Å; L511-A749 HydrophobicContact CD2-CB 3.99Å; L511-A749 HydrophobicContact CG-CB 3.74Å; L511-V809 HydrophobicContact CD2-CB 4.28Å; L511-V809 HydrophobicContact CD2-CG1 3.56Å; L511-V809 HydrophobicContact CD2-CG2 3.83Å; L511-V809 HydrophobicContact CG-CG2 4.21Å; L511-L845 HydrophobicContact CD1-CB 3.91Å; L511-L845 HydrophobicContact CD1-CD2 3.81Å; L511-L845 HydrophobicContact CD1-CG 3.75Å; L511-L845 VanDerWaalsContact CD1-O 3.24Å; L511-L845 WeakPolarHBondContact CD1-O 3.49Å; L511-Y847 HydrophobicContact CB-CD2 3.72Å; L511-Y847 HydrophobicContact CB-CE2 4.46Å; L511-Y847 HydrophobicContact CB-CG 3.97Å
512	A	92.2	Very high	90.2	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.008	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-41.9	179.3	0	0	0	0	0	112.3	E508 A515 N516 L520 F524 Y847	E508-A512 WeakPolarHBondContact O-CB 3.42Å; E508-A512 PolarHBondContact O-N 3.04Å; A512-A515 PolarHBondContact O-N 3.46Å; A512-N516 WeakPolarHBondContact O-CB 3.3Å; A512-N516 PolarHBondContact O-N 2.88Å; A512-N516 VanDerWaalsContact O-N 3.11Å; A512-N516 PolarHBondContact O-ND2 3.31Å; A512-L520 HydrophobicContact CB-CD1 3.86Å; A512-F524 HydrophobicContact CB-CD2 3.71Å; A512-F524 HydrophobicContact CB-CE2 3.47Å; A512-F524 VanDerWaalsContact CB-CE2 3.47Å; A512-F524 HydrophobicContact CB-CZ 4.38Å; A512-Y847 HydrophobicContact CB-CE2 4.27Å
513	A	91.3	Very high	89.7	Confident	21 Å²	21	61.3 Å²	61.3	17%	0.174	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-43.5	172.4	0	0	0	0	0	111	E509 L511 A515 N516 R517 G518	E509-A513 WeakPolarHBondContact O-CB 3.5Å; E509-A513 PolarHBondContact O-N 3.18Å; L511-A513 PolarHBondContact O-N 3.35Å; A513-A515 VanDerWaalsContact C-N 3.29Å; A513-A515 PolarHBondContact O-N 3.47Å; A513-N516 CarbonylContact O-C 3.55Å; A513-N516 PolarHBondContact O-N 2.79Å; A513-R517 PolarHBondContact O-N 3.22Å; A513-G518 VanDerWaalsContact O-CA 3.25Å; A513-G518 WeakPolarHBondContact O-CA 3.3Å; A513-G518 PolarHBondContact O-N 3.44Å
514	S	90.3	Very high	89.4	Confident	36 Å²	36	61 Å²	61	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-59.8	-38.6	176.5	82.2	0	0	0	0	112.5	Q510 L511 N516 R747	Q510-S514 WeakPolarHBondContact O-CB 3.41Å; Q510-S514 PolarHBondContact O-N 2.96Å; L511-S514 WeakPolarHBondContact O-CB 3.46Å; L511-S514 PolarHBondContact O-N 2.82Å; L511-S514 VanDerWaalsContact O-N 3.15Å; L511-S514 PolarHBondContact O-OG 2.85Å; S514-N516 VanDerWaalsContact C-N 3.31Å; S514-R747 PolarHBondContact O-NH1 3.47Å; S514-R747 PolarHBondContact OG-NH1 2.81Å
515	A	88.4	Confident	89	Confident	26 Å²	26	65.5 Å²	65.5	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-67.1	-36.7	179.6	0	0	0	0	0	110.9	L511 A512 A513 R517 R747 Y847	L511-A515 PolarHBondContact O-N 3.07Å; A512-A515 PolarHBondContact O-N 3.46Å; A513-A515 VanDerWaalsContact C-N 3.29Å; A513-A515 PolarHBondContact O-N 3.47Å; A515-R517 PolarHBondContact O-N 2.97Å; A515-R747 VanDerWaalsContact CA-NH1 3.27Å; A515-Y847 HydrophobicContact CB-CE1 3.82Å; A515-Y847 VanDerWaalsContact CB-OH 3.32Å; A515-Y847 WeakPolarHBondContact CB-OH 3.18Å
516	N	87.6	Confident	88.8	Confident	72 Å²	72	65.2 Å²	65.2	39%	0.385	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	40.1	-177.9	-66.4	-79.1	0	0	0	112.7	A512 A513 S514 G518 I519 P521	A512-N516 WeakPolarHBondContact O-CB 3.3Å; A512-N516 PolarHBondContact O-N 2.88Å; A512-N516 VanDerWaalsContact O-N 3.11Å; A512-N516 PolarHBondContact O-ND2 3.31Å; A513-N516 CarbonylContact O-C 3.55Å; A513-N516 PolarHBondContact O-N 2.79Å; S514-N516 VanDerWaalsContact C-N 3.31Å; N516-G518 VanDerWaalsContact C-N 3.26Å; N516-G518 PolarHBondContact O-N 2.72Å; N516-I519 WeakPolarHBondContact CB-O 3.37Å; N516-I519 PolarHBondContact O-N 3.09Å; N516-I519 VanDerWaalsContact O-N 3.09Å; N516-P521 HydrophobicContact CB-CG 4.44Å
517	R	85.7	Confident	88.6	Confident	244 Å²	244	62.4 Å²	62.4	92%	0.921	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	31.9	173.5	-53.8	-179.4	-179.3	-177.6	0.2	114.9	A513 A515	A513-R517 PolarHBondContact O-N 3.22Å; A515-R517 PolarHBondContact O-N 2.97Å
518	G	82.2	Confident	88.4	Confident	59 Å²	59	64.7 Å²	64.7	61%	0.608	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	1.7	-179.5	0	0	0	0	0	115	A513 N516	A513-G518 VanDerWaalsContact O-CA 3.25Å; A513-G518 WeakPolarHBondContact O-CA 3.3Å; A513-G518 PolarHBondContact O-N 3.44Å; N516-G518 VanDerWaalsContact C-N 3.26Å; N516-G518 PolarHBondContact O-N 2.72Å
519	I	86.4	Confident	88.2	Confident	125 Å²	125	65.4 Å²	65.4	64%	0.641	36%	0.36	S	S	*	.			trans	-113	126	-178.2	-57	176.1	0	0	0	109.2	N516	N516-I519 WeakPolarHBondContact CB-O 3.37Å; N516-I519 PolarHBondContact O-N 3.09Å; N516-I519 VanDerWaalsContact O-N 3.09Å
520	L	87.5	Confident	88.1	Confident	69 Å²	69	61.6 Å²	61.6	36%	0.361	34%	0.344	S	S	.	.			trans	-74.7	131.1	174	-164.6	69.5	0	0	0	110.1	E509 A512 F524	E509-L520 HydrophobicContact CB-CD1 4.46Å; E509-L520 HydrophobicContact CG-CD2 4.26Å; A512-L520 HydrophobicContact CB-CD1 3.86Å; L520-F524 HydrophobicContact CD1-CB 4.12Å; L520-F524 HydrophobicContact CD1-CD1 3.89Å; L520-F524 HydrophobicContact CD1-CD2 3.88Å; L520-F524 HydrophobicContact CD1-CE1 4.27Å; L520-F524 HydrophobicContact CD1-CE2 4.27Å; L520-F524 HydrophobicContact CD1-CG 3.67Å; L520-F524 HydrophobicContact CD1-CZ 4.45Å; L520-F524 HydrophobicContact CD2-CB 4.3Å; L520-F524 HydrophobicContact CD2-CD1 3.78Å; L520-F524 HydrophobicContact CD2-CE1 4.41Å; L520-F524 HydrophobicContact CD2-CG 4.17Å; L520-F524 HydrophobicContact CG-CB 3.88Å; L520-F524 HydrophobicContact CG-CD1 4.05Å; L520-F524 HydrophobicContact CG-CG 3.91Å
521	P	85.9	Confident	88.3	Confident	35 Å²	35	59.7 Å²	59.7	23%	0.227	34%	0.335	C	S	.	.			trans	-58.4	142.2	175.7	-25.8	35	0	0	0	112.6	N516 N523 F524	N516-P521 HydrophobicContact CB-CG 4.44Å; P521-N523 WeakPolarHBondContact CB-OD1 3.04Å; P521-N523 PolarHBondContact O-N 3.24Å; P521-F524 HydrophobicContact CB-CB 4.35Å; P521-F524 WeakPolarHBondContact O-CB 3.42Å; P521-F524 PolarHBondContact O-N 3.07Å
522	S	82.3	Confident	88.3	Confident	134 Å²	134	60.3 Å²	60.3	94%	0.937	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.2	-179.5	54.4	0	0	0	0	114.2
523	N	82.4	Confident	88.3	Confident	131 Å²	131	63.6 Å²	63.6	70%	0.701	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	18.4	174.2	68.3	-36.9	0	0	0	112.7	P521 Q525	P521-N523 WeakPolarHBondContact CB-OD1 3.04Å; P521-N523 PolarHBondContact O-N 3.24Å; N523-Q525 PolarHBondContact O-N 2.69Å
524	F	87.3	Confident	88.2	Confident	39 Å²	39	68.6 Å²	68.6	17%	0.171	38%	0.381	C	S	.	.			trans	-63	133.3	175.3	173.7	-96.9	0	0	0	110.9	E508 E509 A512 L520 P521 A526 H859	E508-F524 HydrophobicContact CB-CZ 4.29Å; E508-F524 HydrophobicContact CG-CE2 4.17Å; E508-F524 HydrophobicContact CG-CZ 3.95Å; E509-F524 HydrophobicContact CG-CD1 4.37Å; E509-F524 HydrophobicContact CG-CE1 3.54Å; E509-F524 HydrophobicContact CG-CZ 4Å; A512-F524 HydrophobicContact CB-CD2 3.71Å; A512-F524 HydrophobicContact CB-CE2 3.47Å; A512-F524 VanDerWaalsContact CB-CE2 3.47Å; A512-F524 HydrophobicContact CB-CZ 4.38Å; L520-F524 HydrophobicContact CD1-CB 4.12Å; L520-F524 HydrophobicContact CD1-CD1 3.89Å; L520-F524 HydrophobicContact CD1-CD2 3.88Å; L520-F524 HydrophobicContact CD1-CE1 4.27Å; L520-F524 HydrophobicContact CD1-CE2 4.27Å; L520-F524 HydrophobicContact CD1-CG 3.67Å; L520-F524 HydrophobicContact CD1-CZ 4.45Å; L520-F524 HydrophobicContact CD2-CB 4.3Å; L520-F524 HydrophobicContact CD2-CD1 3.78Å; L520-F524 HydrophobicContact CD2-CE1 4.41Å; L520-F524 HydrophobicContact CD2-CG 4.17Å; L520-F524 HydrophobicContact CG-CB 3.88Å; L520-F524 HydrophobicContact CG-CD1 4.05Å; L520-F524 HydrophobicContact CG-CG 3.91Å; P521-F524 HydrophobicContact CB-CB 4.35Å; P521-F524 WeakPolarHBondContact O-CB 3.42Å; P521-F524 PolarHBondContact O-N 3.07Å; F524-A526 HydrophobicContact CE1-CB 4.32Å; F524-A526 HydrophobicContact CZ-CB 4.27Å; F524-H859 AromaticContact CE2-CE1 3.71Å; F524-H859 AromaticContact CE2-NE2 3.9Å
525	Q	86.6	Confident	88.2	Confident	109 Å²	109	67.5 Å²	67.5	51%	0.509	37%	0.373	S	S	.	.			trans	-137.5	127.6	172	-177.5	176.4	-3.5	0	0	107.2	N523	N523-Q525 PolarHBondContact O-N 2.69Å
526	A	88.9	Confident	88.2	Confident	27 Å²	27	71.6 Å²	71.6	22%	0.223	39%	0.391	C	S	.	.			trans	-67.1	146.2	179	0	0	0	0	0	111.7	C505 F524 Q528	C505-A526 HydrophobicContact CB-CB 4.2Å; C505-A526 VanDerWaalsContact SG-CB 3.6Å; F524-A526 HydrophobicContact CE1-CB 4.32Å; F524-A526 HydrophobicContact CZ-CB 4.27Å; A526-Q528 PolarHBondContact O-N 3.06Å
527	T	89.2	Confident	88.5	Confident	36 Å²	36	68.6 Å²	68.6	22%	0.221	38%	0.375	C	S	.	.			trans	-75.9	108.8	-173	-59.3	0	0	0	0	110.6	E508 V861 R863	E508-T527 WeakPolarHBondContact OE1-CB 3.27Å; E508-T527 PolarHBondContact OE1-N 3.33Å; E508-T527 PolarHBondContact OE1-OG1 3.18Å; E508-T527 PolarHBondContact OE2-N 3.06Å; T527-V861 HydrophobicContact CG2-CG2 3.98Å; T527-R863 PolarHBondContact O-NH2 3.45Å
528	Q	89.3	Confident	88.6	Confident	53 Å²	53	61.3 Å²	61.3	25%	0.248	35%	0.354	C	S	.	.			trans	-111.3	91.2	178.7	-169.9	63.8	21.6	0	0	111.3	A526 C530 L531 T535	A526-Q528 PolarHBondContact O-N 3.06Å; Q528-C530 VanDerWaalsContact C-N 3.34Å; Q528-C530 PolarHBondContact NE2-O 2.94Å; Q528-C530 PolarHBondContact O-N 2.9Å; Q528-L531 HydrophobicContact CB-CD2 4.17Å; Q528-L531 HydrophobicContact CG-CD2 3.56Å; Q528-T535 HydrophobicContact CG-CG2 4.17Å
529	C	89.9	Confident	89	Confident	16 Å²	16	63.7 Å²	63.7	11%	0.108	35%	0.349	C	S	.	.	S	Bend	trans	-69.3	-25.7	-178.5	-56	0	0	0	0	114.2	Y472 F473 V490	Y472-C529 CarbonylContact C-O 3.57Å; Y472-C529 VanDerWaalsContact CA-O 3.3Å; Y472-C529 WeakPolarHBondContact CA-O 3.32Å; Y472-C529 HydrophobicContact CD2-CB 4.41Å; Y472-C529 HydrophobicContact CE2-CB 4.16Å; F473-C529 PolarHBondContact N-O 3.28Å; V490-C529 HydrophobicContact CB-CB 4.45Å; V490-C529 HydrophobicContact CG2-CB 4.42Å
530	C	93.3	Very high	89.2	Confident	9 Å²	9	59.7 Å²	59.7	6%	0.061	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	118.9	179.3	-172.1	0	0	0	0	110.7	V471 Y472 V490 Q528	V471-C530 CarbonylContact O-C 3.49Å; V471-C530 WeakPolarHBondContact O-CA 3.17Å; Y472-C530 HydrophobicContact CD2-CB 4.37Å; V490-C530 HydrophobicContact CG1-CB 4.02Å; Q528-C530 VanDerWaalsContact C-N 3.34Å; Q528-C530 PolarHBondContact NE2-O 2.94Å; Q528-C530 PolarHBondContact O-N 2.9Å
531	L	94.1	Very high	89.6	Confident	11 Å²	11	57 Å²	57	6%	0.058	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	143.8	176.1	-58.8	-175.6	0	0	0	111.2	R470 V471 F473 Q528 T535 P541 R700	R470-L531 CarbonylContact C-O 3.53Å; R470-L531 VanDerWaalsContact CA-O 3.27Å; R470-L531 WeakPolarHBondContact CA-O 3.21Å; V471-L531 PolarHBondContact N-O 3.07Å; V471-L531 PolarHBondContact O-N 3.33Å; F473-L531 HydrophobicContact CE2-CD1 3.94Å; F473-L531 HydrophobicContact CE2-CG 4.23Å; Q528-L531 HydrophobicContact CB-CD2 4.17Å; Q528-L531 HydrophobicContact CG-CD2 3.56Å; L531-T535 WeakPolarHBondContact CA-OG1 3.17Å; L531-P541 HydrophobicContact CD1-CB 3.95Å; L531-P541 HydrophobicContact CD1-CG 3.9Å; L531-R700 HydrophobicContact CB-CB 3.89Å; L531-R700 HydrophobicContact CD1-CB 3.72Å; L531-R700 HydrophobicContact CG-CB 4.48Å
532	N	93.8	Very high	89.9	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.07	32%	0.319	C	S	.	.			trans	-150.8	-166.4	180	65.5	25.9	0	0	0	110.1	R470 Y496 Q534 T535 N537	R470-N532 HydrophobicContact CG-CB 3.9Å; Y496-N532 WeakPolarHBondContact CB-ND2 3.4Å; N532-Q534 VanDerWaalsContact C-N 3.26Å; N532-Q534 PolarHBondContact O-N 2.94Å; N532-Q534 WeakPolarHBondContact OD1-CA 3.16Å; N532-Q534 WeakPolarHBondContact OD1-CB 3.32Å; N532-Q534 PolarHBondContact OD1-N 2.83Å; N532-T535 PolarHBondContact N-OG1 3.49Å; N532-T535 PolarHBondContact O-OG1 3.29Å; N532-T535 VanDerWaalsContact O-OG1 3.05Å; N532-T535 PolarHBondContact OD1-N 3.05Å; N532-N537 PolarHBondContact O-ND2 2.88Å
533	S	91.7	Very high	90.5	Very high	70 Å²	70	52.2 Å²	52.2	49%	0.49	28%	0.277	S	S	.	.	S	Bend	trans	-74.4	-6.6	178.7	49.6	0	0	0	0	116	S467	S467-S533 WeakPolarHBondContact O-CB 3.35Å
534	Q	90.3	Very high	91.1	Very high	126 Å²	126	46.1 Å²	46.1	59%	0.589	24%	0.244	S	C	*	.	S	Bend	trans	-107.1	-19.9	-177.7	-54.6	-178.3	13.2	0	0	112.2	Y496 N532	Y496-Q534 HydrophobicContact CD1-CB 4Å; Y496-Q534 VanDerWaalsContact CD1-OE1 3.26Å; Y496-Q534 HydrophobicContact CE1-CB 3.97Å; N532-Q534 VanDerWaalsContact C-N 3.26Å; N532-Q534 PolarHBondContact O-N 2.94Å; N532-Q534 WeakPolarHBondContact OD1-CA 3.16Å; N532-Q534 WeakPolarHBondContact OD1-CB 3.32Å; N532-Q534 PolarHBondContact OD1-N 2.83Å
535	T	90.5	Very high	91.4	Very high	14 Å²	14	45.9 Å²	45.9	9%	0.086	24%	0.244	C	C	.	.	S	Bend	trans	-74.4	156.9	176.1	49.8	0	0	0	0	113.2	Y496 Q528 L531 N532 N537	Y496-T535 HydrophobicContact CD2-CG2 4.1Å; Y496-T535 HydrophobicContact CE2-CG2 3.64Å; Q528-T535 HydrophobicContact CG-CG2 4.17Å; L531-T535 WeakPolarHBondContact CA-OG1 3.17Å; N532-T535 PolarHBondContact N-OG1 3.49Å; N532-T535 PolarHBondContact O-OG1 3.29Å; N532-T535 VanDerWaalsContact O-OG1 3.05Å; N532-T535 PolarHBondContact OD1-N 3.05Å; T535-N537 PolarHBondContact O-N 3.47Å; T535-N537 PolarHBondContact O-OD1 3.11Å; T535-N537 PolarHBondContact OG1-OD1 2.99Å
536	N	88.4	Confident	91.7	Very high	111 Å²	111	45.2 Å²	45.2	59%	0.594	24%	0.241	S	C	*	.			trans	-74.2	95.5	173.5	-179	2.4	0	0	0	111.1	L538	N536-L538 WeakPolarHBondContact OD1-CB 3.23Å; N536-L538 VanDerWaalsContact OD1-CG 3.29Å; N536-L538 WeakPolarHBondContact OD1-CG 3.49Å; N536-L538 PolarHBondContact OD1-N 3.23Å
537	N	91.9	Very high	91.9	Very high	9 Å²	9	44.8 Å²	44.8	5%	0.048	24%	0.235	C	C	.	.			trans	-97.3	22.5	-176.9	-53.8	-25.2	0	0	0	113.5	N532 T535 H539 D698 R699 R700	N532-N537 PolarHBondContact O-ND2 2.88Å; T535-N537 PolarHBondContact O-N 3.47Å; T535-N537 PolarHBondContact O-OD1 3.11Å; T535-N537 PolarHBondContact OG1-OD1 2.99Å; N537-H539 VanDerWaalsContact C-N 3.31Å; N537-H539 PolarHBondContact O-N 2.98Å; N537-D698 HydrophobicContact CB-CB 4.28Å; N537-D698 VanDerWaalsContact CB-OD1 3.25Å; N537-D698 WeakPolarHBondContact CB-OD1 3.44Å; N537-D698 VanDerWaalsContact ND2-CG 3.29Å; N537-D698 PolarHBondContact ND2-OD1 3.38Å; N537-D698 PolarHBondContact ND2-OD2 2.93Å; N537-R699 PolarHBondContact O-N 2.72Å; N537-R700 HydrophobicContact CB-CB 4.32Å; N537-R700 PolarHBondContact ND2-NE 3.38Å
538	L	89.8	Confident	92.1	Very high	91 Å²	91	43.4 Å²	43.4	48%	0.476	23%	0.226	S	C	.	.	S	Bend	trans	-70	-27.7	-178.3	-68.7	174.1	0	0	0	113.4	N536 R699	N536-L538 WeakPolarHBondContact OD1-CB 3.23Å; N536-L538 VanDerWaalsContact OD1-CG 3.29Å; N536-L538 WeakPolarHBondContact OD1-CG 3.49Å; N536-L538 PolarHBondContact OD1-N 3.23Å; L538-R699 WeakPolarHBondContact O-CD 3.49Å; L538-R699 PolarHBondContact O-NE 2.88Å
539	H	89.3	Confident	92.5	Very high	110 Å²	110	41 Å²	41	51%	0.509	22%	0.215	S	C	.	.	S	Bend	trans	-103.2	153	-179	-62.3	-82.9	0	0	0	111.2	N537	N537-H539 VanDerWaalsContact C-N 3.31Å; N537-H539 PolarHBondContact O-N 2.98Å
540	H	91.9	Very high	92.8	Very high	40 Å²	40	40.8 Å²	40.8	19%	0.185	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-63.7	128.3	170.8	-66	-79.3	0	0	0	110.2	Q637 R699 E702 I704	H540-Q637 PolarHBondContact CE1-NE2 3.11Å; H540-R699 PolarHBondContact NE2-NH1 2.87Å; H540-E702 IonicContact CE1-OE2 3.11Å; H540-E702 PolarHBondContact CE1-OE2 3.42Å; H540-E702 WeakPolarHBondContact ND1-CB 3.22Å; H540-E702 PolarHBondContact ND1-O 2.61Å; H540-E702 IonicContact ND1-OE2 3.7Å; H540-I704 HydrophobicContact CB-CD1 3.67Å; H540-I704 HydrophobicContact CB-CG1 3.91Å
541	P	94.4	Very high	93	Very high	14 Å²	14	40.4 Å²	40.4	9%	0.091	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-62.6	154.5	170.2	17.8	-22.3	0	0	0	111.3	F473 L531 R699 P703 I704	F473-P541 HydrophobicContact CD2-CB 4.2Å; F473-P541 HydrophobicContact CE1-CB 4.29Å; F473-P541 HydrophobicContact CE1-CG 4.41Å; F473-P541 HydrophobicContact CE2-CB 3.49Å; F473-P541 VanDerWaalsContact CE2-CB 3.49Å; F473-P541 HydrophobicContact CE2-CG 3.8Å; F473-P541 HydrophobicContact CZ-CB 3.55Å; F473-P541 HydrophobicContact CZ-CG 3.5Å; F473-P541 VanDerWaalsContact CZ-CG 3.5Å; L531-P541 HydrophobicContact CD1-CB 3.95Å; L531-P541 HydrophobicContact CD1-CG 3.9Å; P541-R699 WeakPolarHBondContact CD-O 3.23Å; P541-P703 HydrophobicContact CB-CB 4.49Å; P541-P703 HydrophobicContact CG-CB 4.04Å; P541-P703 CarbonylContact O-C 3.58Å; P541-P703 VanDerWaalsContact O-CA 3.3Å; P541-P703 WeakPolarHBondContact O-CA 3.19Å; P541-I704 PolarHBondContact O-N 3.37Å
542	L	93.7	Very high	93.1	Very high	62 Å²	62	40.8 Å²	40.8	33%	0.325	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	127.2	173.4	-56.7	-178.8	0	0	0	108.8	I704 T706 K856 I857	L542-I704 HydrophobicContact CD2-CB 3.98Å; L542-I704 HydrophobicContact CD2-CD1 4.47Å; L542-I704 HydrophobicContact CD2-CG2 4.34Å; L542-T706 HydrophobicContact CB-CG2 4.44Å; L542-T706 HydrophobicContact CD2-CG2 4.28Å; L542-K856 HydrophobicContact CD1-CB 4.33Å; L542-I857 HydrophobicContact CB-CD1 3.99Å; L542-I857 HydrophobicContact CB-CG1 3.92Å; L542-I857 HydrophobicContact CD1-CG1 3.64Å; L542-I857 HydrophobicContact CG-CG1 4.41Å
543	A	94.6	Very high	93.3	Very high	6 Å²	6	40.2 Å²	40.2	5%	0.05	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	158.9	173.3	0	0	0	0	0	109.4	F473 I549 P703 I704 I705 T706	F473-A543 HydrophobicContact CD1-CB 3.8Å; F473-A543 HydrophobicContact CE1-CB 4.17Å; A543-I549 HydrophobicContact CB-CD1 3.81Å; A543-I549 HydrophobicContact CB-CG1 4.14Å; A543-P703 HydrophobicContact CB-CB 4.23Å; A543-I704 PolarHBondContact N-O 3.42Å; A543-I705 HydrophobicContact CB-CD1 3.83Å; A543-I705 CarbonylContact O-C 3.54Å; A543-I705 WeakPolarHBondContact O-CA 3.45Å; A543-T706 PolarHBondContact O-N 3.23Å; A543-T706 PolarHBondContact O-OG1 3.14Å
544	V	93.7	Very high	93.6	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.018	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	144.2	-176	175.9	0	0	0	0	109	E547 M709 I857 R860	V544-E547 HydrophobicContact CB-CB 4.46Å; V544-E547 HydrophobicContact CB-CG 4.4Å; V544-E547 PolarHBondContact O-N 2.93Å; V544-M709 HydrophobicContact CG1-CB 4.16Å; V544-M709 HydrophobicContact CG2-CB 4.06Å; V544-M709 HydrophobicContact CG2-CG 3.97Å; V544-I857 HydrophobicContact CG2-CD1 3.54Å; V544-R860 VanDerWaalsContact CG2-NH2 3.25Å
545	I	93.4	Very high	93.9	Very high	33 Å²	33	31.8 Å²	31.8	17%	0.169	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	147.8	174.5	64.6	171.3	0	0	0	111.3	E547 P632 T635 I705 T706 P708	I545-E547 PolarHBondContact O-N 3.03Å; I545-P632 CarbonylContact C-O 3.56Å; I545-P632 VanDerWaalsContact CA-O 3.31Å; I545-P632 WeakPolarHBondContact CA-O 3.35Å; I545-T635 HydrophobicContact CG2-CG2 4.02Å; I545-I705 HydrophobicContact CG2-CG2 3.48Å; I545-I705 VanDerWaalsContact CG2-CG2 3.48Å; I545-T706 PolarHBondContact N-O 3.06Å; I545-P708 HydrophobicContact CD1-CG 3.66Å; I545-P708 HydrophobicContact CG1-CG 3.77Å
546	E	93	Very high	94.1	Very high	95 Å²	95	34.1 Å²	34.1	44%	0.444	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	12.8	-173.4	-50.1	-53	141.8	0	0	115.5	L631 P632 H633	E546-L631 VanDerWaalsContact C-CD1 3.46Å; E546-P632 PolarHBondContact N-O 2.87Å; E546-H633 VanDerWaalsContact CD-ND1 3.34Å; E546-H633 IonicContact OE1-CE1 3.21Å; E546-H633 IonicContact OE1-CG 2.72Å; E546-H633 IonicContact OE1-ND1 2.76Å; E546-H633 PolarHBondContact OE1-ND1 2.8Å; E546-H633 IonicContact OE2-CE1 2.76Å; E546-H633 PolarHBondContact OE2-CE1 3.3Å; E546-H633 IonicContact OE2-ND1 3.81Å; E546-H633 PolarHBondContact OE2-ND1 3.32Å
547	E	93.1	Very high	94.4	Very high	19 Å²	19	28.9 Å²	28.9	9%	0.089	14%	0.142	C	C	.	.	S	Bend	trans	-112.7	134.3	170.5	-71.3	-175.7	-159.5	0	0	112.1	V544 I545 P632 R860	V544-E547 HydrophobicContact CB-CB 4.46Å; V544-E547 HydrophobicContact CB-CG 4.4Å; V544-E547 PolarHBondContact O-N 2.93Å; I545-E547 PolarHBondContact O-N 3.03Å; E547-P632 VanDerWaalsContact O-CD 3.25Å; E547-P632 WeakPolarHBondContact O-CD 3.31Å; E547-R860 IonicContact OE1-CZ 3.17Å; E547-R860 VanDerWaalsContact OE1-CZ 3.24Å; E547-R860 IonicContact OE1-NH1 3.23Å; E547-R860 PolarHBondContact OE1-NH1 2.9Å; E547-R860 IonicContact OE1-NH2 2.88Å; E547-R860 PolarHBondContact OE1-NH2 2.65Å; E547-R860 IonicContact OE2-CZ 3.38Å; E547-R860 IonicContact OE2-NH1 3.47Å; E547-R860 IonicContact OE2-NH2 2.73Å; E547-R860 PolarHBondContact OE2-NH2 3.36Å
548	P	94.9	Very high	94.4	Very high	7 Å²	7	28.8 Å²	28.8	5%	0.045	14%	0.142	C	C	.	.			trans	-73.5	143.8	-173	28.3	-32.3	0	0	0	112.5	G474 K629 L630	G474-P548 PolarHBondContact N-O 3.32Å; G474-P548 WeakPolarHBondContact O-CG 3.44Å; P548-K629 HydrophobicContact CB-CD 4.24Å; P548-K629 VanDerWaalsContact CB-CE 3.42Å; P548-K629 HydrophobicContact CB-CG 3.93Å; P548-L630 CarbonylContact C-O 3.49Å; P548-L630 WeakPolarHBondContact CA-O 3.3Å
549	I	97.1	Very high	94.6	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	115.1	169.5	-53.2	174.3	0	0	0	106.4	V471 Y472 F473 A543 K629 L630 P632 L638 I640 P703 I705	V471-I549 HydrophobicContact CG1-CG2 3.94Å; Y472-I549 WeakPolarHBondContact O-CA 3.43Å; F473-I549 HydrophobicContact CD1-CB 4.47Å; F473-I549 HydrophobicContact CD1-CD1 4.43Å; F473-I549 HydrophobicContact CD1-CG1 3.99Å; F473-I549 HydrophobicContact CD1-CG2 3.97Å; F473-I549 HydrophobicContact CE1-CB 4.47Å; F473-I549 HydrophobicContact CE1-CD1 4.21Å; F473-I549 HydrophobicContact CE1-CG1 4.14Å; F473-I549 HydrophobicContact CE1-CG2 3.62Å; F473-I549 HydrophobicContact CZ-CG2 4.39Å; A543-I549 HydrophobicContact CB-CD1 3.81Å; A543-I549 HydrophobicContact CB-CG1 4.14Å; I549-K629 WeakPolarHBondContact O-CA 3.47Å; I549-L630 HydrophobicContact CB-CB 4.39Å; I549-L630 PolarHBondContact N-O 2.95Å; I549-L630 PolarHBondContact O-N 3.09Å; I549-P632 HydrophobicContact CD1-CG 4.25Å; I549-L638 HydrophobicContact CD1-CD2 3.81Å; I549-I640 HydrophobicContact CG2-CD1 4.22Å; I549-P703 HydrophobicContact CD1-CG 4.06Å; I549-I705 HydrophobicContact CD1-CD1 3.9Å
550	I	96.6	Very high	94.7	Very high	13 Å²	13	22.8 Å²	22.8	7%	0.067	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.5	-177.9	-53.6	175.3	0	0	0	108.9	V471 Y472 E476 L492 R627 L628 K629	V471-I550 CarbonylContact C-O 3.35Å; V471-I550 WeakPolarHBondContact CA-O 3.22Å; Y472-I550 HydrophobicContact CD1-CD1 4.1Å; Y472-I550 HydrophobicContact CD1-CG1 4.43Å; Y472-I550 PolarHBondContact N-O 3.47Å; Y472-I550 PolarHBondContact O-N 3.02Å; E476-I550 HydrophobicContact CG-CD1 4.39Å; L492-I550 HydrophobicContact CD1-CB 4.04Å; L492-I550 HydrophobicContact CD1-CD1 4.43Å; L492-I550 HydrophobicContact CD1-CG2 3.58Å; I550-R627 HydrophobicContact CG2-CB 3.94Å; I550-R627 HydrophobicContact CG2-CG 4.39Å; I550-L628 CarbonylContact C-O 3.57Å; I550-L628 WeakPolarHBondContact CA-O 3.45Å; I550-K629 HydrophobicContact CG1-CG 4.24Å
551	V	97.1	Very high	94.7	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.6	175.8	-170.9	0	0	0	0	109.1	T469 R470 V471 V553 L570 L628 I640 L701	T469-V551 HydrophobicContact CG2-CG1 3.59Å; R470-V551 CarbonylContact O-C 3.36Å; R470-V551 WeakPolarHBondContact O-CA 3.46Å; V471-V551 HydrophobicContact CG1-CG2 4.38Å; V471-V551 HydrophobicContact CG2-CG1 4.49Å; V551-V553 HydrophobicContact CG1-CG2 3.77Å; V551-L570 HydrophobicContact CB-CD1 3.92Å; V551-L570 HydrophobicContact CB-CD2 3.97Å; V551-L570 HydrophobicContact CG1-CD2 4.2Å; V551-L570 HydrophobicContact CG2-CD1 3.67Å; V551-L570 HydrophobicContact CG2-CD2 4.18Å; V551-L628 PolarHBondContact N-O 3.48Å; V551-L628 PolarHBondContact O-N 2.83Å; V551-I640 HydrophobicContact CG2-CD1 3.66Å; V551-I640 HydrophobicContact CG2-CG2 4.45Å; V551-L701 HydrophobicContact CG1-CD2 4.17Å
552	E	96.7	Very high	94.6	Very high	20 Å²	20	24.1 Å²	24.1	9%	0.093	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	109.3	176.2	-171.5	169.3	87.7	0	0	108.6	T469 R470 T625 A626 R627	T469-E552 VanDerWaalsContact CA-O 3.29Å; T469-E552 WeakPolarHBondContact CA-O 3.32Å; R470-E552 HydrophobicContact CB-CB 4.13Å; R470-E552 WeakPolarHBondContact CD-OE1 3.49Å; R470-E552 IonicContact CZ-OE1 3.52Å; R470-E552 PolarHBondContact N-O 3.4Å; R470-E552 IonicContact NE-OE1 2.67Å; R470-E552 IonicContact NH1-OE1 3.43Å; R470-E552 PolarHBondContact NH1-OE1 3.26Å; R470-E552 PolarHBondContact O-N 2.9Å; E552-T625 HydrophobicContact CG-CG2 3.24Å; E552-A626 CarbonylContact C-O 3.55Å; E552-A626 WeakPolarHBondContact CA-O 3.31Å; E552-R627 HydrophobicContact CB-CG 4.41Å; E552-R627 HydrophobicContact CG-CG 4.21Å; E552-R627 IonicContact OE2-CZ 2.73Å; E552-R627 VanDerWaalsContact OE2-CZ 3.27Å; E552-R627 IonicContact OE2-NE 3.21Å; E552-R627 PolarHBondContact OE2-NE 3.4Å; E552-R627 IonicContact OE2-NH2 2.62Å; E552-R627 PolarHBondContact OE2-NH2 2.97Å
553	V	97.3	Very high	94.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.7	-176.1	-175.8	0	0	0	0	109.7	I464 T469 V551 F555 T625 A626 L628 L676	I464-V553 HydrophobicContact CG2-CG1 3.7Å; T469-V553 HydrophobicContact CG2-CG2 4.43Å; V551-V553 HydrophobicContact CG1-CG2 3.77Å; V553-F555 HydrophobicContact CB-CE2 3.82Å; V553-F555 HydrophobicContact CB-CZ 3.96Å; V553-F555 HydrophobicContact CG1-CD2 4.34Å; V553-F555 HydrophobicContact CG1-CE1 3.96Å; V553-F555 HydrophobicContact CG1-CE2 3.74Å; V553-F555 HydrophobicContact CG1-CZ 3.54Å; V553-F555 WeakPolarHBondContact O-CD2 3.43Å; V553-T625 WeakPolarHBondContact O-CA 3.36Å; V553-A626 PolarHBondContact N-O 3.14Å; V553-A626 PolarHBondContact O-N 3.17Å; V553-L628 HydrophobicContact CG2-CD1 4.39Å; V553-L676 HydrophobicContact CG1-CD2 4.1Å; V553-L676 HydrophobicContact CG2-CD1 4.4Å; V553-L676 HydrophobicContact CG2-CD2 4.33Å
554	T	97.1	Very high	94.6	Very high	20 Å²	20	22.1 Å²	22.1	12%	0.123	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.2	178.2	-60.4	0	0	0	0	110.7	H465 T623 T625	H465-T554 HydrophobicContact CB-CG2 4.33Å; H465-T554 PolarHBondContact N-O 2.87Å; T554-T623 HydrophobicContact CG2-CG2 3.69Å; T554-T625 PolarHBondContact OG1-OG1 3.22Å
555	F	97	Very high	94.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.4	-179.6	-59.5	-84.7	0	0	0	110.4	P462 H463 I464 V553 L568 F616 L618 T623 K624 A626 V643	P462-F555 HydrophobicContact CB-CB 4.35Å; P462-F555 HydrophobicContact CG-CB 4.18Å; P462-F555 HydrophobicContact CG-CD1 3.57Å; P462-F555 HydrophobicContact CG-CE1 4.38Å; P462-F555 HydrophobicContact CG-CG 4.26Å; H463-F555 CarbonylContact O-C 3.5Å; H463-F555 WeakPolarHBondContact O-CA 3.35Å; I464-F555 HydrophobicContact CD1-CD1 4.38Å; I464-F555 HydrophobicContact CD1-CE1 3.87Å; I464-F555 HydrophobicContact CG1-CD1 3.72Å; I464-F555 HydrophobicContact CG1-CE1 3.72Å; V553-F555 HydrophobicContact CB-CE2 3.82Å; V553-F555 HydrophobicContact CB-CZ 3.96Å; V553-F555 HydrophobicContact CG1-CD2 4.34Å; V553-F555 HydrophobicContact CG1-CE1 3.96Å; V553-F555 HydrophobicContact CG1-CE2 3.74Å; V553-F555 HydrophobicContact CG1-CZ 3.54Å; V553-F555 WeakPolarHBondContact O-CD2 3.43Å; F555-L568 HydrophobicContact CE2-CD2 4.2Å; F555-L568 HydrophobicContact CZ-CD1 4.15Å; F555-L568 HydrophobicContact CZ-CD2 4.19Å; F555-F616 HydrophobicContact CB-CE1 4.45Å; F555-F616 AromaticContact CD2-CE1 3.9Å; F555-F616 HydrophobicContact CD2-CE1 3.9Å; F555-F616 HydrophobicContact CD2-CZ 4.1Å; F555-F616 HydrophobicContact CG-CE1 4.36Å; F555-L618 HydrophobicContact CB-CD1 4.47Å; F555-L618 HydrophobicContact CB-CD2 3.95Å; F555-T623 CarbonylContact O-C 3.6Å; F555-T623 VanDerWaalsContact O-CA 3.31Å; F555-T623 WeakPolarHBondContact O-CA 3.19Å; F555-K624 PolarHBondContact N-O 3.02Å; F555-K624 PolarHBondContact O-N 3.33Å; F555-A626 HydrophobicContact CD2-CB 4.32Å; F555-A626 HydrophobicContact CE2-CB 3.78Å; F555-V643 HydrophobicContact CE1-CG2 4.18Å; F555-V643 HydrophobicContact CZ-CG1 4.35Å; F555-V643 HydrophobicContact CZ-CG2 4.46Å
556	R	95.6	Very high	94.7	Very high	63 Å²	63	21.3 Å²	21.3	24%	0.238	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.6	169.5	175.2	178.5	179.7	-109.4	-3.4	109.5	D426 P462 H463 P558 E622 T623	D426-R556 IonicContact OD1-NH1 2.69Å; D426-R556 IonicContact OD1-NH2 3.33Å; P462-R556 WeakPolarHBondContact CB-O 3.33Å; H463-R556 HydrophobicContact CB-CB 4.43Å; H463-R556 PolarHBondContact N-O 3.13Å; H463-R556 PolarHBondContact O-N 3.14Å; R556-P558 WeakPolarHBondContact O-CD 3.44Å; R556-E622 WeakPolarHBondContact CA-O 3.25Å; R556-T623 HydrophobicContact CB-CG2 4.45Å
557	N	94.5	Very high	94.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.109	C	C	.	.			trans	-80.9	120.5	162	-176.3	10.2	0	0	0	108.9	L559 V561 L563 L618 G619 E621 E622	N557-L559 PolarHBondContact ND2-O 2.86Å; N557-L559 WeakPolarHBondContact OD1-CB 3.43Å; N557-L559 PolarHBondContact OD1-N 3.18Å; N557-V561 PolarHBondContact ND2-O 2.91Å; N557-L563 HydrophobicContact CB-CD1 4.3Å; N557-L563 WeakPolarHBondContact OD1-CD1 3.35Å; N557-L618 HydrophobicContact CB-CB 4.11Å; N557-L618 HydrophobicContact CB-CD2 4.42Å; N557-G619 PolarHBondContact ND2-O 3.03Å; N557-E621 CarbonylContact O-C 3.58Å; N557-E621 VanDerWaalsContact O-CA 3.27Å; N557-E621 WeakPolarHBondContact O-CA 3.37Å; N557-E622 PolarHBondContact N-O 2.92Å
558	P	92.9	Very high	95	Very high	7 Å²	7	19.6 Å²	19.6	5%	0.045	10%	0.104	C	C	.	.			trans	-87.1	-7.4	172.8	36.1	-35.5	0	0	0	113.1	L461 R556	L461-P558 HydrophobicContact CD2-CG 3.3Å; R556-P558 WeakPolarHBondContact O-CD 3.44Å
559	L	92.6	Very high	95	Very high	4 Å²	4	19.8 Å²	19.8	2%	0.021	11%	0.106	C	C	.	.	S	Bend	trans	-92.9	154.1	-176.8	-56.5	-170.6	0	0	0	112.3	L423 L438 L461 N557 V561 L563 E621	L423-L559 HydrophobicContact CD2-CD1 4.33Å; L423-L559 HydrophobicContact CD2-CD2 4.42Å; L438-L559 HydrophobicContact CD2-CD1 4.48Å; L461-L559 HydrophobicContact CD1-CD1 3.6Å; L461-L559 HydrophobicContact CD1-CD2 4.45Å; L461-L559 HydrophobicContact CD1-CG 3.98Å; N557-L559 PolarHBondContact ND2-O 2.86Å; N557-L559 WeakPolarHBondContact OD1-CB 3.43Å; N557-L559 PolarHBondContact OD1-N 3.18Å; L559-V561 HydrophobicContact CB-CB 4.4Å; L559-V561 PolarHBondContact O-N 3.46Å; L559-L563 HydrophobicContact CD1-CD2 4.38Å; L559-E621 PolarHBondContact O-N 3.12Å
560	K	92.1	Very high	95	Very high	71 Å²	71	19.8 Å²	19.8	31%	0.309	11%	0.106	S	C	.	.	S	Bend	trans	-78.4	13.2	168.7	-58.6	173.9	-172.1	166.9	0	113.4	R428 Q429 A431 S620 E621	R428-K560 PolarHBondContact O-NZ 3.34Å; Q429-K560 PolarHBondContact O-NZ 2.9Å; A431-K560 HydrophobicContact CB-CB 4.04Å; A431-K560 WeakPolarHBondContact CB-O 3.41Å; K560-S620 VanDerWaalsContact CA-OG 3.31Å; K560-S620 WeakPolarHBondContact CA-OG 3.41Å; K560-E621 HydrophobicContact CG-CG 4.5Å
561	V	91.6	Very high	95	Very high	24 Å²	24	19.2 Å²	19.2	15%	0.145	10%	0.103	C	C	.	.	S	Bend	trans	-123	129.6	-177.2	-175.7	0	0	0	0	106.3	A431 Q434 A435 N557 L559	A431-V561 HydrophobicContact CB-CG2 4.06Å; A431-V561 WeakPolarHBondContact O-CG2 3.39Å; Q434-V561 HydrophobicContact CB-CG2 4.1Å; A435-V561 HydrophobicContact CB-CG1 4.29Å; A435-V561 HydrophobicContact CB-CG2 4.02Å; N557-V561 PolarHBondContact ND2-O 2.91Å; L559-V561 HydrophobicContact CB-CB 4.4Å; L559-V561 PolarHBondContact O-N 3.46Å
562	S	92.4	Very high	94.9	Very high	59 Å²	59	19.2 Å²	19.2	41%	0.413	10%	0.103	S	C	.	.			trans	-61.6	139.9	176.8	-54	0	0	0	0	110.9	L618	S562-L618 CarbonylContact C-O 3.51Å; S562-L618 WeakPolarHBondContact CA-O 3.38Å; S562-L618 WeakPolarHBondContact CB-O 3.35Å
563	L	93.5	Very high	94.7	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.8	174.1	-57.9	179.6	0	0	0	109.3	L438 L461 P462 N557 L559 L565 L618 L647	L438-L563 HydrophobicContact CD2-CD2 3.84Å; L461-L563 HydrophobicContact CB-CD1 4.18Å; P462-L563 HydrophobicContact CB-CD1 4.35Å; N557-L563 HydrophobicContact CB-CD1 4.3Å; N557-L563 WeakPolarHBondContact OD1-CD1 3.35Å; L559-L563 HydrophobicContact CD1-CD2 4.38Å; L563-L565 HydrophobicContact CB-CD2 4.43Å; L563-L618 HydrophobicContact CB-CB 4.42Å; L563-L618 PolarHBondContact N-O 3.35Å; L563-L618 PolarHBondContact O-N 3.49Å; L563-L647 HydrophobicContact CD2-CD1 4.34Å
564	L	93.7	Very high	94.5	Very high	24 Å²	24	22.3 Å²	22.3	13%	0.126	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	115.3	166.2	170.7	57.4	0	0	0	108.4	E615 Y617 T648	L564-E615 HydrophobicContact CD1-CB 3.94Å; L564-E615 HydrophobicContact CD1-CG 4.24Å; L564-Y617 HydrophobicContact CB-CD1 4.47Å; L564-Y617 HydrophobicContact CB-CE1 4.42Å; L564-Y617 HydrophobicContact CD1-CD1 4.04Å; L564-Y617 HydrophobicContact CD1-CD2 4.3Å; L564-Y617 HydrophobicContact CD1-CE1 3.79Å; L564-Y617 HydrophobicContact CD1-CE2 4.06Å; L564-Y617 HydrophobicContact CD1-CG 4.28Å; L564-Y617 HydrophobicContact CD2-CE1 4.15Å; L564-Y617 HydrophobicContact CG-CE1 4.33Å; L564-T648 PolarHBondContact O-OG1 3.19Å
565	L	95.1	Very high	94.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	116.3	168.6	-40.5	-177.9	0	0	0	107.3	P462 L563 F616 L618 Y645 N646 L647	P462-L565 HydrophobicContact CG-CD1 3.92Å; L563-L565 HydrophobicContact CB-CD2 4.43Å; L565-F616 HydrophobicContact CB-CB 4.37Å; L565-F616 HydrophobicContact CD1-CD1 4.06Å; L565-F616 PolarHBondContact N-O 2.83Å; L565-F616 PolarHBondContact O-N 3.39Å; L565-L618 HydrophobicContact CD1-CD1 3.82Å; L565-L618 HydrophobicContact CG-CD1 4.09Å; L565-Y645 HydrophobicContact CB-CD2 4.37Å; L565-Y645 HydrophobicContact CB-CG 4.36Å; L565-Y645 HydrophobicContact CD1-CG 4.4Å; L565-Y645 HydrophobicContact CD2-CD2 3.9Å; L565-Y645 HydrophobicContact CD2-CE2 4.09Å; L565-Y645 HydrophobicContact CG-CD2 4.47Å; L565-N646 WeakPolarHBondContact CA-O 3.49Å; L565-L647 HydrophobicContact CD2-CD1 3.71Å
566	S	94.7	Very high	93.5	Very high	20 Å²	20	25.8 Å²	25.8	14%	0.14	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	153.6	171.9	56.4	0	0	0	0	111.5	L568 K614 N646	S566-L568 VanDerWaalsContact C-N 3.32Å; S566-L568 PolarHBondContact O-N 2.97Å; S566-K614 CarbonylContact C-O 3.57Å; S566-K614 WeakPolarHBondContact CA-O 3.47Å; S566-K614 VanDerWaalsContact CB-O 3.3Å; S566-K614 WeakPolarHBondContact CB-O 3.45Å; S566-N646 PolarHBondContact N-O 3.43Å; S566-N646 WeakPolarHBondContact O-CB 3.28Å; S566-N646 PolarHBondContact O-N 2.91Å; S566-N646 VanDerWaalsContact OG-CB 3.31Å; S566-N646 WeakPolarHBondContact OG-CB 3.4Å
567	N	94.8	Very high	91.9	Very high	78 Å²	78	23.4 Å²	23.4	42%	0.417	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	50	47.6	-176.8	-56.4	-35.2	0	0	0	113.6	S569 I612 I613 K614 N646	N567-S569 PolarHBondContact O-N 2.87Å; N567-I612 HydrophobicContact CB-CG2 3.89Å; N567-I613 CarbonylContact C-O 3.53Å; N567-I613 WeakPolarHBondContact CA-O 3.45Å; N567-I613 PolarHBondContact N-O 3.47Å; N567-K614 PolarHBondContact N-O 3.29Å; N567-N646 PolarHBondContact ND2-ND2 2.88Å
568	L	96.9	Very high	89.8	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	122.9	178.3	173.2	66.9	0	0	0	110.4	F555 S566 I613 F616 A626 L628 V643 I644 Y645	F555-L568 HydrophobicContact CE2-CD2 4.2Å; F555-L568 HydrophobicContact CZ-CD1 4.15Å; F555-L568 HydrophobicContact CZ-CD2 4.19Å; S566-L568 VanDerWaalsContact C-N 3.32Å; S566-L568 PolarHBondContact O-N 2.97Å; L568-I613 HydrophobicContact CB-CB 4.3Å; L568-I613 PolarHBondContact N-O 3.3Å; L568-I613 PolarHBondContact O-N 3.47Å; L568-F616 HydrophobicContact CD2-CB 3.87Å; L568-F616 HydrophobicContact CD2-CD1 4.12Å; L568-F616 HydrophobicContact CD2-CD2 4.32Å; L568-F616 HydrophobicContact CD2-CG 3.86Å; L568-A626 HydrophobicContact CD2-CB 4.3Å; L568-L628 HydrophobicContact CD2-CD2 4.33Å; L568-L628 HydrophobicContact CG-CD1 4.48Å; L568-L628 HydrophobicContact CG-CD2 4.08Å; L568-V643 HydrophobicContact CD1-CB 4.15Å; L568-I644 WeakPolarHBondContact CA-O 3.48Å; L568-Y645 HydrophobicContact CD1-CD1 3.84Å; L568-Y645 HydrophobicContact CD1-CG 4.29Å
569	S	96.6	Very high	87.4	Confident	11 Å²	11	32.3 Å²	32.3	8%	0.077	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	168.8	179	66.1	0	0	0	0	112.1	N567 V643 I644	N567-S569 PolarHBondContact O-N 2.87Å; S569-V643 CarbonylContact O-C 3.55Å; S569-V643 WeakPolarHBondContact O-CA 3.22Å; S569-V643 WeakPolarHBondContact O-CB 3.25Å; S569-I644 PolarHBondContact N-O 3.13Å; S569-I644 PolarHBondContact O-N 2.71Å
570	L	97	Very high	84.8	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	137.2	174.6	-71.3	161.1	0	0	0	110.9	V551 N596 L628 L630 I640 V643 L676	V551-L570 HydrophobicContact CB-CD1 3.92Å; V551-L570 HydrophobicContact CB-CD2 3.97Å; V551-L570 HydrophobicContact CG1-CD2 4.2Å; V551-L570 HydrophobicContact CG2-CD1 3.67Å; V551-L570 HydrophobicContact CG2-CD2 4.18Å; L570-N596 PolarHBondContact O-ND2 3.27Å; L570-L628 HydrophobicContact CD1-CB 3.64Å; L570-L628 HydrophobicContact CD2-CB 4.14Å; L570-L628 HydrophobicContact CD2-CD1 3.85Å; L570-L628 HydrophobicContact CG-CB 3.57Å; L570-L628 HydrophobicContact CG-CD1 3.88Å; L570-L628 HydrophobicContact CG-CG 4.36Å; L570-L630 HydrophobicContact CB-CD2 4.13Å; L570-L630 HydrophobicContact CB-CG 4.5Å; L570-L630 HydrophobicContact CD1-CD1 4.1Å; L570-L630 HydrophobicContact CD1-CD2 4.11Å; L570-L630 HydrophobicContact CD1-CG 3.74Å; L570-I640 HydrophobicContact CB-CG2 4.45Å; L570-I640 HydrophobicContact CD2-CG2 3.85Å; L570-V643 HydrophobicContact CD2-CG1 4.14Å; L570-L676 HydrophobicContact CD2-CD1 4.41Å
571	L	95.1	Very high	82.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.4	166.2	172.6	66.6	0	0	0	108.9	N596 E597 I640 V641 G642 I644 R673	L571-N596 WeakPolarHBondContact CA-OD1 3.43Å; L571-E597 HydrophobicContact CD1-CB 3.93Å; L571-E597 HydrophobicContact CD1-CG 4.35Å; L571-I640 CarbonylContact O-C 3.48Å; L571-V641 HydrophobicContact CD2-CB 4.05Å; L571-V641 HydrophobicContact CD2-CG1 4.16Å; L571-V641 HydrophobicContact CG-CB 4.08Å; L571-V641 PolarHBondContact O-N 2.92Å; L571-G642 PolarHBondContact N-O 2.82Å; L571-G642 PolarHBondContact O-N 3.13Å; L571-I644 HydrophobicContact CB-CD1 4.14Å; L571-I644 HydrophobicContact CB-CG1 4.12Å; L571-I644 HydrophobicContact CD1-CD1 3.82Å; L571-I644 HydrophobicContact CD1-CG1 4.41Å; L571-R673 HydrophobicContact CD2-CB 4.44Å
572	W	95.1	Very high	79.3	Confident	1 Å²	1	41.9 Å²	41.9	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	161	179.1	58.9	-100.5	0	0	0	112.9	F574 T595 N596 V608 T610 L630 L638 N639	W572-F574 HydrophobicContact CE3-CB 3.97Å; W572-F574 HydrophobicContact CZ3-CB 3.72Å; W572-T595 WeakPolarHBondContact O-CA 3.41Å; W572-T595 PolarHBondContact O-OG1 2.94Å; W572-N596 HydrophobicContact CD2-CB 4.31Å; W572-N596 HydrophobicContact CH2-CB 4.46Å; W572-N596 HydrophobicContact CZ2-CB 3.8Å; W572-N596 PolarHBondContact N-OD1 3.25Å; W572-N596 PolarHBondContact NE1-ND2 2.81Å; W572-N596 PolarHBondContact O-N 3.01Å; W572-N596 PolarHBondContact O-OD1 2.69Å; W572-V608 HydrophobicContact CH2-CB 4.11Å; W572-V608 HydrophobicContact CH2-CG2 4.36Å; W572-V608 HydrophobicContact CZ2-CB 3.69Å; W572-V608 HydrophobicContact CZ2-CG1 4.45Å; W572-V608 HydrophobicContact CZ2-CG2 4.36Å; W572-T610 PolarHBondContact NE1-OG1 3.07Å; W572-L630 HydrophobicContact CB-CD1 4.41Å; W572-L630 HydrophobicContact CG-CD1 4.37Å; W572-L638 HydrophobicContact CB-CD1 3.83Å; W572-L638 HydrophobicContact CD2-CD1 4.09Å; W572-L638 HydrophobicContact CE3-CD1 3.96Å; W572-L638 HydrophobicContact CG-CD1 4.05Å; W572-N639 CarbonylContact C-O 3.54Å; W572-N639 VanDerWaalsContact CA-O 3.22Å; W572-N639 WeakPolarHBondContact CA-O 3.49Å
573	R	93.8	Very high	76.5	Confident	83 Å²	83	48.7 Å²	48.7	31%	0.313	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.3	174.4	-61.9	173.8	177.5	-171.7	-9.6	109.2	M593 I594 N639 V641	R573-M593 HydrophobicContact CB-CE 3.91Å; R573-M593 VanDerWaalsContact CD-CE 3.49Å; R573-M593 HydrophobicContact CG-CE 4.23Å; R573-I594 CarbonylContact C-O 3.58Å; R573-I594 VanDerWaalsContact CA-O 3.27Å; R573-I594 WeakPolarHBondContact CA-O 3.47Å; R573-N639 PolarHBondContact N-O 3.43Å; R573-N639 PolarHBondContact O-N 2.71Å; R573-V641 HydrophobicContact CB-CG2 4.43Å; R573-V641 HydrophobicContact CG-CG2 3.84Å
574	F	93	Very high	73.9	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.009	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.5	-174.3	-174	-95.2	0	0	0	110.8	W572 T576 I594 I607 V608 R634 Q637 L638 I705	W572-F574 HydrophobicContact CE3-CB 3.97Å; W572-F574 HydrophobicContact CZ3-CB 3.72Å; F574-T576 HydrophobicContact CD1-CG2 4.28Å; F574-T576 HydrophobicContact CE1-CG2 3.7Å; F574-I594 PolarHBondContact N-O 3.44Å; F574-I594 PolarHBondContact O-N 3.16Å; F574-I607 HydrophobicContact CB-CG2 4.42Å; F574-I607 HydrophobicContact CD1-CG2 3.44Å; F574-I607 VanDerWaalsContact CD1-CG2 3.44Å; F574-I607 HydrophobicContact CD2-CG2 4.3Å; F574-I607 HydrophobicContact CE1-CG2 3.59Å; F574-I607 HydrophobicContact CE2-CG2 4.43Å; F574-I607 HydrophobicContact CG-CG2 3.81Å; F574-I607 HydrophobicContact CZ-CG2 4.09Å; F574-V608 HydrophobicContact CD2-CG2 4.46Å; F574-R634 HydrophobicContact CE1-CB 4.34Å; F574-R634 HydrophobicContact CZ-CB 4.04Å; F574-R634 WeakPolarHBondContact CZ-O 3.45Å; F574-Q637 WeakPolarHBondContact CA-O 3.22Å; F574-L638 HydrophobicContact CB-CD1 4.43Å; F574-L638 HydrophobicContact CD2-CB 4.14Å; F574-L638 HydrophobicContact CD2-CD1 4.17Å; F574-I705 HydrophobicContact CE2-CG1 4.08Å
575	S	91.1	Very high	70.9	Confident	22 Å²	22	62.5 Å²	62.5	15%	0.154	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.8	173	59	0	0	0	0	111.8	G577 G636 Q637	S575-G577 PolarHBondContact O-N 3.08Å; S575-G636 WeakPolarHBondContact O-CA 3.46Å; S575-Q637 PolarHBondContact N-O 3.36Å; S575-Q637 PolarHBondContact O-N 3.35Å
576	T	80.5	Confident	68	Low	70 Å²	70	68.4 Å²	68.4	43%	0.429	41%	0.414	S	S	.	.			trans	-86.4	41.5	175.5	51.8	0	0	0	0	112	F574	F574-T576 HydrophobicContact CD1-CG2 4.28Å; F574-T576 HydrophobicContact CE1-CG2 3.7Å
577	G	63.3	Low	65.2	Low	13 Å²	13	75.7 Å²	75.7	13%	0.134	45%	0.446	C	S	.	.			trans	-100.8	126.4	179.3	0	0	0	0	0	112	S575 P579 E591	S575-G577 PolarHBondContact O-N 3.08Å; G577-P579 WeakPolarHBondContact O-CD 3.42Å; G577-E591 VanDerWaalsContact CA-OE1 3.26Å; G577-E591 WeakPolarHBondContact CA-OE1 3.31Å
578	T	49.7	Very low	62.4	Low	116 Å²	116	81.8 Å²	81.8	71%	0.712	47%	0.472	S	S	*	.			trans	-70	121.5	163.3	13.1	0	0	0	0	109	L580	T578-L580 VanDerWaalsContact C-N 3.3Å; T578-L580 PolarHBondContact O-N 3.38Å
579	P	43.4	Very low	59.5	Low	79 Å²	79	88.6 Å²	88.6	51%	0.513	51%	0.507	S	S	.	.			trans	-70.4	90.9	173	28.3	-33.4	0	0	0	109.3	G577 G581 K856	G577-P579 WeakPolarHBondContact O-CD 3.42Å; P579-G581 PolarHBondContact O-N 2.86Å; P579-K856 VanDerWaalsContact CG-NZ 3.3Å
580	L	37.7	Very low	56.8	Low	152 Å²	152	93 Å²	93	80%	0.796	54%	0.538	S	S	*	.			trans	-71.8	90.5	179.5	-84.9	161.7	0	0	0	110.5	T578 G582	T578-L580 VanDerWaalsContact C-N 3.3Å; T578-L580 PolarHBondContact O-N 3.38Å; L580-G582 VanDerWaalsContact C-N 3.29Å; L580-G582 PolarHBondContact O-N 2.67Å
581	G	36.6	Very low	54.7	Low	89 Å²	89	98.3 Å²	98.3	92%	0.918	56%	0.563	S	S	*	*			trans	-70.2	83.9	161.5	0	0	0	0	0	110.8	P579	P579-G581 PolarHBondContact O-N 2.86Å
582	G	30.8	Very low	53.1	Low	58 Å²	58	106 Å²	106	60%	0.598	60%	0.599	S	S	*	*	S	Bend	trans	159.8	92.5	170.6	0	0	0	0	0	116.9	L580	L580-G582 VanDerWaalsContact C-N 3.29Å; L580-G582 PolarHBondContact O-N 2.67Å
583	K	33.3	Very low	52.4	Low	203 Å²	203	111.3 Å²	111.3	88%	0.883	63%	0.625	S	S	*	*			trans	60	108.1	160.4	-65.1	-173.7	176.3	-176.4	0	118.7
584	E	39.4	Very low	52.1	Low	200 Å²	200	109.9 Å²	109.9	94%	0.935	62%	0.623	S	S	*	*			trans	12.5	103	140.6	-63.3	174.6	-176.1	0	0	118.2
585	S	30.5	Very low	51.8	Low	114 Å²	114	110.8 Å²	110.8	80%	0.797	63%	0.629	S	S	*	*			trans	-142.2	114.7	142	57.9	0	0	0	0	108.3	E587	S585-E587 PolarHBondContact O-N 3.42Å
586	S	34.7	Very low	51.7	Low	124 Å²	124	110.7 Å²	110.7	87%	0.867	63%	0.626	S	S	*	*			trans	-80.8	92.9	-172.4	53.4	0	0	0	0	112.1
587	E	35	Very low	51.8	Low	174 Å²	174	108.1 Å²	108.1	81%	0.813	61%	0.609	S	S	*	*			trans	-126.8	121.4	159.2	-69.6	-168.2	170.9	0	0	109.5	S585 I589	S585-E587 PolarHBondContact O-N 3.42Å; E587-I589 PolarHBondContact O-N 3.16Å
588	Q	36.5	Very low	52.4	Low	206 Å²	206	111 Å²	111	96%	0.963	62%	0.622	S	S	*	*			trans	-78.8	83.4	-178.7	-69.7	175.4	-50.5	0	0	110	S590	Q588-S590 PolarHBondContact O-N 3.38Å
589	I	36.3	Very low	52.8	Low	143 Å²	143	109.8 Å²	109.8	73%	0.733	61%	0.614	S	S	*	*			trans	-77.6	115.1	156.3	-57.4	178.1	0	0	0	106.4	E587 E591	E587-I589 PolarHBondContact O-N 3.16Å; I589-E591 PolarHBondContact O-N 2.96Å
590	S	39.5	Very low	53.5	Low	102 Å²	102	109.5 Å²	109.5	71%	0.713	61%	0.614	S	S	*	*			trans	-69.4	92.7	170.1	51	0	0	0	0	109	Q588 E592	Q588-S590 PolarHBondContact O-N 3.38Å; S590-E592 PolarHBondContact O-N 3.37Å; S590-E592 VanDerWaalsContact O-N 3.1Å
591	E	54.1	Low	54.3	Low	114 Å²	114	105.4 Å²	105.4	53%	0.533	60%	0.602	S	S	.	*			trans	-58.6	113.6	172.8	-69.1	-170.5	166.5	0	0	109.7	G577 I589 M593	G577-E591 VanDerWaalsContact CA-OE1 3.26Å; G577-E591 WeakPolarHBondContact CA-OE1 3.31Å; I589-E591 PolarHBondContact O-N 2.96Å; E591-M593 PolarHBondContact O-N 3.12Å
592	E	61	Low	55.3	Low	162 Å²	162	104 Å²	104	76%	0.757	59%	0.587	S	S	*	*			trans	-67.6	115.9	176.3	-67.6	-176	163.2	0	0	109.7	S590	S590-E592 PolarHBondContact O-N 3.37Å; S590-E592 VanDerWaalsContact O-N 3.1Å
593	M	79.4	Confident	56.8	Low	112 Å²	112	108.6 Å²	108.6	55%	0.552	59%	0.593	S	S	*	*			trans	-96.7	104.9	-173.7	-164.9	164.2	117.7	0	0	110.2	R573 E591	R573-M593 HydrophobicContact CB-CE 3.91Å; R573-M593 VanDerWaalsContact CD-CE 3.49Å; R573-M593 HydrophobicContact CG-CE 4.23Å; E591-M593 PolarHBondContact O-N 3.12Å
594	I	87.6	Confident	58.8	Low	52 Å²	52	100 Å²	100	27%	0.267	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.1	136.5	-169.1	-57.8	172.3	0	0	0	109.8	R573 F574 I607	R573-I594 CarbonylContact C-O 3.58Å; R573-I594 VanDerWaalsContact CA-O 3.27Å; R573-I594 WeakPolarHBondContact CA-O 3.47Å; F574-I594 PolarHBondContact N-O 3.44Å; F574-I594 PolarHBondContact O-N 3.16Å; I594-I607 HydrophobicContact CB-CD1 4.49Å; I594-I607 HydrophobicContact CD1-CD1 3.46Å; I594-I607 VanDerWaalsContact CD1-CD1 3.46Å; I594-I607 HydrophobicContact CG2-CD1 3.97Å
595	T	88	Confident	60.7	Low	22 Å²	22	96.5 Å²	96.5	14%	0.135	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	146.9	-175.8	-178.9	0	0	0	0	111	W572 E597 D598 K604	W572-T595 WeakPolarHBondContact O-CA 3.41Å; W572-T595 PolarHBondContact O-OG1 2.94Å; T595-E597 VanDerWaalsContact C-N 3.26Å; T595-E597 HydrophobicContact CG2-CB 4.13Å; T595-E597 PolarHBondContact O-N 3.11Å; T595-E597 PolarHBondContact OG1-N 3.2Å; T595-D598 WeakPolarHBondContact CG2-OD2 3.33Å; T595-K604 WeakPolarHBondContact O-CD 2.88Å; T595-K604 VanDerWaalsContact O-CE 3.24Å; T595-K604 WeakPolarHBondContact O-CE 3.02Å; T595-K604 PolarHBondContact O-NZ 2.84Å
596	N	88.5	Confident	63.2	Low	20 Å²	20	98.1 Å²	98.1	11%	0.107	53%	0.534	C	S	.	.	S	Bend	trans	-88.8	16.2	171.8	75.6	-29	0	0	0	114	L570 L571 W572	L570-N596 PolarHBondContact O-ND2 3.27Å; L571-N596 WeakPolarHBondContact CA-OD1 3.43Å; W572-N596 HydrophobicContact CD2-CB 4.31Å; W572-N596 HydrophobicContact CH2-CB 4.46Å; W572-N596 HydrophobicContact CZ2-CB 3.8Å; W572-N596 PolarHBondContact N-OD1 3.25Å; W572-N596 PolarHBondContact NE1-ND2 2.81Å; W572-N596 PolarHBondContact O-N 3.01Å; W572-N596 PolarHBondContact O-OD1 2.69Å
597	E	83.5	Confident	65.9	Low	16 Å²	16	92.6 Å²	92.6	8%	0.075	50%	0.495	C	S	.	.	S	Bend	trans	-67.6	-47.2	174.8	-160.9	163.4	174.1	0	0	111.8	C455 L456 L571 T595 R673	C455-E597 PolarHBondContact SG-OE1 2.69Å; L456-E597 HydrophobicContact CB-CG 4.43Å; L456-E597 HydrophobicContact CD1-CG 4.05Å; L456-E597 HydrophobicContact CG-CG 4.07Å; L456-E597 PolarHBondContact N-OE1 2.89Å; L571-E597 HydrophobicContact CD1-CB 3.93Å; L571-E597 HydrophobicContact CD1-CG 4.35Å; T595-E597 VanDerWaalsContact C-N 3.26Å; T595-E597 HydrophobicContact CG2-CB 4.13Å; T595-E597 PolarHBondContact O-N 3.11Å; T595-E597 PolarHBondContact OG1-N 3.2Å; E597-R673 IonicContact OE1-CZ 3.72Å; E597-R673 IonicContact OE1-NE 3.54Å; E597-R673 PolarHBondContact OE1-NE 3.47Å; E597-R673 IonicContact OE1-NH2 3.8Å; E597-R673 IonicContact OE2-NE 3.56Å
598	D	73.9	Confident	68.6	Low	74 Å²	74	84.4 Å²	84.4	40%	0.396	46%	0.457	S	S	.	.	S	Bend	trans	-84.7	153.6	-176.1	-19.9	-76	0	0	0	113.6	T595 S600 K604	T595-D598 WeakPolarHBondContact CG2-OD2 3.33Å; D598-S600 VanDerWaalsContact C-N 3.27Å; D598-S600 PolarHBondContact O-N 3.23Å; D598-S600 VanDerWaalsContact O-N 3.13Å; D598-K604 PolarHBondContact O-NZ 3.35Å; D598-K604 IonicContact OD2-NZ 2.9Å; D598-K604 PolarHBondContact OD2-NZ 3.42Å; D598-K604 VanDerWaalsContact OD2-NZ 3.16Å
599	T	58.3	Low	71.4	Confident	90 Å²	90	77.3 Å²	77.3	55%	0.552	43%	0.428	S	S	*	.	S	Bend	trans	-77.3	5.2	-167.4	-42.6	0	0	0	0	115.4	A601 R671	T599-A601 PolarHBondContact O-N 2.93Å; T599-R671 PolarHBondContact OG1-NH1 2.87Å
600	S	58.6	Low	74.2	Confident	73 Å²	73	71.9 Å²	71.9	51%	0.51	40%	0.401	S	S	.	.			trans	-74.8	84.2	174.5	44	0	0	0	0	112.3	D598 K604	D598-S600 VanDerWaalsContact C-N 3.27Å; D598-S600 PolarHBondContact O-N 3.23Å; D598-S600 VanDerWaalsContact O-N 3.13Å; S600-K604 VanDerWaalsContact O-CD 3.27Å; S600-K604 WeakPolarHBondContact O-CD 3.48Å; S600-K604 VanDerWaalsContact O-CE 3.22Å; S600-K604 WeakPolarHBondContact O-CE 3.16Å; S600-K604 WeakPolarHBondContact O-CG 3.26Å; S600-K604 VanDerWaalsContact OG-CE 3.22Å; S600-K604 WeakPolarHBondContact OG-CE 3.46Å; S600-K604 PolarHBondContact OG-NZ 3.22Å
601	A	54.2	Low	76.8	Confident	66 Å²	66	71.5 Å²	71.5	55%	0.545	39%	0.388	S	S	.	.			trans	-68.1	-35.6	-169.2	0	0	0	0	0	115.9	T599 K604	T599-A601 PolarHBondContact O-N 2.93Å; A601-K604 PolarHBondContact O-N 3.42Å
602	G	58.3	Low	78.8	Confident	58 Å²	58	70.4 Å²	70.4	60%	0.598	39%	0.385	S	S	*	.	H	α-helix	trans	-60.8	-56.3	-164.8	0	0	0	0	0	115.5	K604	G602-K604 PolarHBondContact O-N 2.82Å
603	E	62.2	Low	80.5	Confident	156 Å²	156	64.5 Å²	64.5	73%	0.729	36%	0.358	S	S	*	.	H	α-helix	trans	-73	-13.3	-174.5	-61.9	176.5	164.1	0	0	113.4	I607	E603-I607 WeakPolarHBondContact O-CD1 3.49Å
604	K	74.7	Confident	81.2	Confident	21 Å²	21	67 Å²	67	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-86.4	-35.1	-172.6	-58.5	-175.6	-175	-168.8	0	112.1	T595 D598 S600 A601 G602 E606 I607 V608	T595-K604 WeakPolarHBondContact O-CD 2.88Å; T595-K604 VanDerWaalsContact O-CE 3.24Å; T595-K604 WeakPolarHBondContact O-CE 3.02Å; T595-K604 PolarHBondContact O-NZ 2.84Å; D598-K604 PolarHBondContact O-NZ 3.35Å; D598-K604 IonicContact OD2-NZ 2.9Å; D598-K604 PolarHBondContact OD2-NZ 3.42Å; D598-K604 VanDerWaalsContact OD2-NZ 3.16Å; S600-K604 VanDerWaalsContact O-CD 3.27Å; S600-K604 WeakPolarHBondContact O-CD 3.48Å; S600-K604 VanDerWaalsContact O-CE 3.22Å; S600-K604 WeakPolarHBondContact O-CE 3.16Å; S600-K604 WeakPolarHBondContact O-CG 3.26Å; S600-K604 VanDerWaalsContact OG-CE 3.22Å; S600-K604 WeakPolarHBondContact OG-CE 3.46Å; S600-K604 PolarHBondContact OG-NZ 3.22Å; A601-K604 PolarHBondContact O-N 3.42Å; G602-K604 PolarHBondContact O-N 2.82Å; K604-E606 VanDerWaalsContact C-N 3.28Å; K604-E606 PolarHBondContact O-N 2.72Å; K604-I607 PolarHBondContact O-N 2.67Å; K604-I607 VanDerWaalsContact O-N 3.15Å; K604-V608 PolarHBondContact O-N 3.38Å; K604-V608 VanDerWaalsContact O-N 3.11Å
605	E	78.9	Confident	81.6	Confident	127 Å²	127	69.8 Å²	69.8	59%	0.593	38%	0.378	S	S	*	.	H	α-helix	trans	-66.5	-29.6	175.3	-67.6	-174.1	173.1	0	0	111.9	I607 H633	E605-I607 PolarHBondContact O-N 3.35Å; E605-I607 VanDerWaalsContact O-N 3.15Å; E605-H633 PolarHBondContact O-CD2 3.07Å; E605-H633 VanDerWaalsContact O-CD2 3.23Å
606	E	84.1	Confident	82	Confident	148 Å²	148	69.5 Å²	69.5	69%	0.692	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-11.9	172.9	-61.2	-168.6	168.5	0	0	114.2	K604 H633	K604-E606 VanDerWaalsContact C-N 3.28Å; K604-E606 PolarHBondContact O-N 2.72Å; E606-H633 WeakPolarHBondContact O-CB 3.45Å
607	I	90.3	Very high	82.3	Confident	9 Å²	9	73.5 Å²	73.5	5%	0.046	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-52	-175.5	-54.8	169.5	0	0	0	110.3	F574 I594 E603 K604 E605 H633 R634	F574-I607 HydrophobicContact CB-CG2 4.42Å; F574-I607 HydrophobicContact CD1-CG2 3.44Å; F574-I607 VanDerWaalsContact CD1-CG2 3.44Å; F574-I607 HydrophobicContact CD2-CG2 4.3Å; F574-I607 HydrophobicContact CE1-CG2 3.59Å; F574-I607 HydrophobicContact CE2-CG2 4.43Å; F574-I607 HydrophobicContact CG-CG2 3.81Å; F574-I607 HydrophobicContact CZ-CG2 4.09Å; I594-I607 HydrophobicContact CB-CD1 4.49Å; I594-I607 HydrophobicContact CD1-CD1 3.46Å; I594-I607 VanDerWaalsContact CD1-CD1 3.46Å; I594-I607 HydrophobicContact CG2-CD1 3.97Å; E603-I607 WeakPolarHBondContact O-CD1 3.49Å; K604-I607 PolarHBondContact O-N 2.67Å; K604-I607 VanDerWaalsContact O-N 3.15Å; E605-I607 PolarHBondContact O-N 3.35Å; E605-I607 VanDerWaalsContact O-N 3.15Å; I607-H633 PolarHBondContact O-N 3.47Å; I607-R634 HydrophobicContact CG2-CB 4.47Å
608	V	92.8	Very high	82.8	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.006	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	109.9	174.2	-177.6	0	0	0	0	109.8	W572 F574 K604 T610 L630 L631 P632 L638	W572-V608 HydrophobicContact CH2-CB 4.11Å; W572-V608 HydrophobicContact CH2-CG2 4.36Å; W572-V608 HydrophobicContact CZ2-CB 3.69Å; W572-V608 HydrophobicContact CZ2-CG1 4.45Å; W572-V608 HydrophobicContact CZ2-CG2 4.36Å; F574-V608 HydrophobicContact CD2-CG2 4.46Å; K604-V608 PolarHBondContact O-N 3.38Å; K604-V608 VanDerWaalsContact O-N 3.11Å; V608-T610 PolarHBondContact O-N 3.19Å; V608-T610 PolarHBondContact O-OG1 3.41Å; V608-L630 HydrophobicContact CG1-CB 3.83Å; V608-L630 HydrophobicContact CG1-CD1 4.47Å; V608-L630 HydrophobicContact CG1-CD2 4.12Å; V608-L630 HydrophobicContact CG1-CG 4.36Å; V608-L631 CarbonylContact C-O 3.55Å; V608-L631 WeakPolarHBondContact CA-O 3.39Å; V608-P632 HydrophobicContact CG2-CB 4.26Å; V608-L638 HydrophobicContact CG2-CD1 4.18Å
609	T	94.8	Very high	83.7	Confident	58 Å²	58	70.3 Å²	70.3	36%	0.356	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	129.1	167.1	-69.4	0	0	0	0	109.2	L631 H633	T609-L631 PolarHBondContact N-O 3.34Å; T609-L631 PolarHBondContact O-N 3.47Å; T609-H633 WeakPolarHBondContact CB-NE2 3.48Å; T609-H633 PolarHBondContact OG1-NE2 3.12Å
610	T	94.8	Very high	85.4	Confident	28 Å²	28	69 Å²	69	17%	0.172	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.5	-175.9	-57.8	0	0	0	0	109.8	W572 V608 L630	W572-T610 PolarHBondContact NE1-OG1 3.07Å; V608-T610 PolarHBondContact O-N 3.19Å; V608-T610 PolarHBondContact O-OG1 3.41Å; T610-L630 HydrophobicContact CG2-CD2 3.76Å
611	E	94.6	Very high	87	Confident	94 Å²	94	70.6 Å²	70.6	44%	0.439	37%	0.371	S	S	.	.			trans	-71.6	134.6	174.9	-169	177.9	148.4	0	0	110.9	K629	E611-K629 HydrophobicContact CB-CB 3.85Å; E611-K629 WeakPolarHBondContact CB-O 3.36Å; E611-K629 PolarHBondContact N-O 2.98Å; E611-K629 WeakPolarHBondContact OE2-CB 3.28Å; E611-K629 VanDerWaalsContact OE2-CD 3.28Å; E611-K629 WeakPolarHBondContact OE2-CD 3.25Å
612	I	95.3	Very high	88.9	Confident	91 Å²	91	70.6 Å²	70.6	47%	0.467	36%	0.36	S	S	.	.			trans	-115.1	111.4	-179.8	-57.4	176.7	0	0	0	108.9	N567 K614	N567-I612 HydrophobicContact CB-CG2 3.89Å; I612-K614 PolarHBondContact O-N 3.24Å
613	I	96.9	Very high	90.8	Very high	38 Å²	38	71.4 Å²	71.4	20%	0.195	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	107.7	169.1	-60.7	-177.8	0	0	0	107.6	N567 L568 E615 F616 A626 L628	N567-I613 CarbonylContact C-O 3.53Å; N567-I613 WeakPolarHBondContact CA-O 3.45Å; N567-I613 PolarHBondContact N-O 3.47Å; L568-I613 HydrophobicContact CB-CB 4.3Å; L568-I613 PolarHBondContact N-O 3.3Å; L568-I613 PolarHBondContact O-N 3.47Å; I613-E615 VanDerWaalsContact C-N 3.33Å; I613-E615 PolarHBondContact O-N 2.99Å; I613-F616 HydrophobicContact CG2-CB 4.14Å; I613-A626 HydrophobicContact CD1-CB 4.17Å; I613-L628 HydrophobicContact CD1-CD2 3.53Å; I613-L628 HydrophobicContact CG1-CD2 3.89Å
614	K	95.4	Very high	92.4	Very high	166 Å²	166	67.3 Å²	67.3	72%	0.722	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.2	-43.2	-175.4	-68.7	-174.8	178.4	-177.2	0	113.2	S566 N567 I612	S566-K614 CarbonylContact C-O 3.57Å; S566-K614 WeakPolarHBondContact CA-O 3.47Å; S566-K614 VanDerWaalsContact CB-O 3.3Å; S566-K614 WeakPolarHBondContact CB-O 3.45Å; N567-K614 PolarHBondContact N-O 3.29Å; I612-K614 PolarHBondContact O-N 3.24Å
615	E	95.1	Very high	93.5	Very high	110 Å²	110	69.4 Å²	69.4	51%	0.514	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	123.2	179.2	-64.1	-174	172.2	0	0	110.4	L564 I613 Y617	L564-E615 HydrophobicContact CD1-CB 3.94Å; L564-E615 HydrophobicContact CD1-CG 4.24Å; I613-E615 VanDerWaalsContact C-N 3.33Å; I613-E615 PolarHBondContact O-N 2.99Å; E615-Y617 HydrophobicContact CB-CD2 4.36Å; E615-Y617 HydrophobicContact CB-CE2 3.73Å; E615-Y617 WeakPolarHBondContact OE2-CE2 3.41Å; E615-Y617 VanDerWaalsContact OE2-CZ 3.3Å; E615-Y617 PolarHBondContact OE2-OH 3.12Å
616	F	95.9	Very high	94.3	Very high	16 Å²	16	63.5 Å²	63.5	7%	0.07	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	103.9	173.5	-171.7	-98.6	0	0	0	109.3	F555 L565 L568 I613 L618 K624 A626	F555-F616 HydrophobicContact CB-CE1 4.45Å; F555-F616 AromaticContact CD2-CE1 3.9Å; F555-F616 HydrophobicContact CD2-CE1 3.9Å; F555-F616 HydrophobicContact CD2-CZ 4.1Å; F555-F616 HydrophobicContact CG-CE1 4.36Å; L565-F616 HydrophobicContact CB-CB 4.37Å; L565-F616 HydrophobicContact CD1-CD1 4.06Å; L565-F616 PolarHBondContact N-O 2.83Å; L565-F616 PolarHBondContact O-N 3.39Å; L568-F616 HydrophobicContact CD2-CB 3.87Å; L568-F616 HydrophobicContact CD2-CD1 4.12Å; L568-F616 HydrophobicContact CD2-CD2 4.32Å; L568-F616 HydrophobicContact CD2-CG 3.86Å; I613-F616 HydrophobicContact CG2-CB 4.14Å; F616-L618 HydrophobicContact CD1-CD1 3.78Å; F616-L618 HydrophobicContact CD1-CG 4.14Å; F616-L618 HydrophobicContact CE1-CD1 3.73Å; F616-L618 HydrophobicContact CE1-CD2 4.21Å; F616-L618 HydrophobicContact CE1-CG 3.78Å; F616-K624 HydrophobicContact CE1-CD 4.19Å; F616-K624 HydrophobicContact CE1-CG 4.5Å; F616-K624 HydrophobicContact CE2-CD 4.12Å; F616-K624 HydrophobicContact CE2-CG 4.32Å; F616-K624 HydrophobicContact CZ-CB 4.12Å; F616-K624 HydrophobicContact CZ-CD 3.7Å; F616-K624 HydrophobicContact CZ-CG 3.74Å; F616-A626 HydrophobicContact CD2-CB 4.14Å; F616-A626 HydrophobicContact CE2-CB 3.59Å; F616-A626 HydrophobicContact CZ-CB 3.92Å
617	Y	94.7	Very high	94.9	Very high	104 Å²	104	61.2 Å²	61.2	41%	0.408	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	127.1	178.9	-66	-91.7	0	0	0	111	L564 E615 K624	L564-Y617 HydrophobicContact CB-CD1 4.47Å; L564-Y617 HydrophobicContact CB-CE1 4.42Å; L564-Y617 HydrophobicContact CD1-CD1 4.04Å; L564-Y617 HydrophobicContact CD1-CD2 4.3Å; L564-Y617 HydrophobicContact CD1-CE1 3.79Å; L564-Y617 HydrophobicContact CD1-CE2 4.06Å; L564-Y617 HydrophobicContact CD1-CG 4.28Å; L564-Y617 HydrophobicContact CD2-CE1 4.15Å; L564-Y617 HydrophobicContact CG-CE1 4.33Å; E615-Y617 HydrophobicContact CB-CD2 4.36Å; E615-Y617 HydrophobicContact CB-CE2 3.73Å; E615-Y617 WeakPolarHBondContact OE2-CE2 3.41Å; E615-Y617 VanDerWaalsContact OE2-CZ 3.3Å; E615-Y617 PolarHBondContact OE2-OH 3.12Å; Y617-K624 WeakPolarHBondContact O-CD 3.48Å; Y617-K624 PolarHBondContact O-NZ 3.21Å
618	L	94.6	Very high	95.2	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.3	164	-70.5	125.9	0	0	0	109.3	P462 F555 N557 S562 L563 L565 F616 E622 K624	P462-L618 HydrophobicContact CB-CD1 4.28Å; P462-L618 HydrophobicContact CG-CD1 4.3Å; F555-L618 HydrophobicContact CB-CD1 4.47Å; F555-L618 HydrophobicContact CB-CD2 3.95Å; N557-L618 HydrophobicContact CB-CB 4.11Å; N557-L618 HydrophobicContact CB-CD2 4.42Å; S562-L618 CarbonylContact C-O 3.51Å; S562-L618 WeakPolarHBondContact CA-O 3.38Å; S562-L618 WeakPolarHBondContact CB-O 3.35Å; L563-L618 HydrophobicContact CB-CB 4.42Å; L563-L618 PolarHBondContact N-O 3.35Å; L563-L618 PolarHBondContact O-N 3.49Å; L565-L618 HydrophobicContact CD1-CD1 3.82Å; L565-L618 HydrophobicContact CG-CD1 4.09Å; F616-L618 HydrophobicContact CD1-CD1 3.78Å; F616-L618 HydrophobicContact CD1-CG 4.14Å; F616-L618 HydrophobicContact CE1-CD1 3.73Å; F616-L618 HydrophobicContact CE1-CD2 4.21Å; F616-L618 HydrophobicContact CE1-CG 3.78Å; L618-E622 WeakPolarHBondContact CA-OE2 3.5Å; L618-K624 HydrophobicContact CD2-CB 3.97Å
619	G	93.8	Very high	95.4	Very high	21 Å²	21	63.2 Å²	63.2	22%	0.216	32%	0.315	C	S	.	.			trans	-69.4	174.7	172.4	0	0	0	0	0	113.4	N557 E621 E622	N557-G619 PolarHBondContact ND2-O 3.03Å; G619-E621 PolarHBondContact O-N 3.16Å; G619-E622 PolarHBondContact N-OE2 2.84Å; G619-E622 WeakPolarHBondContact O-CB 3.45Å; G619-E622 PolarHBondContact O-N 3.42Å
620	S	92.7	Very high	95.5	Very high	63 Å²	63	60.5 Å²	60.5	44%	0.441	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	122.1	171.5	172.9	0	0	0	0	111.3	K560 E622	K560-S620 VanDerWaalsContact CA-OG 3.31Å; K560-S620 WeakPolarHBondContact CA-OG 3.41Å; S620-E622 PolarHBondContact O-N 3.21Å
621	E	92.6	Very high	95.5	Very high	106 Å²	106	61.4 Å²	61.4	50%	0.495	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	15.4	177.8	-60.2	179.8	103.3	0	0	115.2	N557 L559 K560 G619	N557-E621 CarbonylContact O-C 3.58Å; N557-E621 VanDerWaalsContact O-CA 3.27Å; N557-E621 WeakPolarHBondContact O-CA 3.37Å; L559-E621 PolarHBondContact O-N 3.12Å; K560-E621 HydrophobicContact CG-CG 4.5Å; G619-E621 PolarHBondContact O-N 3.16Å
622	E	95.4	Very high	95.5	Very high	67 Å²	67	56.9 Å²	56.9	31%	0.313	28%	0.28	S	S	.	.			trans	-71.5	140.7	-177.5	-168	-175.8	-176.6	0	0	111.9	R556 N557 L618 G619 S620 K624	R556-E622 WeakPolarHBondContact CA-O 3.25Å; N557-E622 PolarHBondContact N-O 2.92Å; L618-E622 WeakPolarHBondContact CA-OE2 3.5Å; G619-E622 PolarHBondContact N-OE2 2.84Å; G619-E622 WeakPolarHBondContact O-CB 3.45Å; G619-E622 PolarHBondContact O-N 3.42Å; S620-E622 PolarHBondContact O-N 3.21Å; E622-K624 HydrophobicContact CG-CB 4.29Å; E622-K624 WeakPolarHBondContact OE1-CD 3.49Å; E622-K624 IonicContact OE1-NZ 3.96Å
623	T	97.3	Very high	95.5	Very high	74 Å²	74	54.9 Å²	54.9	45%	0.454	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.9	162.7	-57.7	0	0	0	0	108.9	T554 F555 R556	T554-T623 HydrophobicContact CG2-CG2 3.69Å; F555-T623 CarbonylContact O-C 3.6Å; F555-T623 VanDerWaalsContact O-CA 3.31Å; F555-T623 WeakPolarHBondContact O-CA 3.19Å; R556-T623 HydrophobicContact CB-CG2 4.45Å
624	K	96.6	Very high	95.3	Very high	70 Å²	70	59 Å²	59	30%	0.304	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	143.3	-169	-167.1	179.2	-167.6	153.9	0	111.2	F555 F616 Y617 L618 E622	F555-K624 PolarHBondContact N-O 3.02Å; F555-K624 PolarHBondContact O-N 3.33Å; F616-K624 HydrophobicContact CE1-CD 4.19Å; F616-K624 HydrophobicContact CE1-CG 4.5Å; F616-K624 HydrophobicContact CE2-CD 4.12Å; F616-K624 HydrophobicContact CE2-CG 4.32Å; F616-K624 HydrophobicContact CZ-CB 4.12Å; F616-K624 HydrophobicContact CZ-CD 3.7Å; F616-K624 HydrophobicContact CZ-CG 3.74Å; Y617-K624 WeakPolarHBondContact O-CD 3.48Å; Y617-K624 PolarHBondContact O-NZ 3.21Å; L618-K624 HydrophobicContact CD2-CB 3.97Å; E622-K624 HydrophobicContact CG-CB 4.29Å; E622-K624 WeakPolarHBondContact OE1-CD 3.49Å; E622-K624 IonicContact OE1-NZ 3.96Å
625	T	96.6	Very high	95.2	Very high	65 Å²	65	54.4 Å²	54.4	40%	0.399	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.6	-176	-56.6	0	0	0	0	110.5	E552 V553 T554	E552-T625 HydrophobicContact CG-CG2 3.24Å; V553-T625 WeakPolarHBondContact O-CA 3.36Å; T554-T625 PolarHBondContact OG1-OG1 3.22Å
626	A	96.8	Very high	95.1	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.033	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	144.8	170.1	0	0	0	0	0	110.1	E552 V553 F555 L568 I613 F616 L628	E552-A626 CarbonylContact C-O 3.55Å; E552-A626 WeakPolarHBondContact CA-O 3.31Å; V553-A626 PolarHBondContact N-O 3.14Å; V553-A626 PolarHBondContact O-N 3.17Å; F555-A626 HydrophobicContact CD2-CB 4.32Å; F555-A626 HydrophobicContact CE2-CB 3.78Å; L568-A626 HydrophobicContact CD2-CB 4.3Å; I613-A626 HydrophobicContact CD1-CB 4.17Å; F616-A626 HydrophobicContact CD2-CB 4.14Å; F616-A626 HydrophobicContact CE2-CB 3.59Å; F616-A626 HydrophobicContact CZ-CB 3.92Å; A626-L628 HydrophobicContact CB-CG 4.48Å
627	R	96	Very high	95	Very high	99 Å²	99	52 Å²	52	37%	0.374	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	117.2	167.6	-69.8	177.3	177.7	163.1	4.1	107.3	L492 D493 I550 E552	L492-R627 HydrophobicContact CD1-CG 4.46Å; D493-R627 IonicContact OD1-CZ 3.54Å; D493-R627 IonicContact OD1-NH1 3.6Å; D493-R627 PolarHBondContact OD1-NH1 2.97Å; D493-R627 IonicContact OD1-NH2 2.74Å; D493-R627 PolarHBondContact OD1-NH2 3.19Å; D493-R627 IonicContact OD2-NH1 2.87Å; I550-R627 HydrophobicContact CG2-CB 3.94Å; I550-R627 HydrophobicContact CG2-CG 4.39Å; E552-R627 HydrophobicContact CB-CG 4.41Å; E552-R627 HydrophobicContact CG-CG 4.21Å; E552-R627 IonicContact OE2-CZ 2.73Å; E552-R627 VanDerWaalsContact OE2-CZ 3.27Å; E552-R627 IonicContact OE2-NE 3.21Å; E552-R627 PolarHBondContact OE2-NE 3.4Å; E552-R627 IonicContact OE2-NH2 2.62Å; E552-R627 PolarHBondContact OE2-NH2 2.97Å
628	L	96.9	Very high	95.1	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	135.2	-178.3	-59.6	170.3	0	0	0	108.9	I550 V551 V553 L568 L570 I613 A626 V643	I550-L628 CarbonylContact C-O 3.57Å; I550-L628 WeakPolarHBondContact CA-O 3.45Å; V551-L628 PolarHBondContact N-O 3.48Å; V551-L628 PolarHBondContact O-N 2.83Å; V553-L628 HydrophobicContact CG2-CD1 4.39Å; L568-L628 HydrophobicContact CD2-CD2 4.33Å; L568-L628 HydrophobicContact CG-CD1 4.48Å; L568-L628 HydrophobicContact CG-CD2 4.08Å; L570-L628 HydrophobicContact CD1-CB 3.64Å; L570-L628 HydrophobicContact CD2-CB 4.14Å; L570-L628 HydrophobicContact CD2-CD1 3.85Å; L570-L628 HydrophobicContact CG-CB 3.57Å; L570-L628 HydrophobicContact CG-CD1 3.88Å; L570-L628 HydrophobicContact CG-CG 4.36Å; I613-L628 HydrophobicContact CD1-CD2 3.53Å; I613-L628 HydrophobicContact CG1-CD2 3.89Å; A626-L628 HydrophobicContact CB-CG 4.48Å; L628-V643 HydrophobicContact CD1-CG1 3.72Å
629	K	96.2	Very high	95.1	Very high	52 Å²	52	49.5 Å²	49.5	23%	0.226	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136.4	-168.2	-169.2	174.9	-176.7	170.2	0	111.5	E476 P548 I549 I550 E611	E476-K629 WeakPolarHBondContact OE1-CE 3.47Å; E476-K629 IonicContact OE1-NZ 2.61Å; E476-K629 PolarHBondContact OE1-NZ 3.04Å; E476-K629 IonicContact OE2-NZ 3.99Å; P548-K629 HydrophobicContact CB-CD 4.24Å; P548-K629 VanDerWaalsContact CB-CE 3.42Å; P548-K629 HydrophobicContact CB-CG 3.93Å; I549-K629 WeakPolarHBondContact O-CA 3.47Å; I550-K629 HydrophobicContact CG1-CG 4.24Å; E611-K629 HydrophobicContact CB-CB 3.85Å; E611-K629 WeakPolarHBondContact CB-O 3.36Å; E611-K629 PolarHBondContact N-O 2.98Å; E611-K629 WeakPolarHBondContact OE2-CB 3.28Å; E611-K629 VanDerWaalsContact OE2-CD 3.28Å; E611-K629 WeakPolarHBondContact OE2-CD 3.25Å
630	L	96.6	Very high	95.3	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	143.9	167.8	-59.6	-178.7	0	0	0	109	P548 I549 L570 W572 V608 T610 L638 I640	P548-L630 CarbonylContact C-O 3.49Å; P548-L630 WeakPolarHBondContact CA-O 3.3Å; I549-L630 HydrophobicContact CB-CB 4.39Å; I549-L630 PolarHBondContact N-O 2.95Å; I549-L630 PolarHBondContact O-N 3.09Å; L570-L630 HydrophobicContact CB-CD2 4.13Å; L570-L630 HydrophobicContact CB-CG 4.5Å; L570-L630 HydrophobicContact CD1-CD1 4.1Å; L570-L630 HydrophobicContact CD1-CD2 4.11Å; L570-L630 HydrophobicContact CD1-CG 3.74Å; W572-L630 HydrophobicContact CB-CD1 4.41Å; W572-L630 HydrophobicContact CG-CD1 4.37Å; V608-L630 HydrophobicContact CG1-CB 3.83Å; V608-L630 HydrophobicContact CG1-CD1 4.47Å; V608-L630 HydrophobicContact CG1-CD2 4.12Å; V608-L630 HydrophobicContact CG1-CG 4.36Å; T610-L630 HydrophobicContact CG2-CD2 3.76Å; L630-L638 HydrophobicContact CD1-CD2 4.04Å; L630-I640 HydrophobicContact CD1-CD1 3.86Å; L630-I640 HydrophobicContact CD1-CG1 3.99Å
631	L	95.8	Very high	95.4	Very high	47 Å²	47	47 Å²	47	25%	0.246	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	106	172.7	-177.2	67.9	0	0	0	108.4	E546 V608 T609 H633	E546-L631 VanDerWaalsContact C-CD1 3.46Å; V608-L631 CarbonylContact C-O 3.55Å; V608-L631 WeakPolarHBondContact CA-O 3.39Å; T609-L631 PolarHBondContact N-O 3.34Å; T609-L631 PolarHBondContact O-N 3.47Å; L631-H633 PolarHBondContact O-NE2 3.4Å
632	P	95.3	Very high	95.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	131.1	-176.6	33.3	-32	0	0	0	111.6	I545 E546 E547 I549 V608 I705	I545-P632 CarbonylContact C-O 3.56Å; I545-P632 VanDerWaalsContact CA-O 3.31Å; I545-P632 WeakPolarHBondContact CA-O 3.35Å; E546-P632 PolarHBondContact N-O 2.87Å; E547-P632 VanDerWaalsContact O-CD 3.25Å; E547-P632 WeakPolarHBondContact O-CD 3.31Å; I549-P632 HydrophobicContact CD1-CG 4.25Å; V608-P632 HydrophobicContact CG2-CB 4.26Å; P632-I705 HydrophobicContact CB-CD1 4.07Å; P632-I705 HydrophobicContact CB-CG1 4.1Å; P632-I705 HydrophobicContact CB-CG2 3.95Å; P632-I705 HydrophobicContact CG-CD1 4.05Å; P632-I705 HydrophobicContact CG-CG2 4.04Å
633	H	94.3	Very high	95.6	Very high	48 Å²	48	38.7 Å²	38.7	22%	0.222	19%	0.192	C	C	.	.			trans	-102.8	-16.3	-178.6	-59.8	-61.6	0	0	0	113	E546 E605 E606 I607 T609 L631	E546-H633 VanDerWaalsContact CD-ND1 3.34Å; E546-H633 IonicContact OE1-CE1 3.21Å; E546-H633 IonicContact OE1-CG 2.72Å; E546-H633 IonicContact OE1-ND1 2.76Å; E546-H633 PolarHBondContact OE1-ND1 2.8Å; E546-H633 IonicContact OE2-CE1 2.76Å; E546-H633 PolarHBondContact OE2-CE1 3.3Å; E546-H633 IonicContact OE2-ND1 3.81Å; E546-H633 PolarHBondContact OE2-ND1 3.32Å; E605-H633 PolarHBondContact O-CD2 3.07Å; E605-H633 VanDerWaalsContact O-CD2 3.23Å; E606-H633 WeakPolarHBondContact O-CB 3.45Å; I607-H633 PolarHBondContact O-N 3.47Å; T609-H633 WeakPolarHBondContact CB-NE2 3.48Å; T609-H633 PolarHBondContact OG1-NE2 3.12Å; L631-H633 PolarHBondContact O-NE2 3.4Å
634	R	92.6	Very high	95.5	Very high	125 Å²	125	35.3 Å²	35.3	47%	0.472	17%	0.172	S	C	.	.	S	Bend	trans	-125	146.6	-179.3	-61.8	-171.7	70.3	-163.5	-2.2	112.7	F574 I607 I705	F574-R634 HydrophobicContact CE1-CB 4.34Å; F574-R634 HydrophobicContact CZ-CB 4.04Å; F574-R634 WeakPolarHBondContact CZ-O 3.45Å; I607-R634 HydrophobicContact CG2-CB 4.47Å; R634-I705 WeakPolarHBondContact O-CG2 3.39Å
635	T	93.8	Very high	95.4	Very high	70 Å²	70	32 Å²	32	43%	0.429	16%	0.157	S	C	.	.			trans	-75.1	138.8	173.2	57.2	0	0	0	0	111.4	I545 I705 P707	I545-T635 HydrophobicContact CG2-CG2 4.02Å; T635-I705 WeakPolarHBondContact CA-O 3.44Å; T635-P707 HydrophobicContact CG2-CG 4.15Å
636	G	93.4	Very high	95.3	Very high	11 Å²	11	30.1 Å²	30.1	11%	0.113	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.3	-163.3	-175.4	0	0	0	0	0	111.6	S575 I705	S575-G636 WeakPolarHBondContact O-CA 3.46Å; G636-I705 PolarHBondContact N-O 2.61Å; G636-I705 PolarHBondContact O-N 3.32Å
637	Q	94.2	Very high	95.1	Very high	63 Å²	63	30 Å²	30	29%	0.294	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.3	169.3	-176.3	174.8	-8.1	0	0	109.6	H540 F574 S575	H540-Q637 PolarHBondContact CE1-NE2 3.11Å; F574-Q637 WeakPolarHBondContact CA-O 3.22Å; S575-Q637 PolarHBondContact N-O 3.36Å; S575-Q637 PolarHBondContact O-N 3.35Å
638	L	95.6	Very high	94.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	136.8	175.7	179.1	67.1	0	0	0	108.8	I549 W572 F574 V608 L630 I640 E702 P703 I705	I549-L638 HydrophobicContact CD1-CD2 3.81Å; W572-L638 HydrophobicContact CB-CD1 3.83Å; W572-L638 HydrophobicContact CD2-CD1 4.09Å; W572-L638 HydrophobicContact CE3-CD1 3.96Å; W572-L638 HydrophobicContact CG-CD1 4.05Å; F574-L638 HydrophobicContact CB-CD1 4.43Å; F574-L638 HydrophobicContact CD2-CB 4.14Å; F574-L638 HydrophobicContact CD2-CD1 4.17Å; V608-L638 HydrophobicContact CG2-CD1 4.18Å; L630-L638 HydrophobicContact CD1-CD2 4.04Å; L638-I640 HydrophobicContact CG-CG1 4.46Å; L638-E702 CarbonylContact O-C 3.58Å; L638-E702 VanDerWaalsContact O-C 3.28Å; L638-E702 WeakPolarHBondContact O-CA 3.32Å; L638-P703 HydrophobicContact CB-CG 4.17Å; L638-P703 HydrophobicContact CD2-CG 4.2Å; L638-P703 HydrophobicContact CG-CG 4.4Å; L638-P703 PolarHBondContact N-O 3.44Å; L638-P703 VanDerWaalsContact O-CD 3.26Å; L638-P703 WeakPolarHBondContact O-CD 3.49Å; L638-I705 HydrophobicContact CB-CD1 4Å; L638-I705 HydrophobicContact CB-CG1 4.13Å; L638-I705 HydrophobicContact CD2-CD1 4.13Å
639	N	95.3	Very high	93.8	Very high	53 Å²	53	26.6 Å²	26.6	28%	0.283	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	115.1	176.3	-175.3	-16.2	0	0	0	109	W572 R573 V641	W572-N639 CarbonylContact C-O 3.54Å; W572-N639 VanDerWaalsContact CA-O 3.22Å; W572-N639 WeakPolarHBondContact CA-O 3.49Å; R573-N639 PolarHBondContact N-O 3.43Å; R573-N639 PolarHBondContact O-N 2.71Å; N639-V641 PolarHBondContact O-N 2.86Å
640	I	96.6	Very high	92.1	Very high	2 Å²	2	26 Å²	26	1%	0.01	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	102.9	-180	-54.6	177.7	0	0	0	107.8	I549 V551 L570 L571 L630 L638 L676 L701	I549-I640 HydrophobicContact CG2-CD1 4.22Å; V551-I640 HydrophobicContact CG2-CD1 3.66Å; V551-I640 HydrophobicContact CG2-CG2 4.45Å; L570-I640 HydrophobicContact CB-CG2 4.45Å; L570-I640 HydrophobicContact CD2-CG2 3.85Å; L571-I640 CarbonylContact O-C 3.48Å; L630-I640 HydrophobicContact CD1-CD1 3.86Å; L630-I640 HydrophobicContact CD1-CG1 3.99Å; L638-I640 HydrophobicContact CG-CG1 4.46Å; I640-L676 HydrophobicContact CG2-CD1 4.39Å; I640-L701 HydrophobicContact CB-CB 4.13Å; I640-L701 HydrophobicContact CB-CD2 4.02Å; I640-L701 HydrophobicContact CD1-CD2 4.5Å; I640-L701 HydrophobicContact CG2-CD2 4.11Å; I640-L701 PolarHBondContact N-O 2.86Å; I640-L701 WeakPolarHBondContact O-CD1 3.24Å
641	V	94.7	Very high	90	Very high	29 Å²	29	32.7 Å²	32.7	18%	0.176	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-29.5	-167.8	-172.7	0	0	0	0	112.2	L571 R573 N639 D675 L676	L571-V641 HydrophobicContact CD2-CB 4.05Å; L571-V641 HydrophobicContact CD2-CG1 4.16Å; L571-V641 HydrophobicContact CG-CB 4.08Å; L571-V641 PolarHBondContact O-N 2.92Å; R573-V641 HydrophobicContact CB-CG2 4.43Å; R573-V641 HydrophobicContact CG-CG2 3.84Å; N639-V641 PolarHBondContact O-N 2.86Å; V641-D675 CarbonylContact O-C 3.58Å; V641-D675 WeakPolarHBondContact O-CA 3.35Å; V641-L676 PolarHBondContact O-N 2.69Å
642	G	95.7	Very high	87.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.1	-155.6	-166.7	0	0	0	0	0	114.4	L571 Q674	L571-G642 PolarHBondContact N-O 2.82Å; L571-G642 PolarHBondContact O-N 3.13Å; G642-Q674 CarbonylContact C-O 3.54Å; G642-Q674 WeakPolarHBondContact CA-O 3.32Å
643	V	96.7	Very high	84.8	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	149.7	169.9	-66.2	0	0	0	0	110.5	I464 F555 L568 S569 L570 L628 Y645 R673 Q674	I464-V643 HydrophobicContact CD1-CG2 3.57Å; F555-V643 HydrophobicContact CE1-CG2 4.18Å; F555-V643 HydrophobicContact CZ-CG1 4.35Å; F555-V643 HydrophobicContact CZ-CG2 4.46Å; L568-V643 HydrophobicContact CD1-CB 4.15Å; S569-V643 CarbonylContact O-C 3.55Å; S569-V643 WeakPolarHBondContact O-CA 3.22Å; S569-V643 WeakPolarHBondContact O-CB 3.25Å; L570-V643 HydrophobicContact CD2-CG1 4.14Å; L628-V643 HydrophobicContact CD1-CG1 3.72Å; V643-Y645 HydrophobicContact CG2-CD1 4.05Å; V643-Y645 HydrophobicContact CG2-CE1 3.91Å; V643-R673 CarbonylContact O-C 3.54Å; V643-R673 VanDerWaalsContact O-CA 3.23Å; V643-R673 WeakPolarHBondContact O-CA 3.35Å; V643-R673 WeakPolarHBondContact O-CB 3.38Å; V643-Q674 HydrophobicContact CG2-CB 4.25Å; V643-Q674 PolarHBondContact N-O 3.38Å; V643-Q674 PolarHBondContact O-N 3.14Å
644	I	95.4	Very high	82	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.015	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	141.7	169.1	-67.5	156.9	0	0	0	108	L456 L568 S569 L571 R671 G672 R673	L456-I644 HydrophobicContact CD1-CB 4.49Å; L456-I644 HydrophobicContact CD1-CD1 3.92Å; L456-I644 HydrophobicContact CD1-CG1 3.74Å; L456-I644 HydrophobicContact CD1-CG2 3.9Å; L568-I644 WeakPolarHBondContact CA-O 3.48Å; S569-I644 PolarHBondContact N-O 3.13Å; S569-I644 PolarHBondContact O-N 2.71Å; L571-I644 HydrophobicContact CB-CD1 4.14Å; L571-I644 HydrophobicContact CB-CG1 4.12Å; L571-I644 HydrophobicContact CD1-CD1 3.82Å; L571-I644 HydrophobicContact CD1-CG1 4.41Å; I644-R671 HydrophobicContact CG2-CG 4.14Å; I644-G672 WeakPolarHBondContact CA-O 3.38Å; I644-R673 HydrophobicContact CG1-CB 4.2Å
645	Y	95.5	Very high	79.2	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	162.9	170.4	51.4	-92.1	0	0	0	111.3	L459 L461 L565 L568 V643 L647 G672 Q674	L459-Y645 HydrophobicContact CB-CE2 4.43Å; L459-Y645 HydrophobicContact CD1-CD2 4.16Å; L459-Y645 HydrophobicContact CD1-CE2 3.54Å; L461-Y645 PolarHBondContact O-OH 2.92Å; L565-Y645 HydrophobicContact CB-CD2 4.37Å; L565-Y645 HydrophobicContact CB-CG 4.36Å; L565-Y645 HydrophobicContact CD1-CG 4.4Å; L565-Y645 HydrophobicContact CD2-CD2 3.9Å; L565-Y645 HydrophobicContact CD2-CE2 4.09Å; L565-Y645 HydrophobicContact CG-CD2 4.47Å; L568-Y645 HydrophobicContact CD1-CD1 3.84Å; L568-Y645 HydrophobicContact CD1-CG 4.29Å; V643-Y645 HydrophobicContact CG2-CD1 4.05Å; V643-Y645 HydrophobicContact CG2-CE1 3.91Å; Y645-L647 HydrophobicContact CD2-CB 4.27Å; Y645-L647 HydrophobicContact CE2-CB 4.17Å; Y645-G672 PolarHBondContact N-O 3.45Å; Y645-G672 PolarHBondContact O-N 3.19Å; Y645-Q674 HydrophobicContact CE1-CG 4.4Å; Y645-Q674 WeakPolarHBondContact OH-CG 3.42Å; Y645-Q674 PolarHBondContact OH-NE2 2.93Å; Y645-Q674 PolarHBondContact OH-OE1 3.13Å
646	N	93.7	Very high	76.3	Confident	26 Å²	26	47.8 Å²	47.8	14%	0.139	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.2	167.9	-71.2	-12.7	0	0	0	109.3	L565 S566 N567 I669 I670 R671	L565-N646 WeakPolarHBondContact CA-O 3.49Å; S566-N646 PolarHBondContact N-O 3.43Å; S566-N646 WeakPolarHBondContact O-CB 3.28Å; S566-N646 PolarHBondContact O-N 2.91Å; S566-N646 VanDerWaalsContact OG-CB 3.31Å; S566-N646 WeakPolarHBondContact OG-CB 3.4Å; N567-N646 PolarHBondContact ND2-ND2 2.88Å; N646-I669 HydrophobicContact CB-CG2 3.64Å; N646-I670 WeakPolarHBondContact CA-O 3.43Å; N646-R671 WeakPolarHBondContact OD1-CA 3.42Å; N646-R671 WeakPolarHBondContact OD1-CB 3.45Å; N646-R671 VanDerWaalsContact OD1-CG 3.26Å; N646-R671 WeakPolarHBondContact OD1-CG 3.28Å
647	L	93.4	Very high	73.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.6	173.8	-175.8	60.5	0	0	0	110	L438 L442 L459 L461 L563 L565 Y645 I670	L438-L647 HydrophobicContact CD1-CD2 4.18Å; L442-L647 HydrophobicContact CD2-CD2 4.16Å; L442-L647 HydrophobicContact CD2-CG 4.43Å; L459-L647 HydrophobicContact CD1-CB 3.87Å; L459-L647 HydrophobicContact CD1-CD2 4.34Å; L461-L647 HydrophobicContact CB-CD2 4.38Å; L563-L647 HydrophobicContact CD2-CD1 4.34Å; L565-L647 HydrophobicContact CD2-CD1 3.71Å; Y645-L647 HydrophobicContact CD2-CB 4.27Å; Y645-L647 HydrophobicContact CE2-CB 4.17Å; L647-I670 PolarHBondContact N-O 3.47Å; L647-I670 PolarHBondContact O-N 3.42Å
648	T	87.1	Confident	70.9	Confident	11 Å²	11	55.6 Å²	55.6	7%	0.067	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	143.1	-177.9	63.1	0	0	0	0	112	L564 I669	L564-T648 PolarHBondContact O-OG1 3.19Å; T648-I669 HydrophobicContact CG2-CB 4.35Å; T648-I669 HydrophobicContact CG2-CD1 4.22Å; T648-I669 HydrophobicContact CG2-CG1 3.96Å; T648-I669 HydrophobicContact CG2-CG2 4.08Å
649	S	77.6	Confident	68	Low	18 Å²	18	62.3 Å²	62.3	13%	0.126	38%	0.377	C	S	.	.			trans	-95	80.6	164.2	-173.9	0	0	0	0	109.2	M668	S649-M668 PolarHBondContact N-O 2.82Å
650	S	60.6	Low	65.2	Low	41 Å²	41	68.1 Å²	68.1	29%	0.287	41%	0.408	S	S	.	.			trans	-94.3	134.4	177.9	48.5	0	0	0	0	111.8	L652	S650-L652 PolarHBondContact O-N 3.29Å
651	H	53.5	Low	62.1	Low	140 Å²	140	71.4 Å²	71.4	65%	0.648	44%	0.442	S	S	*	.			trans	-88	88.2	169.4	-75.7	-85.8	0	0	0	109.6	R439 G653	R439-H651 PolarHBondContact NE-NE2 3.46Å; R439-H651 PolarHBondContact NH2-CE1 3.49Å; R439-H651 PolarHBondContact NH2-NE2 3.32Å; H651-G653 PolarHBondContact O-N 3.44Å
652	L	43.4	Very low	59.7	Low	143 Å²	143	79.4 Å²	79.4	75%	0.749	48%	0.478	S	S	*	.			trans	-87.6	61.3	163	-82.6	162.8	0	0	0	109.9	S650	S650-L652 PolarHBondContact O-N 3.29Å
653	G	37.8	Very low	56.8	Low	56 Å²	56	87.8 Å²	87.8	58%	0.577	52%	0.517	S	S	*	.	S	Bend	trans	-135.7	110.7	175.7	0	0	0	0	0	109.8	H651	H651-G653 PolarHBondContact O-N 3.44Å
654	E	35.7	Very low	53.7	Low	190 Å²	190	96 Å²	96	89%	0.888	56%	0.558	S	S	*	*			trans	60.6	72	173.1	-61.8	-179.9	-175.9	0	0	115.9	S656	E654-S656 PolarHBondContact O-N 3.08Å
655	A	33.2	Very low	51.2	Low	110 Å²	110	103.1 Å²	103.1	91%	0.909	60%	0.595	S	S	*	*			trans	-68.1	80	152.3	0	0	0	0	0	109.7	S657	A655-S657 PolarHBondContact O-N 3.17Å
656	S	33.7	Very low	48.9	Very low	107 Å²	107	109.5 Å²	109.5	75%	0.748	63%	0.629	S	S	*	*			trans	-63.8	116.6	161.5	58.2	0	0	0	0	108.2	E654	E654-S656 PolarHBondContact O-N 3.08Å
657	S	38.1	Very low	47.3	Very low	96 Å²	96	110.7 Å²	110.7	67%	0.671	64%	0.639	S	S	*	*	S	Bend	trans	-52	141.7	171.3	52.5	0	0	0	0	111.2	A655	A655-S657 PolarHBondContact O-N 3.17Å
658	N	35.4	Very low	46.6	Very low	142 Å²	142	112 Å²	112	76%	0.759	65%	0.646	S	S	*	*			trans	92.8	87.4	171.6	-44.2	-26.4	0	0	0	116.1
659	T	34.5	Very low	46.6	Very low	142 Å²	142	115.3 Å²	115.3	87%	0.871	66%	0.662	S	S	*	*				-170.6	137.5	102	13.9	0	0	0	0	111.2
660	D	38	Very low	47.2	Very low	175 Å²	175	114.7 Å²	114.7	94%	0.936	66%	0.657	S	S	*	*			trans	-68.9	126.9	166.8	-74.9	-53	0	0	0	109.8
661	G	31	Very low	48.7	Very low	70 Å²	70	116.7 Å²	116.7	72%	0.722	66%	0.659	S	S	*	*			trans	170.5	112	178.2	0	0	0	0	0	112.1	Q663	G661-Q663 PolarHBondContact O-N 3.1Å
662	Q	43.2	Very low	50.6	Low	198 Å²	198	110 Å²	110	93%	0.925	63%	0.628	S	S	*	*			trans	-67.1	102	-174.4	-67.9	142.3	-63.2	0	0	112.9
663	Q	34.5	Very low	53	Low	176 Å²	176	105.1 Å²	105.1	82%	0.822	60%	0.599	S	S	*	*			trans	-138.5	86.1	142.2	-71.1	-163.9	0.8	0	0	109.2	G661 L665	G661-Q663 PolarHBondContact O-N 3.1Å; Q663-L665 VanDerWaalsContact C-N 3.32Å; Q663-L665 PolarHBondContact O-N 3.29Å
664	M	33.7	Very low	55.7	Low	173 Å²	173	103.4 Å²	103.4	85%	0.852	58%	0.576	S	S	*	*			trans	-65.9	96.3	165	-179.3	174.8	173.5	0	0	107.2	D666	M664-D666 PolarHBondContact O-N 3.47Å; M664-D666 VanDerWaalsContact O-N 3.16Å
665	L	41.9	Very low	58.5	Low	151 Å²	151	96 Å²	96	79%	0.791	54%	0.543	S	S	*	.			trans	-54.3	121.4	173.8	-114.2	122.8	0	0	0	108	Q663 S667	Q663-L665 VanDerWaalsContact C-N 3.32Å; Q663-L665 PolarHBondContact O-N 3.29Å; L665-S667 PolarHBondContact O-N 2.97Å
666	D	47.1	Very low	61.4	Low	135 Å²	135	91.3 Å²	91.3	72%	0.722	50%	0.502	S	S	*	.			trans	-53.6	94.9	-173.3	-172.9	29.4	0	0	0	110.2	M664 M668	M664-D666 PolarHBondContact O-N 3.47Å; M664-D666 VanDerWaalsContact O-N 3.16Å; D666-M668 PolarHBondContact O-N 2.87Å
667	S	60.2	Low	64	Low	51 Å²	51	93 Å²	93	36%	0.357	50%	0.496	S	S	.	.			trans	-72.1	107.4	-170.1	59.3	0	0	0	0	107.3	L665 I669	L665-S667 PolarHBondContact O-N 2.97Å; S667-I669 WeakPolarHBondContact O-CG1 3.38Å; S667-I669 PolarHBondContact O-N 3.5Å
668	M	79.1	Confident	66.4	Low	26 Å²	26	90.1 Å²	90.1	13%	0.128	47%	0.473	C	S	.	.			trans	-66.2	104.8	-173.1	-174.2	159.3	-138.3	0	0	111.1	L442 Y443 K446 S649 D666 I670	L442-M668 VanDerWaalsContact C-SD 3.56Å; L442-M668 HydrophobicContact CB-CG 4Å; L442-M668 HydrophobicContact CB-SD 3.84Å; Y443-M668 VanDerWaalsContact CA-SD 3.5Å; Y443-M668 HydrophobicContact CD2-CE 4.38Å; Y443-M668 PolarHBondContact N-SD 2.91Å; Y443-M668 VanDerWaalsContact N-SD 3.38Å; K446-M668 HydrophobicContact CB-CE 3.95Å; K446-M668 HydrophobicContact CD-CE 3.29Å; K446-M668 HydrophobicContact CG-CE 4.12Å; S649-M668 PolarHBondContact N-O 2.82Å; D666-M668 PolarHBondContact O-N 2.87Å; M668-I670 HydrophobicContact CE-CD1 4.48Å; M668-I670 HydrophobicContact CG-CG1 4.48Å
669	I	86.8	Confident	68.7	Low	81 Å²	81	89.2 Å²	89.2	42%	0.415	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.8	175.7	-44.8	-161.8	0	0	0	108.7	N646 T648 S667	N646-I669 HydrophobicContact CB-CG2 3.64Å; T648-I669 HydrophobicContact CG2-CB 4.35Å; T648-I669 HydrophobicContact CG2-CD1 4.22Å; T648-I669 HydrophobicContact CG2-CG1 3.96Å; T648-I669 HydrophobicContact CG2-CG2 4.08Å; S667-I669 WeakPolarHBondContact O-CG1 3.38Å; S667-I669 PolarHBondContact O-N 3.5Å
670	I	90.6	Very high	71.1	Confident	5 Å²	5	82.9 Å²	82.9	3%	0.026	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	119.5	172	-60	-166.9	0	0	0	109.5	L442 V445 K446 P457 L459 N646 L647 M668	L442-I670 HydrophobicContact CB-CD1 3.72Å; L442-I670 HydrophobicContact CB-CG1 4.37Å; L442-I670 HydrophobicContact CD2-CB 4.15Å; L442-I670 HydrophobicContact CD2-CD1 3.84Å; L442-I670 HydrophobicContact CD2-CG1 4.11Å; L442-I670 HydrophobicContact CG-CD1 4.34Å; L442-I670 WeakPolarHBondContact O-CD1 3.21Å; V445-I670 HydrophobicContact CB-CD1 3.69Å; V445-I670 HydrophobicContact CG1-CD1 3.83Å; V445-I670 HydrophobicContact CG1-CG2 3.8Å; K446-I670 HydrophobicContact CB-CD1 3.93Å; K446-I670 HydrophobicContact CB-CG1 4.43Å; P457-I670 HydrophobicContact CG-CG2 4.17Å; L459-I670 HydrophobicContact CD2-CG2 4.3Å; N646-I670 WeakPolarHBondContact CA-O 3.43Å; L647-I670 PolarHBondContact N-O 3.47Å; L647-I670 PolarHBondContact O-N 3.42Å; M668-I670 HydrophobicContact CE-CD1 4.48Å; M668-I670 HydrophobicContact CG-CG1 4.48Å
671	R	91.4	Very high	73.1	Confident	83 Å²	83	79 Å²	79	31%	0.313	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	132.2	168.5	-166.6	172.2	-179.5	-152.1	-4.8	108.7	L456 P457 T599 I644 N646	L456-R671 HydrophobicContact CD1-CG 4.48Å; L456-R671 HydrophobicContact CD2-CB 4.29Å; L456-R671 HydrophobicContact CD2-CG 3.88Å; P457-R671 VanDerWaalsContact CD-O 3.31Å; P457-R671 WeakPolarHBondContact CD-O 3.31Å; P457-R671 VanDerWaalsContact CG-O 3.3Å; P457-R671 WeakPolarHBondContact CG-O 3.34Å; T599-R671 PolarHBondContact OG1-NH1 2.87Å; I644-R671 HydrophobicContact CG2-CG 4.14Å; N646-R671 WeakPolarHBondContact OD1-CA 3.42Å; N646-R671 WeakPolarHBondContact OD1-CB 3.45Å; N646-R671 VanDerWaalsContact OD1-CG 3.26Å; N646-R671 WeakPolarHBondContact OD1-CG 3.28Å
672	G	92.7	Very high	75.5	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	179.7	177.8	0	0	0	0	0	112	P457 I644 Y645	P457-G672 VanDerWaalsContact O-CA 3.31Å; P457-G672 WeakPolarHBondContact O-CA 3.08Å; I644-G672 WeakPolarHBondContact CA-O 3.38Å; Y645-G672 PolarHBondContact N-O 3.45Å; Y645-G672 PolarHBondContact O-N 3.19Å
673	R	93.7	Very high	77.4	Confident	41 Å²	41	74.9 Å²	74.9	16%	0.155	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	161.3	-178.2	64.8	171.4	167.6	102.6	-3.7	113.5	C455 L456 P457 Q458 L459 L571 E597 V643 I644 D675	C455-R673 PolarHBondContact SG-NH2 3.39Å; C455-R673 VanDerWaalsContact SG-NH2 3.35Å; L456-R673 HydrophobicContact CB-CB 4.33Å; L456-R673 HydrophobicContact CB-CG 4Å; P457-R673 PolarHBondContact O-N 2.93Å; Q458-R673 VanDerWaalsContact CA-O 3.32Å; Q458-R673 WeakPolarHBondContact CA-O 3.34Å; L459-R673 PolarHBondContact N-O 3.48Å; L459-R673 VanDerWaalsContact N-O 3.11Å; L571-R673 HydrophobicContact CD2-CB 4.44Å; E597-R673 IonicContact OE1-CZ 3.72Å; E597-R673 IonicContact OE1-NE 3.54Å; E597-R673 PolarHBondContact OE1-NE 3.47Å; E597-R673 IonicContact OE1-NH2 3.8Å; E597-R673 IonicContact OE2-NE 3.56Å; V643-R673 CarbonylContact O-C 3.54Å; V643-R673 VanDerWaalsContact O-CA 3.23Å; V643-R673 WeakPolarHBondContact O-CA 3.35Å; V643-R673 WeakPolarHBondContact O-CB 3.38Å; I644-R673 HydrophobicContact CG1-CB 4.2Å; R673-D675 IonicContact CZ-OD1 3.69Å; R673-D675 IonicContact NH1-OD1 3.07Å; R673-D675 PolarHBondContact NH1-OD1 3.36Å; R673-D675 IonicContact NH1-OD2 2.72Å
674	Q	94.8	Very high	79.6	Confident	19 Å²	19	70 Å²	70	9%	0.089	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	136.1	165.8	-78.6	-177.8	-29.4	0	0	110.7	L459 P462 I464 G642 V643 Y645	L459-Q674 VanDerWaalsContact O-CG 3.25Å; L459-Q674 WeakPolarHBondContact O-CG 3.44Å; L459-Q674 PolarHBondContact O-NE2 2.85Å; P462-Q674 PolarHBondContact O-NE2 3.33Å; P462-Q674 PolarHBondContact O-OE1 2.91Å; P462-Q674 VanDerWaalsContact O-OE1 3.11Å; I464-Q674 HydrophobicContact CD1-CB 3.66Å; I464-Q674 VanDerWaalsContact CD1-OE1 3.29Å; G642-Q674 CarbonylContact C-O 3.54Å; G642-Q674 WeakPolarHBondContact CA-O 3.32Å; V643-Q674 HydrophobicContact CG2-CB 4.25Å; V643-Q674 PolarHBondContact N-O 3.38Å; V643-Q674 PolarHBondContact O-N 3.14Å; Y645-Q674 HydrophobicContact CE1-CG 4.4Å; Y645-Q674 WeakPolarHBondContact OH-CG 3.42Å; Y645-Q674 PolarHBondContact OH-NE2 2.93Å; Y645-Q674 PolarHBondContact OH-OE1 3.13Å
675	D	94.4	Very high	81.9	Confident	35 Å²	35	69.2 Å²	69.2	19%	0.187	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	134.1	-174.7	-42.5	-47.7	0	0	0	111.3	Q458 V641 R673 K677	Q458-D675 PolarHBondContact NE2-OD2 2.9Å; V641-D675 CarbonylContact O-C 3.58Å; V641-D675 WeakPolarHBondContact O-CA 3.35Å; R673-D675 IonicContact CZ-OD1 3.69Å; R673-D675 IonicContact NH1-OD1 3.07Å; R673-D675 PolarHBondContact NH1-OD1 3.36Å; R673-D675 IonicContact NH1-OD2 2.72Å; D675-K677 VanDerWaalsContact C-N 3.3Å; D675-K677 HydrophobicContact CB-CG 4.26Å; D675-K677 PolarHBondContact O-N 3.15Å
676	L	94.5	Very high	83.9	Confident	12 Å²	12	65.1 Å²	65.1	6%	0.063	33%	0.329	C	S	.	.			trans	-79.9	75.4	176.4	-77.5	166.1	0	0	0	110.4	I464 V553 L570 I640 V641 I678 L701	I464-L676 HydrophobicContact CG2-CD2 3.79Å; V553-L676 HydrophobicContact CG1-CD2 4.1Å; V553-L676 HydrophobicContact CG2-CD1 4.4Å; V553-L676 HydrophobicContact CG2-CD2 4.33Å; L570-L676 HydrophobicContact CD2-CD1 4.41Å; I640-L676 HydrophobicContact CG2-CD1 4.39Å; V641-L676 PolarHBondContact O-N 2.69Å; L676-I678 PolarHBondContact O-N 3.11Å; L676-L701 HydrophobicContact CB-CD1 3.74Å; L676-L701 HydrophobicContact CD1-CD1 4.17Å
677	K	87.8	Confident	85.5	Confident	143 Å²	143	66.6 Å²	66.6	62%	0.622	33%	0.329	S	S	*	.			trans	-72.9	84.9	178.6	-62.9	-176.4	-176.7	-179.1	0	111.5	S466 D675	S466-K677 WeakPolarHBondContact CB-O 3.5Å; D675-K677 VanDerWaalsContact C-N 3.3Å; D675-K677 HydrophobicContact CB-CG 4.26Å; D675-K677 PolarHBondContact O-N 3.15Å
678	I	89.6	Confident	86.4	Confident	34 Å²	34	70.5 Å²	70.5	17%	0.174	34%	0.342	C	S	.	.			trans	-80.1	137	173	-58.9	-163.8	0	0	0	110	T469 L676 D698 R700 L701	T469-I678 HydrophobicContact CG2-CD1 4.41Å; L676-I678 PolarHBondContact O-N 3.11Å; I678-D698 HydrophobicContact CG2-CB 3.84Å; I678-R700 HydrophobicContact CD1-CG 3.78Å; I678-R700 VanDerWaalsContact CG2-NH2 3.29Å; I678-L701 HydrophobicContact CD1-CD1 3.41Å; I678-L701 VanDerWaalsContact CD1-CD1 3.41Å; I678-L701 HydrophobicContact CD1-CG 3.75Å; I678-L701 HydrophobicContact CG1-CD1 3.85Å
679	Q	84.1	Confident	86.3	Confident	123 Å²	123	70.1 Å²	70.1	58%	0.575	34%	0.34	S	S	*	.			trans	-115.3	133.3	170.9	-65.8	-179	-5.2	0	0	108.5
680	G	83.6	Confident	85.8	Confident	9 Å²	9	72.9 Å²	72.9	9%	0.093	35%	0.349	C	S	.	.			trans	-73.1	-178.5	172.9	0	0	0	0	0	112.8	Y695 G696	G680-Y695 WeakPolarHBondContact O-CD1 3.39Å; G680-G696 WeakPolarHBondContact CA-O 3.24Å; G680-G696 PolarHBondContact N-O 3.49Å
681	P	80.8	Confident	85.4	Confident	93 Å²	93	79.6 Å²	79.6	60%	0.604	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-62	144.9	-177.9	25.7	-34.6	0	0	0	111.8	L683 G696	P681-L683 PolarHBondContact O-N 3.19Å; P681-G696 PolarHBondContact O-N 2.95Å
682	R	81.4	Confident	84.6	Confident	119 Å²	119	81 Å²	81	45%	0.449	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-64.5	124.2	176.4	-178.7	-179.8	164.8	162.8	2.7	110.1	N684 Y695	R682-N684 PolarHBondContact NE-OD1 3.44Å; R682-N684 PolarHBondContact O-ND2 3Å; R682-N684 VanDerWaalsContact O-ND2 3.08Å; R682-Y695 HydrophobicContact CB-CD1 3.99Å; R682-Y695 HydrophobicContact CB-CE1 3.91Å; R682-Y695 HydrophobicContact CG-CE1 4.4Å
683	L	82.4	Confident	83.9	Confident	63 Å²	63	85.4 Å²	85.4	33%	0.33	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-72	133.5	173.6	-55.9	179.3	0	0	0	108.9	P681 D689 R694	P681-L683 PolarHBondContact O-N 3.19Å; L683-D689 HydrophobicContact CB-CB 3.97Å; L683-R694 HydrophobicContact CB-CB 4.45Å; L683-R694 HydrophobicContact CD1-CB 4.25Å; L683-R694 PolarHBondContact N-O 3.26Å
684	N	81.2	Confident	83.2	Confident	74 Å²	74	89.1 Å²	89.1	40%	0.396	43%	0.433	S	S	.	.			trans	-143.9	19.1	178.8	-64.3	-71.9	0	0	0	111.7	R682 K690	R682-N684 PolarHBondContact NE-OD1 3.44Å; R682-N684 PolarHBondContact O-ND2 3Å; R682-N684 VanDerWaalsContact O-ND2 3.08Å; N684-K690 WeakPolarHBondContact O-CE 3.31Å
685	L	81.4	Confident	82.5	Confident	157 Å²	157	93.5 Å²	93.5	82%	0.822	45%	0.45	S	S	*	.	S	Bend	trans	-86.9	-55.1	-173.2	-68.7	174.8	0	0	0	111.5
686	T	84.6	Confident	81.9	Confident	64 Å²	64	92.8 Å²	92.8	39%	0.393	45%	0.45	S	S	.	.	S	Bend	trans	-77.7	164.1	-179	72.2	0	0	0	0	111.8	E688 D689 K690	T686-E688 PolarHBondContact O-N 2.87Å; T686-E688 PolarHBondContact OG1-N 3.13Å; T686-D689 WeakPolarHBondContact CB-OD2 3.45Å; T686-D689 WeakPolarHBondContact CG2-OD2 3.22Å; T686-D689 PolarHBondContact N-OD2 3.4Å; T686-D689 PolarHBondContact O-N 2.94Å; T686-D689 PolarHBondContact OG1-N 3.2Å; T686-D689 PolarHBondContact OG1-OD2 3.45Å; T686-K690 WeakPolarHBondContact O-CG 3.43Å; T686-K690 PolarHBondContact O-N 3.37Å
687	K	80.9	Confident	81.5	Confident	166 Å²	166	94.6 Å²	94.6	72%	0.722	47%	0.467	S	S	*	.	H	α-helix	trans	-63.3	-33.2	172.2	-171.5	-180	177.4	-174.9	0	111.4	K690 M691	K687-K690 PolarHBondContact O-N 2.91Å; K687-M691 HydrophobicContact CG-SD 4.28Å; K687-M691 WeakPolarHBondContact O-CG 3.27Å; K687-M691 PolarHBondContact O-N 3.2Å
688	E	78.7	Confident	81.7	Confident	133 Å²	133	89.1 Å²	89.1	62%	0.621	44%	0.444	S	S	*	.	H	α-helix	trans	-68.1	-44.2	177.1	-70.1	148.8	-139.9	0	0	111.6	T686 K690 M691 Q692	T686-E688 PolarHBondContact O-N 2.87Å; T686-E688 PolarHBondContact OG1-N 3.13Å; E688-K690 PolarHBondContact O-N 3.32Å; E688-M691 CarbonylContact O-C 3.55Å; E688-M691 PolarHBondContact O-N 3.5Å; E688-Q692 PolarHBondContact O-N 3.01Å
689	D	77.6	Confident	81.9	Confident	19 Å²	19	92 Å²	92	10%	0.102	45%	0.453	C	S	.	.	H	α-helix	trans	-63.8	-27.1	174.4	-57.8	-43.7	0	0	0	113.2	L683 T686 Q692	L683-D689 HydrophobicContact CB-CB 3.97Å; T686-D689 WeakPolarHBondContact CB-OD2 3.45Å; T686-D689 WeakPolarHBondContact CG2-OD2 3.22Å; T686-D689 PolarHBondContact N-OD2 3.4Å; T686-D689 PolarHBondContact O-N 2.94Å; T686-D689 PolarHBondContact OG1-N 3.2Å; T686-D689 PolarHBondContact OG1-OD2 3.45Å; D689-Q692 CarbonylContact C-O 3.6Å
690	K	76.7	Confident	82.4	Confident	138 Å²	138	86.2 Å²	86.2	60%	0.6	43%	0.426	S	S	*	.	H	α-helix	trans	-78.4	-25.1	174.1	-69	175	-171.9	179.5	0	112.2	N684 T686 K687 E688	N684-K690 WeakPolarHBondContact O-CE 3.31Å; T686-K690 WeakPolarHBondContact O-CG 3.43Å; T686-K690 PolarHBondContact O-N 3.37Å; K687-K690 PolarHBondContact O-N 2.91Å; E688-K690 PolarHBondContact O-N 3.32Å
691	M	81.9	Confident	83	Confident	147 Å²	147	86.3 Å²	86.3	72%	0.724	42%	0.424	S	S	*	.	H	α-helix	trans	-93.3	-20.9	179.6	-70.9	-179.7	65.7	0	0	113.5	K687 E688	K687-M691 HydrophobicContact CG-SD 4.28Å; K687-M691 WeakPolarHBondContact O-CG 3.27Å; K687-M691 PolarHBondContact O-N 3.2Å; E688-M691 CarbonylContact O-C 3.55Å; E688-M691 PolarHBondContact O-N 3.5Å
692	Q	75	Confident	83.7	Confident	113 Å²	113	84.5 Å²	84.5	53%	0.528	41%	0.408	S	S	.	.	S	Bend	trans	-129	135.7	176.1	-66.9	-176.3	-16.9	0	0	110.3	E688 D689 R694	E688-Q692 PolarHBondContact O-N 3.01Å; D689-Q692 CarbonylContact C-O 3.6Å; Q692-R694 HydrophobicContact CB-CG 4.1Å; Q692-R694 PolarHBondContact O-N 2.99Å; Q692-R694 VanDerWaalsContact OE1-NH1 3.16Å
693	V	77	Confident	84.3	Confident	91 Å²	91	78.9 Å²	78.9	55%	0.552	39%	0.387	S	S	*	.			trans	-72.4	95.9	176.7	-174.5	0	0	0	0	109.5	Y695	V693-Y695 HydrophobicContact CG1-CE2 3.67Å
694	R	78	Confident	85	Confident	119 Å²	119	77 Å²	77	45%	0.449	38%	0.376	S	S	.	.			trans	-111.1	147.5	177.7	-55.8	-177.7	94.5	135.5	-3.8	110.3	L683 Q692	L683-R694 HydrophobicContact CB-CB 4.45Å; L683-R694 HydrophobicContact CD1-CB 4.25Å; L683-R694 PolarHBondContact N-O 3.26Å; Q692-R694 HydrophobicContact CB-CG 4.1Å; Q692-R694 PolarHBondContact O-N 2.99Å; Q692-R694 VanDerWaalsContact OE1-NH1 3.16Å
695	Y	82	Confident	85.7	Confident	112 Å²	112	73.7 Å²	73.7	44%	0.439	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-121.8	147.4	179.1	-63.1	-85.7	0	0	0	109.8	G680 R682 V693	G680-Y695 WeakPolarHBondContact O-CD1 3.39Å; R682-Y695 HydrophobicContact CB-CD1 3.99Å; R682-Y695 HydrophobicContact CB-CE1 3.91Å; R682-Y695 HydrophobicContact CG-CE1 4.4Å; V693-Y695 HydrophobicContact CG1-CE2 3.67Å
696	G	80.1	Confident	86.3	Confident	19 Å²	19	66.5 Å²	66.5	20%	0.196	32%	0.321	C	S	.	.			trans	-72.1	169.4	173	0	0	0	0	0	112.5	G680 P681	G680-G696 WeakPolarHBondContact CA-O 3.24Å; G680-G696 PolarHBondContact N-O 3.49Å; P681-G696 PolarHBondContact O-N 2.95Å
697	A	85.9	Confident	86.7	Confident	50 Å²	50	66.4 Å²	66.4	41%	0.413	32%	0.322	S	S	.	.			trans	-72.5	148.4	171.4	0	0	0	0	0	111.2
698	D	92.7	Very high	87.2	Confident	28 Å²	28	61.2 Å²	61.2	15%	0.15	31%	0.306	C	S	.	.			trans	-138.4	110.3	171	-173.5	-40.6	0	0	0	108.1	N537 I678 R700	N537-D698 HydrophobicContact CB-CB 4.28Å; N537-D698 VanDerWaalsContact CB-OD1 3.25Å; N537-D698 WeakPolarHBondContact CB-OD1 3.44Å; N537-D698 VanDerWaalsContact ND2-CG 3.29Å; N537-D698 PolarHBondContact ND2-OD1 3.38Å; N537-D698 PolarHBondContact ND2-OD2 2.93Å; I678-D698 HydrophobicContact CG2-CB 3.84Å; D698-R700 WeakPolarHBondContact OD1-CB 3.12Å; D698-R700 VanDerWaalsContact OD1-CG 3.28Å; D698-R700 WeakPolarHBondContact OD1-CG 3.45Å; D698-R700 PolarHBondContact OD1-N 3.38Å; D698-R700 VanDerWaalsContact OD1-N 3.1Å; D698-R700 IonicContact OD1-NE 3.98Å; D698-R700 PolarHBondContact OD1-NE 2.72Å; D698-R700 VanDerWaalsContact OD1-NE 3.08Å; D698-R700 IonicContact OD2-CZ 2.65Å; D698-R700 VanDerWaalsContact OD2-CZ 3.28Å; D698-R700 IonicContact OD2-NE 3.16Å; D698-R700 PolarHBondContact OD2-NE 3.07Å; D698-R700 IonicContact OD2-NH2 2.68Å; D698-R700 PolarHBondContact OD2-NH2 3.01Å
699	R	93.2	Very high	87.9	Confident	95 Å²	95	55.1 Å²	55.1	36%	0.358	28%	0.277	S	S	.	.			trans	-104.1	18.7	-174.2	-54.3	-168.5	-168.5	-156.4	-2.1	112.5	N537 L538 H540 P541 L701 E702	N537-R699 PolarHBondContact O-N 2.72Å; L538-R699 WeakPolarHBondContact O-CD 3.49Å; L538-R699 PolarHBondContact O-NE 2.88Å; H540-R699 PolarHBondContact NE2-NH1 2.87Å; P541-R699 WeakPolarHBondContact CD-O 3.23Å; R699-L701 PolarHBondContact O-N 3.28Å; R699-E702 HydrophobicContact CB-CB 4.37Å; R699-E702 PolarHBondContact O-N 3.31Å
700	R	94.9	Very high	88.7	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.6	-174.5	79.5	-179.4	93.1	153.4	3.7	113.9	S467 T469 V471 L531 N537 I678 D698	S467-R700 PolarHBondContact O-NH1 2.67Å; S467-R700 VanDerWaalsContact O-NH1 3.16Å; T469-R700 PolarHBondContact O-NH1 3.03Å; V471-R700 HydrophobicContact CG2-CB 4.45Å; V471-R700 HydrophobicContact CG2-CG 4.05Å; L531-R700 HydrophobicContact CB-CB 3.89Å; L531-R700 HydrophobicContact CD1-CB 3.72Å; L531-R700 HydrophobicContact CG-CB 4.48Å; N537-R700 HydrophobicContact CB-CB 4.32Å; N537-R700 PolarHBondContact ND2-NE 3.38Å; I678-R700 HydrophobicContact CD1-CG 3.78Å; I678-R700 VanDerWaalsContact CG2-NH2 3.29Å; D698-R700 WeakPolarHBondContact OD1-CB 3.12Å; D698-R700 VanDerWaalsContact OD1-CG 3.28Å; D698-R700 WeakPolarHBondContact OD1-CG 3.45Å; D698-R700 PolarHBondContact OD1-N 3.38Å; D698-R700 VanDerWaalsContact OD1-N 3.1Å; D698-R700 IonicContact OD1-NE 3.98Å; D698-R700 PolarHBondContact OD1-NE 2.72Å; D698-R700 VanDerWaalsContact OD1-NE 3.08Å; D698-R700 IonicContact OD2-CZ 2.65Å; D698-R700 VanDerWaalsContact OD2-CZ 3.28Å; D698-R700 IonicContact OD2-NE 3.16Å; D698-R700 PolarHBondContact OD2-NE 3.07Å; D698-R700 IonicContact OD2-NH2 2.68Å; D698-R700 PolarHBondContact OD2-NH2 3.01Å
701	L	96.1	Very high	89.4	Confident	12 Å²	12	49 Å²	49	6%	0.063	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	5.6	178	-67.9	177.6	0	0	0	114.1	T469 V471 V551 I640 L676 I678 R699 P703	T469-L701 HydrophobicContact CG2-CD2 4.42Å; V471-L701 HydrophobicContact CG2-CD2 3.7Å; V551-L701 HydrophobicContact CG1-CD2 4.17Å; I640-L701 HydrophobicContact CB-CB 4.13Å; I640-L701 HydrophobicContact CB-CD2 4.02Å; I640-L701 HydrophobicContact CD1-CD2 4.5Å; I640-L701 HydrophobicContact CG2-CD2 4.11Å; I640-L701 PolarHBondContact N-O 2.86Å; I640-L701 WeakPolarHBondContact O-CD1 3.24Å; L676-L701 HydrophobicContact CB-CD1 3.74Å; L676-L701 HydrophobicContact CD1-CD1 4.17Å; I678-L701 HydrophobicContact CD1-CD1 3.41Å; I678-L701 VanDerWaalsContact CD1-CD1 3.41Å; I678-L701 HydrophobicContact CD1-CG 3.75Å; I678-L701 HydrophobicContact CG1-CD1 3.85Å; R699-L701 PolarHBondContact O-N 3.28Å; L701-P703 WeakPolarHBondContact O-CD 3.43Å
702	E	95.4	Very high	90	Very high	55 Å²	55	42 Å²	42	26%	0.257	22%	0.216	S	C	.	.			trans	-116.1	56.8	-176.3	-56.5	-179.7	163.7	0	0	113	H540 L638 R699	H540-E702 IonicContact CE1-OE2 3.11Å; H540-E702 PolarHBondContact CE1-OE2 3.42Å; H540-E702 WeakPolarHBondContact ND1-CB 3.22Å; H540-E702 PolarHBondContact ND1-O 2.61Å; H540-E702 IonicContact ND1-OE2 3.7Å; L638-E702 CarbonylContact O-C 3.58Å; L638-E702 VanDerWaalsContact O-C 3.28Å; L638-E702 WeakPolarHBondContact O-CA 3.32Å; R699-E702 HydrophobicContact CB-CB 4.37Å; R699-E702 PolarHBondContact O-N 3.31Å
703	P	95.8	Very high	90.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-68.7	142.9	-177.8	26.5	-32.5	0	0	0	114.1	F473 P541 A543 I549 L638 L701 I705	F473-P703 HydrophobicContact CE1-CB 3.62Å; F473-P703 HydrophobicContact CE1-CG 3.95Å; F473-P703 HydrophobicContact CZ-CB 4.02Å; F473-P703 HydrophobicContact CZ-CG 4.34Å; P541-P703 HydrophobicContact CB-CB 4.49Å; P541-P703 HydrophobicContact CG-CB 4.04Å; P541-P703 CarbonylContact O-C 3.58Å; P541-P703 VanDerWaalsContact O-CA 3.3Å; P541-P703 WeakPolarHBondContact O-CA 3.19Å; A543-P703 HydrophobicContact CB-CB 4.23Å; I549-P703 HydrophobicContact CD1-CG 4.06Å; L638-P703 HydrophobicContact CB-CG 4.17Å; L638-P703 HydrophobicContact CD2-CG 4.2Å; L638-P703 HydrophobicContact CG-CG 4.4Å; L638-P703 PolarHBondContact N-O 3.44Å; L638-P703 VanDerWaalsContact O-CD 3.26Å; L638-P703 WeakPolarHBondContact O-CD 3.49Å; L701-P703 WeakPolarHBondContact O-CD 3.43Å; P703-I705 HydrophobicContact CB-CD1 4.44Å
704	I	95.6	Very high	91.6	Very high	23 Å²	23	33.8 Å²	33.8	12%	0.118	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.8	168	-64	169.1	0	0	0	107.7	H540 P541 L542 A543 T706 K856	H540-I704 HydrophobicContact CB-CD1 3.67Å; H540-I704 HydrophobicContact CB-CG1 3.91Å; P541-I704 PolarHBondContact O-N 3.37Å; L542-I704 HydrophobicContact CD2-CB 3.98Å; L542-I704 HydrophobicContact CD2-CD1 4.47Å; L542-I704 HydrophobicContact CD2-CG2 4.34Å; A543-I704 PolarHBondContact N-O 3.42Å; I704-T706 HydrophobicContact CG2-CG2 4.46Å; I704-K856 HydrophobicContact CG2-CD 4.24Å
705	I	95.7	Very high	92.3	Very high	5 Å²	5	29 Å²	29	3%	0.026	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	119.3	178.2	-43.4	-52.1	0	0	0	109.2	A543 I545 I549 F574 P632 R634 T635 G636 L638 P703	A543-I705 HydrophobicContact CB-CD1 3.83Å; A543-I705 CarbonylContact O-C 3.54Å; A543-I705 WeakPolarHBondContact O-CA 3.45Å; I545-I705 HydrophobicContact CG2-CG2 3.48Å; I545-I705 VanDerWaalsContact CG2-CG2 3.48Å; I549-I705 HydrophobicContact CD1-CD1 3.9Å; F574-I705 HydrophobicContact CE2-CG1 4.08Å; P632-I705 HydrophobicContact CB-CD1 4.07Å; P632-I705 HydrophobicContact CB-CG1 4.1Å; P632-I705 HydrophobicContact CB-CG2 3.95Å; P632-I705 HydrophobicContact CG-CD1 4.05Å; P632-I705 HydrophobicContact CG-CG2 4.04Å; R634-I705 WeakPolarHBondContact O-CG2 3.39Å; T635-I705 WeakPolarHBondContact CA-O 3.44Å; G636-I705 PolarHBondContact N-O 2.61Å; G636-I705 PolarHBondContact O-N 3.32Å; L638-I705 HydrophobicContact CB-CD1 4Å; L638-I705 HydrophobicContact CB-CG1 4.13Å; L638-I705 HydrophobicContact CD2-CD1 4.13Å; P703-I705 HydrophobicContact CB-CD1 4.44Å
706	T	93.8	Very high	92.8	Very high	6 Å²	6	23.8 Å²	23.8	4%	0.037	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	162.2	-177.1	70.7	0	0	0	0	112.1	L542 A543 I545 I704 K856 I857	L542-T706 HydrophobicContact CB-CG2 4.44Å; L542-T706 HydrophobicContact CD2-CG2 4.28Å; A543-T706 PolarHBondContact O-N 3.23Å; A543-T706 PolarHBondContact O-OG1 3.14Å; I545-T706 PolarHBondContact N-O 3.06Å; I704-T706 HydrophobicContact CG2-CG2 4.46Å; T706-K856 HydrophobicContact CG2-CB 4.09Å; T706-K856 HydrophobicContact CG2-CD 4.26Å; T706-I857 HydrophobicContact CG2-CD1 4.36Å; T706-I857 HydrophobicContact CG2-CG1 4.34Å; T706-I857 WeakPolarHBondContact OG1-CD1 3.37Å
707	P	93.2	Very high	93.3	Very high	62 Å²	62	23.9 Å²	23.9	40%	0.403	13%	0.13	S	C	.	.	S	Bend	trans	-55.4	165.7	173.8	-25	34.8	0	0	0	113.4	T635 M709	T635-P707 HydrophobicContact CG2-CG 4.15Å; P707-M709 PolarHBondContact O-N 3.17Å
708	P	92.1	Very high	93.4	Very high	58 Å²	58	27.9 Å²	27.9	38%	0.377	14%	0.14	S	C	.	.			trans	-48.7	137.5	177.8	-30.9	38.2	0	0	0	113.3	I545 V741	I545-P708 HydrophobicContact CD1-CG 3.66Å; I545-P708 HydrophobicContact CG1-CG 3.77Å; P708-V741 HydrophobicContact CB-CG2 3.45Å; P708-V741 VanDerWaalsContact CB-CG2 3.45Å
709	M	93.3	Very high	93.2	Very high	4 Å²	4	27.7 Å²	27.7	2%	0.02	14%	0.138	C	C	.	.			trans	-123.8	152.7	174.8	-77.7	-68.4	-68.3	0	0	110.1	V544 P707 N850 L855 I857 R860	V544-M709 HydrophobicContact CG1-CB 4.16Å; V544-M709 HydrophobicContact CG2-CB 4.06Å; V544-M709 HydrophobicContact CG2-CG 3.97Å; P707-M709 PolarHBondContact O-N 3.17Å; M709-N850 HydrophobicContact CE-CB 4.18Å; M709-N850 HydrophobicContact SD-CB 3.99Å; M709-L855 HydrophobicContact SD-CD1 3.75Å; M709-I857 HydrophobicContact CE-CB 4Å; M709-I857 HydrophobicContact CE-CG2 3.67Å; M709-I857 HydrophobicContact CG-CB 4.34Å; M709-I857 HydrophobicContact CG-CD1 4.26Å; M709-I857 HydrophobicContact SD-CB 4.24Å; M709-R860 HydrophobicContact CE-CG 4.18Å
710	P	93.7	Very high	92.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.124	C	C	.	.			trans	-55	144.8	170.4	22.6	-34.3	0	0	0	111.7	S739 L743 Y848 N850 R860	P710-S739 VanDerWaalsContact CA-OG 3.32Å; P710-S739 WeakPolarHBondContact CA-OG 3.41Å; P710-L743 HydrophobicContact CB-CB 3.51Å; P710-L743 HydrophobicContact CG-CB 4.26Å; P710-Y848 HydrophobicContact CB-CD2 4.08Å; P710-Y848 HydrophobicContact CB-CE2 4Å; P710-Y848 HydrophobicContact CG-CD2 4.06Å; P710-Y848 HydrophobicContact CG-CE2 4.13Å; P710-Y848 WeakPolarHBondContact O-CE2 3.39Å; P710-N850 HydrophobicContact CG-CB 4.22Å; P710-R860 WeakPolarHBondContact O-CD 3.4Å; P710-R860 PolarHBondContact O-NH1 3.3Å
711	L	92.9	Very high	92.5	Very high	28 Å²	28	28.8 Å²	28.8	15%	0.147	16%	0.156	C	C	.	.			trans	-131	127.3	173.6	-176.8	62.7	0	0	0	108.2	H475 N737 V738 S739	H475-L711 HydrophobicContact CB-CD2 3.77Å; L711-N737 PolarHBondContact O-OD1 2.99Å; L711-V738 HydrophobicContact CB-CG2 4.03Å; L711-V738 HydrophobicContact CD2-CG2 3.85Å; L711-V738 HydrophobicContact CG-CG2 3.71Å; L711-V738 WeakPolarHBondContact O-CG2 3.49Å; L711-V738 PolarHBondContact O-N 3.06Å; L711-S739 VanDerWaalsContact N-CB 3.33Å; L711-S739 PolarHBondContact N-OG 2.83Å
712	M	93.1	Very high	92	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.5	-174.9	-170.3	-178.4	62.9	0	0	111.2	V714 F735 C736 L743 L746 F846 Y848 L862	M712-V714 HydrophobicContact CE-CG2 3.67Å; M712-V714 HydrophobicContact CG-CG2 4.22Å; M712-V714 HydrophobicContact SD-CG2 4.17Å; M712-F735 HydrophobicContact CE-CD1 4.27Å; M712-F735 HydrophobicContact SD-CB 4.25Å; M712-F735 HydrophobicContact SD-CD1 3.81Å; M712-C736 VanDerWaalsContact CA-O 3.32Å; M712-C736 WeakPolarHBondContact CA-O 3.37Å; M712-L743 HydrophobicContact CB-CD2 3.87Å; M712-L743 HydrophobicContact CG-CD2 4Å; M712-L743 HydrophobicContact SD-CD2 4.23Å; M712-L746 HydrophobicContact CE-CD1 3.63Å; M712-L746 HydrophobicContact SD-CD1 3.57Å; M712-L746 VanDerWaalsContact SD-CD1 3.57Å; M712-L746 HydrophobicContact SD-CD2 4.14Å; M712-F846 HydrophobicContact CE-CB 3.88Å; M712-F846 HydrophobicContact CE-CG 4.45Å; M712-Y848 HydrophobicContact CB-CD1 4.24Å; M712-Y848 HydrophobicContact CB-CE1 3.84Å; M712-Y848 HydrophobicContact CB-CE2 4.15Å; M712-Y848 HydrophobicContact CE-CD1 3.71Å; M712-Y848 HydrophobicContact CE-CE1 3.96Å; M712-Y848 PolarHBondContact N-OH 2.97Å; M712-Y848 HydrophobicContact SD-CD1 4.44Å; M712-L862 HydrophobicContact CE-CD2 4.41Å
713	E	92.9	Very high	91.5	Very high	27 Å²	27	27.4 Å²	27.4	13%	0.126	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	146.8	165.6	-71.4	174	-163.3	0	0	109.4	R478 F715 C736 V738	R478-E713 IonicContact CZ-OE1 2.86Å; R478-E713 VanDerWaalsContact CZ-OE1 3.29Å; R478-E713 IonicContact CZ-OE2 3.39Å; R478-E713 VanDerWaalsContact NE-CD 3.35Å; R478-E713 IonicContact NE-OE1 3.18Å; R478-E713 PolarHBondContact NE-OE1 3.47Å; R478-E713 IonicContact NE-OE2 3.27Å; R478-E713 PolarHBondContact NE-OE2 2.83Å; R478-E713 IonicContact NH2-OE1 2.67Å; R478-E713 PolarHBondContact NH2-OE1 3.34Å; R478-E713 IonicContact NH2-OE2 2.71Å; E713-F715 HydrophobicContact CB-CE2 3.8Å; E713-F715 HydrophobicContact CB-CZ 4.1Å; E713-F715 WeakPolarHBondContact OE2-CZ 3.4Å; E713-C736 HydrophobicContact CB-CB 4.35Å; E713-C736 PolarHBondContact N-O 3.39Å; E713-C736 PolarHBondContact O-N 3.29Å; E713-V738 HydrophobicContact CB-CG1 4.29Å; E713-V738 HydrophobicContact CG-CG1 4.16Å; E713-V738 HydrophobicContact CG-CG2 4.01Å
714	V	93.3	Very high	90.8	Very high	3 Å²	3	28 Å²	28	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129.1	-179.7	179	0	0	0	0	109.6	A487 M712 F716 V733 E734 F735 F846 L862	A487-V714 HydrophobicContact CB-CB 4.18Å; A487-V714 PolarHBondContact N-O 3.4Å; M712-V714 HydrophobicContact CE-CG2 3.67Å; M712-V714 HydrophobicContact CG-CG2 4.22Å; M712-V714 HydrophobicContact SD-CG2 4.17Å; V714-F716 HydrophobicContact CG1-CD2 4.43Å; V714-F716 HydrophobicContact CG1-CE2 3.69Å; V714-F716 HydrophobicContact CG1-CZ 3.77Å; V714-V733 HydrophobicContact CG1-CG1 3.44Å; V714-V733 VanDerWaalsContact CG1-CG1 3.44Å; V714-E734 WeakPolarHBondContact CA-O 3.34Å; V714-F735 HydrophobicContact CG1-CD1 4.24Å; V714-F735 HydrophobicContact CG1-CE1 4.13Å; V714-F735 HydrophobicContact CG2-CD1 3.52Å; V714-F735 HydrophobicContact CG2-CE1 3.94Å; V714-F735 HydrophobicContact CG2-CG 4.46Å; V714-F846 HydrophobicContact CG1-CE2 4.38Å; V714-F846 HydrophobicContact CG1-CZ 4.38Å; V714-L862 HydrophobicContact CB-CD2 3.69Å; V714-L862 HydrophobicContact CG2-CD2 3.43Å; V714-L862 VanDerWaalsContact CG2-CD2 3.43Å
715	F	93.3	Very high	90.1	Very high	19 Å²	19	27.5 Å²	27.5	8%	0.083	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129	-180	-56.9	-84.9	0	0	0	110.7	A480 K484 Q485 A486 E713 V733 E734 C736	A480-F715 HydrophobicContact CB-CD1 4.12Å; A480-F715 HydrophobicContact CB-CE1 4.18Å; K484-F715 HydrophobicContact CB-CB 4.3Å; K484-F715 HydrophobicContact CB-CD1 4.27Å; K484-F715 HydrophobicContact CD-CB 4.13Å; K484-F715 HydrophobicContact CD-CD1 4.33Å; K484-F715 HydrophobicContact CD-CG 4.2Å; K484-F715 HydrophobicContact CG-CB 4.5Å; Q485-F715 CarbonylContact O-C 3.58Å; Q485-F715 WeakPolarHBondContact O-CA 3.24Å; A486-F715 HydrophobicContact CB-CD1 4.05Å; A486-F715 HydrophobicContact CB-CE1 3.98Å; E713-F715 HydrophobicContact CB-CE2 3.8Å; E713-F715 HydrophobicContact CB-CZ 4.1Å; E713-F715 WeakPolarHBondContact OE2-CZ 3.4Å; F715-V733 CarbonylContact O-C 3.55Å; F715-V733 WeakPolarHBondContact O-CA 3.28Å; F715-E734 HydrophobicContact CB-CB 4.4Å; F715-E734 PolarHBondContact N-O 3.13Å; F715-E734 PolarHBondContact O-N 3.35Å; F715-C736 HydrophobicContact CE2-CB 4.49Å
716	F	92.3	Very high	89.2	Confident	3 Å²	3	27.3 Å²	27.3	1%	0.013	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	135.4	175.1	-59.1	-95.1	0	0	0	108.8	Q485 A487 V714 F719 V733 F846 H864	Q485-F716 HydrophobicContact CB-CB 4.4Å; Q485-F716 PolarHBondContact N-O 3.47Å; Q485-F716 PolarHBondContact O-N 3.47Å; A487-F716 HydrophobicContact CB-CE2 4.23Å; V714-F716 HydrophobicContact CG1-CD2 4.43Å; V714-F716 HydrophobicContact CG1-CE2 3.69Å; V714-F716 HydrophobicContact CG1-CZ 3.77Å; F716-F719 HydrophobicContact CB-CB 4.14Å; F716-F719 HydrophobicContact CB-CD2 3.95Å; F716-F719 HydrophobicContact CB-CG 4.36Å; F716-F719 AromaticContact CD1-CD2 3.54Å; F716-F719 HydrophobicContact CD1-CD2 3.54Å; F716-F719 AromaticContact CD1-CE2 3.64Å; F716-F719 HydrophobicContact CD1-CE2 3.64Å; F716-F719 HydrophobicContact CE1-CD2 4.47Å; F716-F719 HydrophobicContact CE1-CE2 4.14Å; F716-F719 HydrophobicContact CG-CD2 4.06Å; F716-F719 HydrophobicContact CG-CE2 4.49Å; F716-V733 HydrophobicContact CD1-CG2 3.52Å; F716-V733 HydrophobicContact CE1-CG1 4.32Å; F716-V733 HydrophobicContact CE1-CG2 3.61Å; F716-V733 HydrophobicContact CG-CG2 4.46Å; F716-F846 HydrophobicContact CE1-CZ 4.39Å; F716-F846 AromaticContact CZ-CE2 3.96Å; F716-F846 HydrophobicContact CZ-CE2 3.96Å; F716-F846 AromaticContact CZ-CZ 3.79Å; F716-F846 HydrophobicContact CZ-CZ 3.79Å; F716-H864 AromaticContact CD2-CD2 3.74Å; F716-H864 AromaticContact CD2-NE2 3.48Å; F716-H864 WeakPolarHBondContact CD2-NE2 3.42Å; F716-H864 AromaticContact CE1-CD2 3.9Å; F716-H864 HydrophobicContact CE2-CB 4.43Å; F716-H864 AromaticContact CE2-CD2 3.1Å; F716-H864 WeakPolarHBondContact CE2-CD2 3.22Å; F716-H864 AromaticContact CE2-CG 3.8Å; F716-H864 AromaticContact CE2-NE2 3.38Å; F716-H864 WeakPolarHBondContact CE2-NE2 3.28Å; F716-H864 HydrophobicContact CZ-CB 4.49Å; F716-H864 AromaticContact CZ-CD2 3.2Å; F716-H864 WeakPolarHBondContact CZ-CD2 3.3Å; F716-H864 AromaticContact CZ-NE2 3.82Å
717	L	90.4	Very high	88.4	Confident	20 Å²	20	28.2 Å²	28.2	11%	0.105	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.9	177.5	-51.7	90.3	0	0	0	109	K484 F719 Y732 E734	K484-L717 HydrophobicContact CG-CD2 3.97Å; K484-L717 HydrophobicContact CG-CG 4.1Å; L717-F719 PolarHBondContact O-N 3.37Å; L717-Y732 PolarHBondContact N-O 3.16Å; L717-Y732 PolarHBondContact O-N 3.01Å; L717-E734 HydrophobicContact CD1-CB 4.18Å
718	Q	87	Confident	87.8	Confident	135 Å²	135	26.8 Å²	26.8	63%	0.631	15%	0.148	S	C	*	.	S	Bend	trans	57.3	32.3	-177.1	-56.1	171.5	-31.5	0	0	112.5
719	F	88.4	Confident	87.1	Confident	23 Å²	23	28.3 Å²	28.3	10%	0.101	15%	0.147	C	C	.	.			trans	-71.1	125	176.8	-151.3	-84.8	0	0	0	109.5	F716 L717 A731 F755 L829 L831 F844 V866 I868	F716-F719 HydrophobicContact CB-CB 4.14Å; F716-F719 HydrophobicContact CB-CD2 3.95Å; F716-F719 HydrophobicContact CB-CG 4.36Å; F716-F719 AromaticContact CD1-CD2 3.54Å; F716-F719 HydrophobicContact CD1-CD2 3.54Å; F716-F719 AromaticContact CD1-CE2 3.64Å; F716-F719 HydrophobicContact CD1-CE2 3.64Å; F716-F719 HydrophobicContact CE1-CD2 4.47Å; F716-F719 HydrophobicContact CE1-CE2 4.14Å; F716-F719 HydrophobicContact CG-CD2 4.06Å; F716-F719 HydrophobicContact CG-CE2 4.49Å; L717-F719 PolarHBondContact O-N 3.37Å; F719-A731 HydrophobicContact CD2-CB 4.4Å; F719-F755 HydrophobicContact CZ-CE1 4.28Å; F719-L829 HydrophobicContact CD2-CD2 4.37Å; F719-L829 HydrophobicContact CE2-CD2 3.77Å; F719-L831 HydrophobicContact CD1-CD1 4.36Å; F719-L831 HydrophobicContact CD2-CD1 3.96Å; F719-L831 HydrophobicContact CE1-CD1 4.04Å; F719-L831 HydrophobicContact CE2-CD1 3.66Å; F719-L831 HydrophobicContact CE2-CD2 4.18Å; F719-L831 HydrophobicContact CG-CD1 4.33Å; F719-L831 HydrophobicContact CZ-CD1 3.71Å; F719-L831 HydrophobicContact CZ-CD2 4.16Å; F719-F844 HydrophobicContact CZ-CE2 4.38Å; F719-F844 HydrophobicContact CZ-CZ 4.44Å; F719-V866 HydrophobicContact CD1-CG1 3.96Å; F719-V866 HydrophobicContact CE1-CB 4.07Å; F719-V866 HydrophobicContact CE1-CG1 3.59Å; F719-V866 HydrophobicContact CE1-CG2 3.92Å; F719-V866 HydrophobicContact CZ-CG2 4.13Å; F719-I868 HydrophobicContact CE1-CD1 4.05Å
720	P	86.3	Confident	86.6	Confident	10 Å²	10	30.2 Å²	30.2	7%	0.065	16%	0.155	C	C	.	.			trans	-74.1	140.7	-179.4	30.5	-33.6	0	0	0	110.9	L723 L831 I868	P720-L723 HydrophobicContact CB-CD2 3.98Å; P720-L723 HydrophobicContact CB-CG 4.15Å; P720-L723 HydrophobicContact CG-CD1 4.09Å; P720-L723 HydrophobicContact CG-CD2 3.9Å; P720-L723 HydrophobicContact CG-CG 4.02Å; P720-L831 HydrophobicContact CG-CD1 3.7Å; P720-I868 WeakPolarHBondContact O-CD1 3.39Å
721	T	87.5	Confident	86.4	Confident	110 Å²	110	30.2 Å²	30.2	68%	0.675	16%	0.155	S	C	*	.	S	Bend	trans	-92.3	-19.3	167.8	50.6	0	0	0	0	112.5	C869	T721-C869 PolarHBondContact O-N 3.08Å
722	A	86.4	Confident	86.3	Confident	35 Å²	35	31.7 Å²	31.7	29%	0.289	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	138.6	176.6	0	0	0	0	0	111.5	R729 C869	A722-R729 PolarHBondContact O-NH1 3.27Å; A722-C869 VanDerWaalsContact CA-O 3.28Å; A722-C869 WeakPolarHBondContact CA-O 3.47Å; A722-C869 HydrophobicContact CB-CB 4.24Å
723	L	84.8	Confident	86.3	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.8	178.6	-71.5	173	0	0	0	109.5	P720 R729 F755 L831 I868 C869 A870 S871	P720-L723 HydrophobicContact CB-CD2 3.98Å; P720-L723 HydrophobicContact CB-CG 4.15Å; P720-L723 HydrophobicContact CG-CD1 4.09Å; P720-L723 HydrophobicContact CG-CD2 3.9Å; P720-L723 HydrophobicContact CG-CG 4.02Å; L723-R729 HydrophobicContact CD2-CB 3.74Å; L723-R729 HydrophobicContact CD2-CG 4.47Å; L723-F755 HydrophobicContact CD1-CE2 4.06Å; L723-F755 HydrophobicContact CD1-CZ 4.31Å; L723-L831 HydrophobicContact CD1-CB 4.49Å; L723-I868 HydrophobicContact CB-CG2 4.29Å; L723-I868 HydrophobicContact CD1-CG2 4.24Å; L723-I868 HydrophobicContact CG-CG2 4.4Å; L723-C869 PolarHBondContact N-O 2.77Å; L723-A870 VanDerWaalsContact O-CA 3.31Å; L723-A870 WeakPolarHBondContact O-CA 3.36Å; L723-S871 PolarHBondContact O-N 3.41Å
724	L	81.4	Confident	86.3	Confident	11 Å²	11	31.6 Å²	31.6	6%	0.058	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	147.5	168.2	-64.2	167.2	0	0	0	109.4	G726 E727 S871 N909 V915 F958	L724-G726 PolarHBondContact O-N 3.15Å; L724-E727 HydrophobicContact CB-CB 4.08Å; L724-E727 PolarHBondContact N-OE2 2.64Å; L724-E727 WeakPolarHBondContact O-CB 3.44Å; L724-E727 PolarHBondContact O-N 3.23Å; L724-S871 CarbonylContact C-O 3.32Å; L724-S871 WeakPolarHBondContact CA-O 3.26Å; L724-N909 WeakPolarHBondContact CD2-ND2 3.46Å; L724-V915 HydrophobicContact CD1-CB 4.28Å; L724-V915 HydrophobicContact CD1-CG2 4.08Å; L724-F958 HydrophobicContact CB-CE1 3.56Å; L724-F958 HydrophobicContact CB-CZ 3.7Å; L724-F958 HydrophobicContact CD1-CE1 4.5Å; L724-F958 HydrophobicContact CD1-CZ 3.75Å; L724-F958 HydrophobicContact CG-CZ 4.35Å
725	C	81.3	Confident	86.3	Confident	13 Å²	13	31.5 Å²	31.5	9%	0.088	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	125.3	-177	-65.5	0	0	0	0	111.4	E727 P834 S871 S873 F958	C725-E727 PolarHBondContact O-N 2.95Å; C725-P834 VanDerWaalsContact CA-O 3.23Å; C725-P834 WeakPolarHBondContact CA-O 3.21Å; C725-P834 VanDerWaalsContact CB-O 3.31Å; C725-P834 WeakPolarHBondContact CB-O 3.19Å; C725-P834 PolarHBondContact SG-O 3.02Å; C725-S871 PolarHBondContact N-O 3.37Å; C725-S871 PolarHBondContact SG-O 3.09Å; C725-S871 VanDerWaalsContact SG-O 3.37Å; C725-S873 WeakPolarHBondContact O-CB 3.25Å; C725-S873 PolarHBondContact O-OG 2.82Å; C725-F958 WeakPolarHBondContact O-CD1 3.26Å
726	G	75.3	Confident	86.3	Confident	2 Å²	2	31.4 Å²	31.4	2%	0.021	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	8.1	-175	0	0	0	0	0	116.3	L724 G833 F959	L724-G726 PolarHBondContact O-N 3.15Å; G726-G833 WeakPolarHBondContact CA-O 3.47Å; G726-G833 PolarHBondContact N-O 2.88Å; G726-F959 PolarHBondContact O-N 3.23Å
727	E	77.9	Confident	86.3	Confident	24 Å²	24	31.3 Å²	31.3	11%	0.112	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-67.9	137.2	172.5	-173.3	-166.1	161.2	0	0	110.7	L724 C725 R729 R832 G833 F958	L724-E727 HydrophobicContact CB-CB 4.08Å; L724-E727 PolarHBondContact N-OE2 2.64Å; L724-E727 WeakPolarHBondContact O-CB 3.44Å; L724-E727 PolarHBondContact O-N 3.23Å; C725-E727 PolarHBondContact O-N 2.95Å; E727-R729 IonicContact OE1-CZ 3.47Å; E727-R729 IonicContact OE1-NE 3.44Å; E727-R729 PolarHBondContact OE1-NE 3.08Å; E727-R729 IonicContact OE1-NH2 2.7Å; E727-R729 PolarHBondContact OE1-NH2 2.87Å; E727-R729 IonicContact OE2-CZ 3.97Å; E727-R729 IonicContact OE2-NH2 3.62Å; E727-R729 PolarHBondContact OE2-NH2 3.29Å; E727-R832 CarbonylContact O-C 3.57Å; E727-R832 VanDerWaalsContact O-CA 3.3Å; E727-R832 WeakPolarHBondContact O-CA 3.48Å; E727-G833 PolarHBondContact O-N 3.43Å; E727-F958 HydrophobicContact CB-CD1 4.43Å; E727-F958 HydrophobicContact CB-CE1 3.98Å
728	I	79.7	Confident	86.4	Confident	32 Å²	32	32.4 Å²	32.4	16%	0.164	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.8	170.7	-62.1	176.9	0	0	0	110.3	Y780 W830 L831 R832 F957 F959	I728-Y780 HydrophobicContact CD1-CE2 4.33Å; I728-Y780 WeakPolarHBondContact CD1-OH 3.18Å; I728-W830 HydrophobicContact CG2-CE3 3.82Å; I728-W830 HydrophobicContact CG2-CZ3 4.43Å; I728-L831 CarbonylContact C-O 3.6Å; I728-L831 VanDerWaalsContact CA-O 3.31Å; I728-L831 WeakPolarHBondContact CA-O 3.42Å; I728-R832 HydrophobicContact CG1-CB 4.48Å; I728-R832 HydrophobicContact CG1-CG 4.45Å; I728-F957 PolarHBondContact N-O 2.95Å; I728-F959 HydrophobicContact CD1-CB 3.69Å; I728-F959 HydrophobicContact CD1-CD2 4.33Å; I728-F959 HydrophobicContact CD1-CG 4.11Å; I728-F959 HydrophobicContact CG1-CB 4.19Å
729	R	78.9	Confident	86.6	Confident	90 Å²	90	27 Å²	27	34%	0.34	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145.6	179.3	-161.9	174.1	-69.2	169.2	4.2	111.7	A722 L723 E727 L831	A722-R729 PolarHBondContact O-NH1 3.27Å; L723-R729 HydrophobicContact CD2-CB 3.74Å; L723-R729 HydrophobicContact CD2-CG 4.47Å; E727-R729 IonicContact OE1-CZ 3.47Å; E727-R729 IonicContact OE1-NE 3.44Å; E727-R729 PolarHBondContact OE1-NE 3.08Å; E727-R729 IonicContact OE1-NH2 2.7Å; E727-R729 PolarHBondContact OE1-NH2 2.87Å; E727-R729 IonicContact OE2-CZ 3.97Å; E727-R729 IonicContact OE2-NH2 3.62Å; E727-R729 PolarHBondContact OE2-NH2 3.29Å; R729-L831 PolarHBondContact N-O 3.01Å; R729-L831 PolarHBondContact O-N 3.11Å
730	K	81.9	Confident	86.7	Confident	44 Å²	44	30.2 Å²	30.2	19%	0.191	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.9	175.7	-160.1	-175.3	-172.6	-172.7	0	110.3	Y732 W830	K730-Y732 HydrophobicContact CD-CE2 4.46Å; K730-Y732 WeakPolarHBondContact CE-OH 3.36Å; K730-Y732 PolarHBondContact NZ-OH 2.86Å; K730-W830 HydrophobicContact CB-CE3 3.92Å; K730-W830 HydrophobicContact CB-CH2 3.7Å; K730-W830 HydrophobicContact CB-CZ2 4.34Å; K730-W830 HydrophobicContact CB-CZ3 3.49Å; K730-W830 VanDerWaalsContact CB-CZ3 3.49Å; K730-W830 HydrophobicContact CD-CH2 3.76Å; K730-W830 HydrophobicContact CD-CZ2 3.89Å; K730-W830 HydrophobicContact CD-CZ3 4.42Å; K730-W830 HydrophobicContact CG-CD2 4.36Å; K730-W830 HydrophobicContact CG-CE3 4.22Å; K730-W830 HydrophobicContact CG-CH2 3.72Å; K730-W830 HydrophobicContact CG-CZ2 3.86Å; K730-W830 HydrophobicContact CG-CZ3 3.93Å
731	A	89.4	Confident	87	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	-177.2	164.3	0	0	0	0	0	108.9	F719 L829 L831	F719-A731 HydrophobicContact CD2-CB 4.4Å; A731-L829 HydrophobicContact CB-CB 4.48Å; A731-L829 PolarHBondContact N-O 3.35Å; A731-L829 PolarHBondContact O-N 2.76Å; A731-L829 VanDerWaalsContact O-O 3.1Å; A731-L831 HydrophobicContact CB-CD1 3.99Å
732	Y	90.4	Very high	87.3	Confident	59 Å²	59	26.4 Å²	26.4	23%	0.231	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	148.9	170.5	-67.3	-96.4	0	0	0	110.7	L717 K730 R826 L827 P828	L717-Y732 PolarHBondContact N-O 3.16Å; L717-Y732 PolarHBondContact O-N 3.01Å; K730-Y732 HydrophobicContact CD-CE2 4.46Å; K730-Y732 WeakPolarHBondContact CE-OH 3.36Å; K730-Y732 PolarHBondContact NZ-OH 2.86Å; Y732-R826 HydrophobicContact CD1-CG 4.13Å; Y732-R826 VanDerWaalsContact CD1-NE 3.34Å; Y732-R826 VanDerWaalsContact CD2-NH2 3.29Å; Y732-R826 VanDerWaalsContact CG-NH2 3.31Å; Y732-L827 WeakPolarHBondContact CA-O 3.34Å; Y732-P828 HydrophobicContact CD1-CB 4.4Å; Y732-P828 HydrophobicContact CE1-CB 4.26Å
733	V	92.9	Very high	87.7	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.4	169.4	-177.3	0	0	0	0	108.8	V714 F715 F716 F735 F758 R826 L827 L829	V714-V733 HydrophobicContact CG1-CG1 3.44Å; V714-V733 VanDerWaalsContact CG1-CG1 3.44Å; F715-V733 CarbonylContact O-C 3.55Å; F715-V733 WeakPolarHBondContact O-CA 3.28Å; F716-V733 HydrophobicContact CD1-CG2 3.52Å; F716-V733 HydrophobicContact CE1-CG1 4.32Å; F716-V733 HydrophobicContact CE1-CG2 3.61Å; F716-V733 HydrophobicContact CG-CG2 4.46Å; V733-F735 HydrophobicContact CB-CE2 3.95Å; V733-F735 HydrophobicContact CB-CZ 4.21Å; V733-F735 HydrophobicContact CG1-CD1 4.44Å; V733-F735 HydrophobicContact CG1-CD2 4.01Å; V733-F735 HydrophobicContact CG1-CE1 3.97Å; V733-F735 HydrophobicContact CG1-CE2 3.49Å; V733-F735 VanDerWaalsContact CG1-CE2 3.49Å; V733-F735 HydrophobicContact CG1-CG 4.46Å; V733-F735 HydrophobicContact CG1-CZ 3.46Å; V733-F735 VanDerWaalsContact CG1-CZ 3.46Å; V733-F758 HydrophobicContact CB-CE1 4.39Å; V733-F758 HydrophobicContact CG2-CE1 4.35Å; V733-R826 CarbonylContact O-C 3.49Å; V733-R826 WeakPolarHBondContact O-CA 3.26Å; V733-L827 PolarHBondContact N-O 3.26Å; V733-L827 PolarHBondContact O-N 3.09Å; V733-L829 HydrophobicContact CG2-CB 3.96Å; V733-L829 HydrophobicContact CG2-CD2 3.58Å; V733-L829 HydrophobicContact CG2-CG 4.31Å
734	E	92.6	Very high	88.1	Confident	28 Å²	28	25.4 Å²	25.4	13%	0.131	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.5	171.4	-175.6	176.1	-156.2	0	0	108.7	K484 V714 F715 L717 S824 V825 R826	K484-E734 WeakPolarHBondContact CE-OE2 3.38Å; K484-E734 IonicContact NZ-OE1 3.43Å; K484-E734 IonicContact NZ-OE2 3.16Å; K484-E734 PolarHBondContact NZ-OE2 3.13Å; V714-E734 WeakPolarHBondContact CA-O 3.34Å; F715-E734 HydrophobicContact CB-CB 4.4Å; F715-E734 PolarHBondContact N-O 3.13Å; F715-E734 PolarHBondContact O-N 3.35Å; L717-E734 HydrophobicContact CD1-CB 4.18Å; E734-S824 PolarHBondContact OE1-OG 2.98Å; E734-V825 WeakPolarHBondContact CA-O 3.41Å; E734-R826 HydrophobicContact CB-CB 4.5Å
735	F	93.7	Very high	88.6	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	124.7	173.9	-58	-91.8	0	0	0	108	M712 V714 V733 L746 F758 I812 S824 V825 L827 F846	M712-F735 HydrophobicContact CE-CD1 4.27Å; M712-F735 HydrophobicContact SD-CB 4.25Å; M712-F735 HydrophobicContact SD-CD1 3.81Å; V714-F735 HydrophobicContact CG1-CD1 4.24Å; V714-F735 HydrophobicContact CG1-CE1 4.13Å; V714-F735 HydrophobicContact CG2-CD1 3.52Å; V714-F735 HydrophobicContact CG2-CE1 3.94Å; V714-F735 HydrophobicContact CG2-CG 4.46Å; V733-F735 HydrophobicContact CB-CE2 3.95Å; V733-F735 HydrophobicContact CB-CZ 4.21Å; V733-F735 HydrophobicContact CG1-CD1 4.44Å; V733-F735 HydrophobicContact CG1-CD2 4.01Å; V733-F735 HydrophobicContact CG1-CE1 3.97Å; V733-F735 HydrophobicContact CG1-CE2 3.49Å; V733-F735 VanDerWaalsContact CG1-CE2 3.49Å; V733-F735 HydrophobicContact CG1-CG 4.46Å; V733-F735 HydrophobicContact CG1-CZ 3.46Å; V733-F735 VanDerWaalsContact CG1-CZ 3.46Å; F735-L746 HydrophobicContact CB-CD2 4.46Å; F735-L746 HydrophobicContact CD1-CD2 3.7Å; F735-L746 HydrophobicContact CD2-CD2 4.47Å; F735-L746 HydrophobicContact CE1-CD2 4.01Å; F735-L746 HydrophobicContact CG-CD2 3.97Å; F735-F758 HydrophobicContact CE2-CE1 4.02Å; F735-F758 AromaticContact CZ-CE1 3.8Å; F735-F758 HydrophobicContact CZ-CE1 3.8Å; F735-F758 AromaticContact CZ-CZ 3.97Å; F735-F758 HydrophobicContact CZ-CZ 3.97Å; F735-I812 HydrophobicContact CD2-CG2 4.47Å; F735-I812 HydrophobicContact CE1-CD1 3.8Å; F735-I812 HydrophobicContact CE2-CG2 3.89Å; F735-I812 HydrophobicContact CZ-CD1 3.69Å; F735-I812 HydrophobicContact CZ-CG2 4.01Å; F735-S824 CarbonylContact O-C 3.52Å; F735-S824 VanDerWaalsContact O-CA 3.23Å; F735-S824 WeakPolarHBondContact O-CA 3.39Å; F735-V825 HydrophobicContact CB-CG1 3.95Å; F735-V825 HydrophobicContact CD2-CG1 4.38Å; F735-V825 PolarHBondContact N-O 3.46Å; F735-V825 PolarHBondContact O-N 3.37Å; F735-L827 HydrophobicContact CD2-CD1 4.47Å; F735-L827 HydrophobicContact CE2-CD1 4.13Å; F735-F846 AromaticContact CE1-CD1 3.78Å; F735-F846 HydrophobicContact CE1-CD1 3.78Å; F735-F846 AromaticContact CE1-CE1 3.71Å; F735-F846 HydrophobicContact CE1-CE1 3.71Å; F735-F846 HydrophobicContact CZ-CD1 4.46Å; F735-F846 HydrophobicContact CZ-CE1 4.05Å
736	C	92.9	Very high	89.2	Confident	18 Å²	18	26 Å²	26	12%	0.122	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.2	-178	-63.8	0	0	0	0	109.6	M712 E713 F715 V738 S824	M712-C736 VanDerWaalsContact CA-O 3.32Å; M712-C736 WeakPolarHBondContact CA-O 3.37Å; E713-C736 HydrophobicContact CB-CB 4.35Å; E713-C736 PolarHBondContact N-O 3.39Å; E713-C736 PolarHBondContact O-N 3.29Å; F715-C736 HydrophobicContact CE2-CB 4.49Å; C736-V738 HydrophobicContact CB-CG1 4.01Å; C736-S824 WeakPolarHBondContact SG-CB 3.3Å
737	N	93.9	Very high	90.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	116.4	165.4	-177.2	-2.9	0	0	0	108.7	L711 S739 V741 L743 L819 Q820 G822 Q823	L711-N737 PolarHBondContact O-OD1 2.99Å; N737-S739 PolarHBondContact OD1-N 3.33Å; N737-S739 VanDerWaalsContact OD1-N 3.14Å; N737-S739 PolarHBondContact OD1-OG 3.36Å; N737-V741 PolarHBondContact ND2-O 3.42Å; N737-V741 PolarHBondContact OD1-O 3.35Å; N737-L743 HydrophobicContact CB-CD2 3.73Å; N737-L743 HydrophobicContact CB-CG 4.21Å; N737-L743 PolarHBondContact ND2-N 3.33Å; N737-L819 HydrophobicContact CB-CD2 3.97Å; N737-L819 HydrophobicContact CB-CG 4.09Å; N737-L819 PolarHBondContact ND2-O 3.07Å; N737-Q820 WeakPolarHBondContact CB-O 3.42Å; N737-Q820 PolarHBondContact ND2-O 3.18Å; N737-G822 CarbonylContact O-C 3.44Å; N737-G822 WeakPolarHBondContact O-CA 3.41Å; N737-G822 PolarHBondContact O-N 2.92Å; N737-Q823 PolarHBondContact N-O 3.18Å
738	V	91.9	Very high	90.9	Very high	42 Å²	42	26.6 Å²	26.6	26%	0.255	15%	0.152	S	C	.	.			trans	-112.1	6	-173.3	-60	0	0	0	0	113.3	R478 L711 E713 C736	R478-V738 VanDerWaalsContact NH2-CG1 3.27Å; L711-V738 HydrophobicContact CB-CG2 4.03Å; L711-V738 HydrophobicContact CD2-CG2 3.85Å; L711-V738 HydrophobicContact CG-CG2 3.71Å; L711-V738 WeakPolarHBondContact O-CG2 3.49Å; L711-V738 PolarHBondContact O-N 3.06Å; E713-V738 HydrophobicContact CB-CG1 4.29Å; E713-V738 HydrophobicContact CG-CG1 4.16Å; E713-V738 HydrophobicContact CG-CG2 4.01Å; C736-V738 HydrophobicContact CB-CG1 4.01Å
739	S	91.3	Very high	91.6	Very high	22 Å²	22	25 Å²	25	15%	0.154	15%	0.145	C	C	.	.	S	Bend	trans	-95.2	174.6	175.2	69.9	0	0	0	0	112.8	P710 L711 N737 V741 P821	P710-S739 VanDerWaalsContact CA-OG 3.32Å; P710-S739 WeakPolarHBondContact CA-OG 3.41Å; L711-S739 VanDerWaalsContact N-CB 3.33Å; L711-S739 PolarHBondContact N-OG 2.83Å; N737-S739 PolarHBondContact OD1-N 3.33Å; N737-S739 VanDerWaalsContact OD1-N 3.14Å; N737-S739 PolarHBondContact OD1-OG 3.36Å; S739-V741 VanDerWaalsContact C-N 3.28Å; S739-V741 PolarHBondContact OG-N 3.01Å; S739-V741 PolarHBondContact OG-O 3.48Å; S739-P821 WeakPolarHBondContact O-CA 3.47Å; S739-P821 WeakPolarHBondContact O-CB 3.23Å
740	A	90	Very high	92.2	Very high	91 Å²	91	20.9 Å²	20.9	75%	0.752	13%	0.129	S	C	*	.	S	Bend	trans	-79.4	-0.8	169.3	0	0	0	0	0	114.4	P821	A740-P821 VanDerWaalsContact O-CG 3.32Å; A740-P821 WeakPolarHBondContact O-CG 3.36Å
741	V	93.6	Very high	92.7	Very high	26 Å²	26	21 Å²	21	16%	0.158	13%	0.134	C	C	.	.	S	Bend	trans	-119.2	141.9	-173.5	-172.1	0	0	0	0	111	P708 N737 S739	P708-V741 HydrophobicContact CB-CG2 3.45Å; P708-V741 VanDerWaalsContact CB-CG2 3.45Å; N737-V741 PolarHBondContact ND2-O 3.42Å; N737-V741 PolarHBondContact OD1-O 3.35Å; S739-V741 VanDerWaalsContact C-N 3.28Å; S739-V741 PolarHBondContact OG-N 3.01Å; S739-V741 PolarHBondContact OG-O 3.48Å
742	A	93.4	Very high	92.7	Very high	13 Å²	13	24.2 Å²	24.2	11%	0.107	15%	0.148	C	C	.	.			trans	-66.4	141.3	175.6	0	0	0	0	0	111.9	T818 T851	A742-T818 HydrophobicContact CB-CG2 3.86Å; A742-T851 HydrophobicContact CB-CG2 3.98Å
743	L	93.6	Very high	92.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	146.5	174.5	71.9	78.3	0	0	0	111.3	P710 M712 N737 I814 T818 L819 Y848	P710-L743 HydrophobicContact CB-CB 3.51Å; P710-L743 HydrophobicContact CG-CB 4.26Å; M712-L743 HydrophobicContact CB-CD2 3.87Å; M712-L743 HydrophobicContact CG-CD2 4Å; M712-L743 HydrophobicContact SD-CD2 4.23Å; N737-L743 HydrophobicContact CB-CD2 3.73Å; N737-L743 HydrophobicContact CB-CG 4.21Å; N737-L743 PolarHBondContact ND2-N 3.33Å; L743-I814 HydrophobicContact CD1-CD1 4.3Å; L743-T818 CarbonylContact O-C 3.28Å; L743-T818 VanDerWaalsContact O-CA 3.3Å; L743-T818 WeakPolarHBondContact O-CA 3.48Å; L743-T818 WeakPolarHBondContact O-CG2 3.43Å; L743-L819 HydrophobicContact CD1-CB 3.7Å; L743-L819 HydrophobicContact CD1-CD2 4.31Å; L743-L819 HydrophobicContact CD2-CD2 4.33Å; L743-L819 HydrophobicContact CG-CB 3.9Å; L743-L819 HydrophobicContact CG-CD2 4.43Å; L743-L819 PolarHBondContact N-O 3.42Å; L743-L819 PolarHBondContact O-N 2.89Å; L743-Y848 HydrophobicContact CB-CD2 4.26Å; L743-Y848 HydrophobicContact CD2-CD2 4.41Å
744	C	94.1	Very high	91.7	Very high	18 Å²	18	27.6 Å²	27.6	12%	0.122	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	178	177	70.5	0	0	0	0	111.2	L746 E849 N850 T851	C744-L746 VanDerWaalsContact C-N 3.28Å; C744-L746 PolarHBondContact O-N 3.37Å; C744-E849 PolarHBondContact N-O 3.33Å; C744-E849 PolarHBondContact O-N 3.28Å; C744-N850 PolarHBondContact SG-O 2.97Å; C744-T851 HydrophobicContact CB-CG2 4.04Å
745	G	91.1	Very high	91.3	Very high	27 Å²	27	26.8 Å²	26.8	28%	0.278	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	66.5	24.5	173.6	0	0	0	0	0	114.8	R747	G745-R747 WeakPolarHBondContact O-CG 3.39Å; G745-R747 PolarHBondContact O-N 2.94Å
746	L	94.1	Very high	91	Very high	8 Å²	8	27.5 Å²	27.5	4%	0.042	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	120.9	-172.7	-176.6	64.2	0	0	0	112.2	M712 F735 C744 I812 I814 Y847	M712-L746 HydrophobicContact CE-CD1 3.63Å; M712-L746 HydrophobicContact SD-CD1 3.57Å; M712-L746 VanDerWaalsContact SD-CD1 3.57Å; M712-L746 HydrophobicContact SD-CD2 4.14Å; F735-L746 HydrophobicContact CB-CD2 4.46Å; F735-L746 HydrophobicContact CD1-CD2 3.7Å; F735-L746 HydrophobicContact CD2-CD2 4.47Å; F735-L746 HydrophobicContact CE1-CD2 4.01Å; F735-L746 HydrophobicContact CG-CD2 3.97Å; C744-L746 VanDerWaalsContact C-N 3.28Å; C744-L746 PolarHBondContact O-N 3.37Å; L746-I812 HydrophobicContact CB-CB 4.37Å; L746-I812 HydrophobicContact CD1-CD1 4.19Å; L746-I812 HydrophobicContact CD2-CB 3.85Å; L746-I812 HydrophobicContact CD2-CD1 3.91Å; L746-I812 HydrophobicContact CD2-CG1 4.44Å; L746-I812 HydrophobicContact CD2-CG2 3.68Å; L746-I812 HydrophobicContact CG-CB 3.84Å; L746-I812 HydrophobicContact CG-CD1 3.69Å; L746-I812 HydrophobicContact CG-CG1 4.23Å; L746-I812 HydrophobicContact CG-CG2 4.26Å; L746-I812 PolarHBondContact O-N 3.4Å; L746-I814 HydrophobicContact CB-CD1 3.7Å; L746-I814 HydrophobicContact CD2-CD1 3.7Å; L746-I814 HydrophobicContact CD2-CG1 4.18Å; L746-I814 HydrophobicContact CG-CD1 4.33Å; L746-Y847 WeakPolarHBondContact CA-O 3.39Å
747	R	93.9	Very high	90.7	Very high	39 Å²	39	30.1 Å²	30.1	15%	0.147	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	162.1	-176.4	-72.3	168.5	-178.3	-148.7	4.7	110.6	L511 S514 A515 G745 V809 T810 E811 F846 Y847	L511-R747 HydrophobicContact CD2-CB 3.78Å; S514-R747 PolarHBondContact O-NH1 3.47Å; S514-R747 PolarHBondContact OG-NH1 2.81Å; A515-R747 VanDerWaalsContact CA-NH1 3.27Å; G745-R747 WeakPolarHBondContact O-CG 3.39Å; G745-R747 PolarHBondContact O-N 2.94Å; R747-V809 HydrophobicContact CB-CG1 4.1Å; R747-V809 HydrophobicContact CG-CG1 4.35Å; R747-T810 WeakPolarHBondContact CA-O 3.48Å; R747-E811 HydrophobicContact CG-CG 4.14Å; R747-E811 IonicContact CZ-OE1 3.79Å; R747-E811 IonicContact NE-OE1 2.93Å; R747-E811 PolarHBondContact NE-OE1 2.69Å; R747-E811 IonicContact NH2-OE1 2.77Å; R747-E811 PolarHBondContact NH2-OE1 3.11Å; R747-F846 CarbonylContact O-C 3.55Å; R747-F846 WeakPolarHBondContact O-CA 3.42Å; R747-Y847 HydrophobicContact CB-CD1 4.44Å; R747-Y847 PolarHBondContact N-O 2.97Å; R747-Y847 PolarHBondContact O-N 3.28Å
748	V	94.7	Very high	90.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.6	170.1	62.1	0	0	0	0	111.4	F756 F758 V809 T810 I812 F844 L845 F846	V748-F756 HydrophobicContact CG1-CE2 3.61Å; V748-F756 HydrophobicContact CG1-CZ 3.72Å; V748-F756 HydrophobicContact CG2-CZ 4.39Å; V748-F758 HydrophobicContact CG1-CE2 3.69Å; V748-F758 HydrophobicContact CG1-CZ 4.29Å; V748-V809 WeakPolarHBondContact O-CA 3.43Å; V748-T810 PolarHBondContact N-O 2.89Å; V748-T810 PolarHBondContact O-N 3.19Å; V748-I812 HydrophobicContact CB-CD1 4.01Å; V748-I812 HydrophobicContact CG1-CD1 3.99Å; V748-I812 HydrophobicContact CG1-CG1 4.17Å; V748-F844 HydrophobicContact CG2-CB 4.19Å; V748-F844 HydrophobicContact CG2-CD1 4.14Å; V748-L845 CarbonylContact C-O 3.59Å; V748-L845 VanDerWaalsContact CA-O 3.28Å; V748-L845 WeakPolarHBondContact CA-O 3.46Å; V748-L845 WeakPolarHBondContact CG2-O 3.36Å; V748-F846 HydrophobicContact CB-CD1 3.72Å; V748-F846 HydrophobicContact CB-CE1 3.91Å; V748-F846 HydrophobicContact CG2-CD1 3.74Å; V748-F846 HydrophobicContact CG2-CE1 3.66Å; V748-F846 HydrophobicContact CG2-CG 4.32Å; V748-F846 HydrophobicContact CG2-CZ 4.19Å
749	A	94.5	Very high	89.6	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	153.4	163.5	0	0	0	0	0	109.7	L507 L511 R808 V809 F844 L845	L507-A749 HydrophobicContact CD2-CB 4.05Å; L511-A749 HydrophobicContact CD1-CB 3.75Å; L511-A749 HydrophobicContact CD2-CB 3.99Å; L511-A749 HydrophobicContact CG-CB 3.74Å; A749-R808 WeakPolarHBondContact CA-O 3.36Å; A749-V809 HydrophobicContact CB-CG2 4.28Å; A749-F844 WeakPolarHBondContact O-CA 3.45Å; A749-L845 PolarHBondContact N-O 3.14Å; A749-L845 PolarHBondContact O-N 2.92Å
750	S	93.1	Very high	88.5	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	154.3	171.6	-174.1	0	0	0	0	111.5	H752 N843	S750-H752 PolarHBondContact O-N 2.87Å; S750-H752 PolarHBondContact OG-N 2.94Å; S750-N843 WeakPolarHBondContact CA-O 3.44Å; S750-N843 WeakPolarHBondContact CB-O 3.46Å; S750-N843 PolarHBondContact OG-O 2.83Å
751	T	91.5	Very high	87	Confident	48 Å²	48	31.8 Å²	31.8	29%	0.294	18%	0.184	S	C	.	.	S	Bend	trans	-54	-30.2	160.4	42.3	0	0	0	0	112.6	L503 N843	L503-T751 HydrophobicContact CD1-CG2 3.97Å; L503-T751 HydrophobicContact CD2-CG2 4.1Å; T751-N843 HydrophobicContact CG2-CB 3.96Å; T751-N843 PolarHBondContact N-O 2.82Å; T751-N843 VanDerWaalsContact N-O 3.16Å; T751-N843 PolarHBondContact OG1-N 2.65Å; T751-N843 PolarHBondContact OG1-O 2.94Å
752	H	88.4	Confident	84.7	Confident	66 Å²	66	34.6 Å²	34.6	31%	0.306	21%	0.205	S	C	.	.			trans	-126.5	78.8	-177.6	-59.6	80.7	0	0	0	110	S750 D754 F755 E841 I842	S750-H752 PolarHBondContact O-N 2.87Å; S750-H752 PolarHBondContact OG-N 2.94Å; H752-D754 VanDerWaalsContact C-N 3.3Å; H752-D754 PolarHBondContact O-N 3.43Å; H752-F755 HydrophobicContact CB-CB 3.76Å; H752-F755 WeakPolarHBondContact O-CB 3.45Å; H752-F755 PolarHBondContact O-N 2.93Å; H752-F755 VanDerWaalsContact O-N 3.15Å; H752-E841 PolarHBondContact CE1-O 3.17Å; H752-I842 HydrophobicContact CB-CG2 4.21Å
753	P	83.6	Confident	82	Confident	23 Å²	23	39.6 Å²	39.6	15%	0.149	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-62.7	-35.5	-177.1	26.8	-35.9	0	0	0	112.7	F755 R808	P753-F755 PolarHBondContact O-N 3.4Å; P753-R808 HydrophobicContact CG-CG 4.3Å
754	D	80.8	Confident	79	Confident	108 Å²	108	42.6 Å²	42.6	58%	0.578	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-75.1	-1.1	179.3	-52	-55.7	0	0	0	113.6	H752	H752-D754 VanDerWaalsContact C-N 3.3Å; H752-D754 PolarHBondContact O-N 3.43Å
755	F	83.1	Confident	76.2	Confident	10 Å²	10	47 Å²	47	4%	0.044	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-77.9	-23	178.4	178	-106.7	0	0	0	113	F719 L723 H752 P753 L831 R832 P834 I842 F844 I868	F719-F755 HydrophobicContact CZ-CE1 4.28Å; L723-F755 HydrophobicContact CD1-CE2 4.06Å; L723-F755 HydrophobicContact CD1-CZ 4.31Å; H752-F755 HydrophobicContact CB-CB 3.76Å; H752-F755 WeakPolarHBondContact O-CB 3.45Å; H752-F755 PolarHBondContact O-N 2.93Å; H752-F755 VanDerWaalsContact O-N 3.15Å; P753-F755 PolarHBondContact O-N 3.4Å; F755-L831 HydrophobicContact CD1-CD2 4.04Å; F755-L831 HydrophobicContact CE1-CD2 3.53Å; F755-L831 HydrophobicContact CE1-CG 4.44Å; F755-L831 HydrophobicContact CZ-CB 4.29Å; F755-L831 HydrophobicContact CZ-CD2 4.09Å; F755-L831 CarbonylContact O-C 3.58Å; F755-L831 WeakPolarHBondContact O-CA 3.37Å; F755-R832 WeakPolarHBondContact CD2-O 3.33Å; F755-R832 VanDerWaalsContact CE2-O 3.26Å; F755-R832 WeakPolarHBondContact CE2-O 3.11Å; F755-R832 PolarHBondContact O-N 3.27Å; F755-P834 HydrophobicContact CD2-CG 4.44Å; F755-I842 HydrophobicContact CB-CD1 4.5Å; F755-I842 HydrophobicContact CD1-CD1 3.71Å; F755-I842 HydrophobicContact CD1-CG2 3.98Å; F755-I842 HydrophobicContact CD2-CD1 3.41Å; F755-I842 VanDerWaalsContact CD2-CD1 3.41Å; F755-I842 HydrophobicContact CE1-CD1 3.64Å; F755-I842 HydrophobicContact CE1-CG2 4.34Å; F755-I842 HydrophobicContact CE2-CD1 3.4Å; F755-I842 VanDerWaalsContact CE2-CD1 3.4Å; F755-I842 HydrophobicContact CG-CD1 3.61Å; F755-I842 HydrophobicContact CG-CG2 4.49Å; F755-I842 HydrophobicContact CZ-CD1 3.53Å; F755-F844 AromaticContact CD1-CZ 3.96Å; F755-F844 HydrophobicContact CD1-CZ 3.96Å; F755-F844 HydrophobicContact CE1-CZ 4.03Å; F755-I868 HydrophobicContact CE2-CG1 4.2Å; F755-I868 HydrophobicContact CZ-CD1 4.22Å; F755-I868 HydrophobicContact CZ-CG1 3.81Å
756	F	87.9	Confident	73.5	Confident	16 Å²	16	55.1 Å²	55.1	7%	0.07	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	159.5	-170.1	74.5	-76.6	0	0	0	115.5	V748 F758 L829 W830 L831 F844	V748-F756 HydrophobicContact CG1-CE2 3.61Å; V748-F756 HydrophobicContact CG1-CZ 3.72Å; V748-F756 HydrophobicContact CG2-CZ 4.39Å; F756-F758 HydrophobicContact CD2-CE2 4.12Å; F756-F758 HydrophobicContact CE2-CD2 4.44Å; F756-F758 AromaticContact CE2-CE2 3.76Å; F756-F758 HydrophobicContact CE2-CE2 3.76Å; F756-F758 HydrophobicContact CE2-CZ 4.36Å; F756-L829 HydrophobicContact CB-CD1 3.99Å; F756-L829 HydrophobicContact CD2-CD1 3.85Å; F756-L829 HydrophobicContact CG-CD1 4.35Å; F756-W830 CarbonylContact C-O 3.48Å; F756-W830 WeakPolarHBondContact CA-O 3.07Å; F756-W830 WeakPolarHBondContact CB-O 3.34Å; F756-L831 HydrophobicContact CB-CD2 3.78Å; F756-F844 HydrophobicContact CD1-CD1 4.43Å; F756-F844 AromaticContact CD1-CE1 3.6Å; F756-F844 HydrophobicContact CD1-CE1 3.6Å; F756-F844 HydrophobicContact CD1-CZ 4.43Å; F756-F844 HydrophobicContact CD2-CE1 4.29Å; F756-F844 HydrophobicContact CE1-CD1 4.17Å; F756-F844 AromaticContact CE1-CE1 3.79Å; F756-F844 HydrophobicContact CE1-CE1 3.79Å; F756-F844 HydrophobicContact CE2-CE1 4.45Å; F756-F844 AromaticContact CG-CE1 3.88Å; F756-F844 HydrophobicContact CG-CE1 3.88Å; F756-F844 HydrophobicContact CZ-CD1 4.32Å; F756-F844 HydrophobicContact CZ-CE1 4.21Å
757	T	85.4	Confident	70.7	Confident	72 Å²	72	59.7 Å²	59.7	44%	0.442	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	148.4	165.6	-176.3	0	0	0	0	111.5	W830	T757-W830 HydrophobicContact CG2-CB 3.9Å; T757-W830 PolarHBondContact N-O 2.88Å; T757-W830 PolarHBondContact O-N 2.94Å
758	F	84.5	Confident	67.6	Low	22 Å²	22	63.5 Å²	63.5	10%	0.096	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	147	172	-61.8	-81.6	0	0	0	111.5	V733 F735 V748 F756 T810 I812 P813 L827 L829 F846	V733-F758 HydrophobicContact CB-CE1 4.39Å; V733-F758 HydrophobicContact CG2-CE1 4.35Å; F735-F758 HydrophobicContact CE2-CE1 4.02Å; F735-F758 AromaticContact CZ-CE1 3.8Å; F735-F758 HydrophobicContact CZ-CE1 3.8Å; F735-F758 AromaticContact CZ-CZ 3.97Å; F735-F758 HydrophobicContact CZ-CZ 3.97Å; V748-F758 HydrophobicContact CG1-CE2 3.69Å; V748-F758 HydrophobicContact CG1-CZ 4.29Å; F756-F758 HydrophobicContact CD2-CE2 4.12Å; F756-F758 HydrophobicContact CE2-CD2 4.44Å; F756-F758 AromaticContact CE2-CE2 3.76Å; F756-F758 HydrophobicContact CE2-CE2 3.76Å; F756-F758 HydrophobicContact CE2-CZ 4.36Å; F758-T810 HydrophobicContact CD2-CG2 4.43Å; F758-I812 HydrophobicContact CD2-CG1 4.01Å; F758-I812 HydrophobicContact CE2-CD1 4.01Å; F758-I812 HydrophobicContact CE2-CG1 3.61Å; F758-I812 HydrophobicContact CZ-CD1 4.03Å; F758-I812 HydrophobicContact CZ-CG1 4.05Å; F758-P813 HydrophobicContact CB-CG 4.04Å; F758-L827 HydrophobicContact CD1-CB 4.34Å; F758-L827 HydrophobicContact CD1-CD1 4.4Å; F758-L829 HydrophobicContact CD1-CD1 3.97Å; F758-L829 HydrophobicContact CE1-CD1 3.76Å; F758-L829 HydrophobicContact CG-CD1 4.48Å; F758-L829 HydrophobicContact CZ-CD1 4.1Å; F758-F846 HydrophobicContact CZ-CE1 4.48Å
759	G	78.4	Confident	64.7	Low	17 Å²	17	69.8 Å²	69.8	18%	0.175	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-97.4	157.6	164.9	0	0	0	0	0	112.5	P828	G759-P828 PolarHBondContact N-O 2.85Å
760	S	68.9	Low	61.7	Low	54 Å²	54	73 Å²	73	38%	0.378	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-84.1	143.1	174	179.1	0	0	0	0	111.9	S762	S760-S762 PolarHBondContact O-N 3.46Å; S760-S762 WeakPolarHBondContact OG-CB 3.46Å; S760-S762 PolarHBondContact OG-N 3.34Å; S760-S762 VanDerWaalsContact OG-N 3.08Å
761	Q	58.4	Low	58.8	Low	99 Å²	99	80 Å²	80	46%	0.463	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.6	167.9	-88.9	174.8	-1.4	0	0	113.1	T763 H815 R826 L827	Q761-T763 VanDerWaalsContact C-N 3.28Å; Q761-T763 PolarHBondContact O-N 2.99Å; Q761-H815 VanDerWaalsContact CB-NE2 3.33Å; Q761-H815 WeakPolarHBondContact CB-NE2 3.4Å; Q761-H815 PolarHBondContact OE1-CD2 2.92Å; Q761-R826 PolarHBondContact NE2-O 3.42Å; Q761-L827 HydrophobicContact CG-CD2 4.12Å
762	S	45.1	Very low	56.1	Low	85 Å²	85	80.7 Å²	80.7	59%	0.594	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	3.3	-171.9	-161.8	0	0	0	0	116.1	S760 A764	S760-S762 PolarHBondContact O-N 3.46Å; S760-S762 WeakPolarHBondContact OG-CB 3.46Å; S760-S762 PolarHBondContact OG-N 3.34Å; S760-S762 VanDerWaalsContact OG-N 3.08Å; S762-A764 VanDerWaalsContact C-N 3.31Å; S762-A764 PolarHBondContact O-N 3.34Å
763	T	37.2	Very low	53.6	Low	118 Å²	118	79.8 Å²	79.8	72%	0.724	50%	0.499	S	S	*	.			trans	-82.6	77.8	175.8	37.5	0	0	0	0	111.2	Q761	Q761-T763 VanDerWaalsContact C-N 3.28Å; Q761-T763 PolarHBondContact O-N 2.99Å
764	A	31.3	Very low	51.2	Low	63 Å²	63	83.1 Å²	83.1	52%	0.521	53%	0.529	S	S	.	.			trans	-52	134.1	158.6	0	0	0	0	0	109	S762 F766	S762-A764 VanDerWaalsContact C-N 3.31Å; S762-A764 PolarHBondContact O-N 3.34Å; A764-F766 PolarHBondContact O-N 3.49Å
765	P	34.9	Very low	49.1	Very low	110 Å²	110	84.5 Å²	84.5	71%	0.714	53%	0.532	S	S	*	.			trans	-71.7	95.6	-176.2	28.2	-34.1	0	0	0	110.4	T767	P765-T767 PolarHBondContact O-N 2.81Å
766	F	33.9	Very low	47	Very low	198 Å²	198	87 Å²	87	87%	0.868	55%	0.546	S	S	*	.			trans	-73.5	49.7	165	-76.3	-77.3	0	0	0	111.7	A764	A764-F766 PolarHBondContact O-N 3.49Å
767	T	34.3	Very low	44.7	Very low	104 Å²	104	89.5 Å²	89.5	64%	0.638	56%	0.564	S	S	*	*	S	Bend	trans	-153.8	130.4	168.1	26.6	0	0	0	0	107.7	P765	P765-T767 PolarHBondContact O-N 2.81Å
768	P	29.7	Very low	42.7	Very low	118 Å²	118	89.3 Å²	89.3	77%	0.766	57%	0.566	S	S	*	*			trans	-63.1	143.6	-179.7	26.6	-34.2	0	0	0	111.1	S770	P768-S770 PolarHBondContact O-N 3.04Å
769	P	33.3	Very low	40.6	Very low	133 Å²	133	90.1 Å²	90.1	86%	0.864	58%	0.577	S	S	*	*			trans	-71.1	127.2	-175.1	28.7	-34.1	0	0	0	110.9
770	S	32	Very low	38.8	Very low	68 Å²	68	93.6 Å²	93.6	48%	0.476	59%	0.585	S	S	.	*			trans	-112.7	142.5	156.9	58.9	0	0	0	0	108.7	P768 G772	P768-S770 PolarHBondContact O-N 3.04Å; S770-G772 PolarHBondContact O-N 3.44Å
771	P	32.6	Very low	37.4	Very low	149 Å²	149	96.5 Å²	96.5	97%	0.968	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	22.5	-155.4	-18.1	34.6	0	0	0	116.7
772	G	34.3	Very low	36.4	Very low	61 Å²	61	96.4 Å²	96.4	63%	0.629	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.7	0.8	-174.8	0	0	0	0	0	116.4	S770	S770-G772 PolarHBondContact O-N 3.44Å
773	S	36.3	Very low	35.9	Very low	47 Å²	47	100.4 Å²	100.4	33%	0.329	61%	0.614	S	S	.	*			trans	-114.2	0.8	-173.2	62.3	0	0	0	0	115.3	E775 N776	S773-E775 VanDerWaalsContact C-N 3.26Å; S773-E775 PolarHBondContact O-N 2.91Å; S773-N776 PolarHBondContact O-N 3.32Å
774	A	32.6	Very low	35.7	Very low	93 Å²	93	100 Å²	100	77%	0.769	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-11.8	-169.4	0	0	0	0	0	115.7
775	E	37.1	Very low	35.7	Very low	138 Å²	138	101.9 Å²	101.9	65%	0.645	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-22.2	180	-64.3	-175.2	156.6	0	0	113.8	S773 K955	S773-E775 VanDerWaalsContact C-N 3.26Å; S773-E775 PolarHBondContact O-N 2.91Å; E775-K955 IonicContact OE2-NZ 3.13Å; E775-K955 PolarHBondContact OE2-NZ 3.34Å
776	N	40	Very low	35.6	Very low	62 Å²	62	102.2 Å²	102.2	33%	0.332	63%	0.625	S	S	.	*			trans	-105.5	67.1	-171.6	-73.3	-7.4	0	0	0	112.6	S773 S778 L954 K955	S773-N776 PolarHBondContact O-N 3.32Å; N776-S778 PolarHBondContact O-N 3Å; N776-L954 WeakPolarHBondContact ND2-CD1 3.22Å; N776-L954 WeakPolarHBondContact ND2-CG 3.43Å; N776-K955 WeakPolarHBondContact OD1-CE 3.4Å
777	C	38.5	Very low	35.4	Very low	68 Å²	68	101 Å²	101	46%	0.459	63%	0.626	S	S	.	*			trans	-61.2	122.9	156.5	-50.8	0	0	0	0	107.5	W830	C777-W830 HydrophobicContact CB-CZ2 4.33Å; C777-W830 WeakPolarHBondContact O-CH2 3.43Å; C777-W830 WeakPolarHBondContact O-CZ2 3.36Å
778	S	44.6	Very low	35.3	Very low	69 Å²	69	104.3 Å²	104.3	48%	0.483	64%	0.635	S	S	.	*			trans	-65	138.7	172.3	170.3	0	0	0	0	110.1	N776 Y780	N776-S778 PolarHBondContact O-N 3Å; S778-Y780 WeakPolarHBondContact CB-O 3.39Å; S778-Y780 PolarHBondContact O-N 2.96Å; S778-Y780 PolarHBondContact OG-N 2.87Å; S778-Y780 PolarHBondContact OG-O 2.7Å
779	A	39.2	Very low	35.5	Very low	39 Å²	39	105.4 Å²	105.4	32%	0.322	64%	0.641	S	S	.	*	S	Bend	trans	-64.4	-20.1	168.4	0	0	0	0	0	112.3	W830	A779-W830 HydrophobicContact CB-CD2 3.71Å; A779-W830 HydrophobicContact CB-CE3 4.09Å; A779-W830 HydrophobicContact CB-CG 3.88Å
780	Y	41	Very low	35.6	Very low	89 Å²	89	103.1 Å²	103.1	35%	0.349	64%	0.643	S	S	.	*	S	Bend	trans	-99.7	128.7	178.7	-54.2	-83.4	0	0	0	111	I728 S778 T782 F959 Y968	I728-Y780 HydrophobicContact CD1-CE2 4.33Å; I728-Y780 WeakPolarHBondContact CD1-OH 3.18Å; S778-Y780 WeakPolarHBondContact CB-O 3.39Å; S778-Y780 PolarHBondContact O-N 2.96Å; S778-Y780 PolarHBondContact OG-N 2.87Å; S778-Y780 PolarHBondContact OG-O 2.7Å; Y780-T782 PolarHBondContact O-N 2.85Å; Y780-T782 PolarHBondContact O-OG1 3.03Å; Y780-F959 HydrophobicContact CE1-CE2 4.01Å; Y780-F959 AromaticContact CZ-CD2 3.87Å; Y780-F959 AromaticContact CZ-CE2 3.68Å; Y780-F959 WeakPolarHBondContact OH-CD2 3.31Å; Y780-F959 WeakPolarHBondContact OH-CE2 3.4Å; Y780-Y968 WeakPolarHBondContact CD2-OH 3.35Å; Y780-Y968 HydrophobicContact CE2-CE1 4.02Å; Y780-Y968 VanDerWaalsContact CE2-OH 3.22Å; Y780-Y968 WeakPolarHBondContact CE2-OH 3.29Å
781	V	38.6	Very low	35.6	Very low	115 Å²	115	105.2 Å²	105.2	70%	0.697	66%	0.657	S	S	*	*			trans	-61.1	105.9	169.6	-176.7	0	0	0	0	108.5	F783	V781-F783 HydrophobicContact CB-CE2 4.31Å; V781-F783 HydrophobicContact CG1-CD1 4.45Å; V781-F783 HydrophobicContact CG1-CD2 4.07Å; V781-F783 HydrophobicContact CG1-CE1 4.02Å; V781-F783 HydrophobicContact CG1-CE2 3.61Å; V781-F783 HydrophobicContact CG1-CG 4.48Å; V781-F783 HydrophobicContact CG1-CZ 3.58Å
782	T	38	Very low	35.6	Very low	97 Å²	97	106.7 Å²	106.7	60%	0.595	65%	0.653	S	S	*	*			trans	-93.7	104.1	177	-50.7	0	0	0	0	107.4	Y780 P784	Y780-T782 PolarHBondContact O-N 2.85Å; Y780-T782 PolarHBondContact O-OG1 3.03Å; T782-P784 WeakPolarHBondContact O-CD 3.49Å
783	F	34.8	Very low	35.2	Very low	169 Å²	169	108.6 Å²	108.6	74%	0.741	66%	0.657	S	S	*	*			trans	-76.7	112	172.8	-67.3	-79.6	0	0	0	109	V781 S785	V781-F783 HydrophobicContact CB-CE2 4.31Å; V781-F783 HydrophobicContact CG1-CD1 4.45Å; V781-F783 HydrophobicContact CG1-CD2 4.07Å; V781-F783 HydrophobicContact CG1-CE1 4.02Å; V781-F783 HydrophobicContact CG1-CE2 3.61Å; V781-F783 HydrophobicContact CG1-CG 4.48Å; V781-F783 HydrophobicContact CG1-CZ 3.58Å; F783-S785 PolarHBondContact O-N 2.92Å
784	P	33.2	Very low	34.9	Very low	110 Å²	110	111.9 Å²	111.9	71%	0.714	68%	0.68	S	S	*	*			trans	-69.2	119	174.2	28.8	-32.7	0	0	0	108.8	T782 P786	T782-P784 WeakPolarHBondContact O-CD 3.49Å; P784-P786 VanDerWaalsContact O-CD 3.3Å; P784-P786 WeakPolarHBondContact O-CD 3.48Å
785	S	31.5	Very low	34.9	Very low	102 Å²	102	112.9 Å²	112.9	71%	0.713	67%	0.669	S	S	*	*			trans	-67.4	119	164.6	-178.3	0	0	0	0	108.1	F783 L787	F783-S785 PolarHBondContact O-N 2.92Å; S785-L787 PolarHBondContact O-N 3.31Å; S785-L787 VanDerWaalsContact O-N 3.09Å
786	P	32	Very low	34.6	Very low	117 Å²	117	112.6 Å²	112.6	76%	0.76	68%	0.676	S	S	*	*			trans	-69.4	110.3	176.1	27.3	-31.9	0	0	0	109	P784 Q788	P784-P786 VanDerWaalsContact O-CD 3.3Å; P784-P786 WeakPolarHBondContact O-CD 3.48Å; P786-Q788 PolarHBondContact O-N 2.83Å
787	L	31.1	Very low	34	Very low	173 Å²	173	117.1 Å²	117.1	91%	0.906	70%	0.7	S	S	*	*			trans	-66	99.9	177.1	-76.7	157.6	0	0	0	110.5	S785	S785-L787 PolarHBondContact O-N 3.31Å; S785-L787 VanDerWaalsContact O-N 3.09Å
788	Q	30.7	Very low	33.6	Very low	174 Å²	174	119.6 Å²	119.6	81%	0.813	71%	0.712	S	S	*	*			trans	-119.2	130.2	153.8	-75.4	-157.8	-6.4	0	0	110.3	P786 G790	P786-Q788 PolarHBondContact O-N 2.83Å; Q788-G790 PolarHBondContact O-N 3.06Å
789	P	35	Very low	32.8	Very low	140 Å²	140	120.8 Å²	120.8	91%	0.909	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	115.9	-180	30.5	-32.5	0	0	0	110.6
790	G	35.2	Very low	32.4	Very low	86 Å²	86	121.4 Å²	121.4	89%	0.887	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	137.1	-8.7	165.9	0	0	0	0	0	117.3	Q788	Q788-G790 PolarHBondContact O-N 3.06Å
791	S	30.9	Very low	31.9	Very low	111 Å²	111	122.1 Å²	122.1	78%	0.776	74%	0.741	S	S	*	*			trans	-102	135.3	178.6	-167.7	0	0	0	0	112.1	S793	S791-S793 PolarHBondContact O-N 3.31Å
792	M	32.8	Very low	31.8	Very low	180 Å²	180	121.3 Å²	121.3	89%	0.887	75%	0.747	S	S	*	*			trans	-61	130.2	170.8	-78.4	-70.3	171	0	0	109.7	S794	M792-S794 PolarHBondContact O-N 3.19Å
793	S	27.3	Very low	31.5	Very low	102 Å²	102	122.3 Å²	122.3	71%	0.713	76%	0.756	S	S	*	*			trans	-61.5	108.4	-174	52.7	0	0	0	0	111.6	S791 E795	S791-S793 PolarHBondContact O-N 3.31Å; S793-E795 PolarHBondContact O-N 3.48Å
794	S	28.4	Very low	31.5	Very low	115 Å²	115	118.5 Å²	118.5	80%	0.804	75%	0.751	S	S	*	*			trans	-70.2	118.3	171.8	-165	0	0	0	0	109.7	M792 T796	M792-S794 PolarHBondContact O-N 3.19Å; S794-T796 PolarHBondContact O-N 2.89Å
795	E	33.1	Very low	31.8	Very low	115 Å²	115	121.9 Å²	121.9	54%	0.537	76%	0.757	S	S	.	*			trans	-73.2	121.7	-176.1	-56	-175.3	170.3	0	0	110	S793 L797 R931	S793-E795 PolarHBondContact O-N 3.48Å; E795-L797 PolarHBondContact O-N 3Å; E795-R931 IonicContact OE1-CZ 3.15Å; E795-R931 IonicContact OE1-NH1 2.69Å; E795-R931 PolarHBondContact OE1-NH1 3.03Å; E795-R931 IonicContact OE1-NH2 2.76Å; E795-R931 PolarHBondContact OE1-NH2 3.41Å; E795-R931 IonicContact OE2-CZ 3.93Å; E795-R931 IonicContact OE2-NH2 2.75Å; E795-R931 PolarHBondContact OE2-NH2 2.92Å
796	T	30.2	Very low	32.7	Very low	131 Å²	131	120.8 Å²	120.8	80%	0.804	75%	0.748	S	S	*	*			trans	-91.8	101.5	171.4	-45.1	0	0	0	0	109.1	S794 V798	S794-T796 PolarHBondContact O-N 2.89Å; T796-V798 PolarHBondContact O-N 3.37Å
797	L	28.2	Very low	33.9	Very low	157 Å²	157	119 Å²	119	82%	0.822	74%	0.738	S	S	*	*			trans	-64.8	101.2	171.1	-101.4	154.4	0	0	0	109.7	E795 S799	E795-L797 PolarHBondContact O-N 3Å; L797-S799 PolarHBondContact O-N 3.21Å
798	V	31	Very low	35.8	Very low	120 Å²	120	118 Å²	118	73%	0.727	72%	0.722	S	S	*	*			trans	-75.9	100.8	163.4	-178.1	0	0	0	0	107	T796	T796-V798 PolarHBondContact O-N 3.37Å
799	S	26.5	Very low	38.4	Very low	95 Å²	95	110.4 Å²	110.4	66%	0.664	69%	0.688	S	S	*	*			trans	-50.8	145.5	169.2	-61	0	0	0	0	110.1	L797 P801	L797-S799 PolarHBondContact O-N 3.21Å; S799-P801 WeakPolarHBondContact O-CD 3.4Å
800	A	30.8	Very low	40.9	Very low	52 Å²	52	105.6 Å²	105.6	43%	0.43	66%	0.656	S	S	.	*			trans	-107.7	52.8	-172.1	0	0	0	0	0	115.2	A802	A800-A802 PolarHBondContact O-N 2.95Å
801	P	31.4	Very low	43.5	Very low	103 Å²	103	107.6 Å²	107.6	67%	0.669	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-69.5	-14.8	167.3	32.5	-31.1	0	0	0	111.7	S799 S804	S799-P801 WeakPolarHBondContact O-CD 3.4Å; P801-S804 PolarHBondContact O-OG 3.24Å
802	A	34.9	Very low	46.2	Very low	98 Å²	98	102.8 Å²	102.8	81%	0.81	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-86.6	6.3	-177	0	0	0	0	0	115.6	A800	A800-A802 PolarHBondContact O-N 2.95Å
803	C	33.3	Very low	48.7	Very low	118 Å²	118	96.5 Å²	96.5	80%	0.797	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-124	25.6	174.1	-155.9	0	0	0	0	112.1
804	S	33.3	Very low	51.4	Low	90 Å²	90	92.7 Å²	92.7	63%	0.629	55%	0.552	S	S	*	*	S	Bend	trans	-67.8	165	153.6	47.9	0	0	0	0	109.4	P801	P801-S804 PolarHBondContact O-OG 3.24Å
805	Q	39.8	Very low	53.6	Low	180 Å²	180	91.9 Å²	91.9	84%	0.841	54%	0.535	S	S	*	.	S	Bend	trans	-45.9	137.9	-178.7	-71.1	177.5	-28.3	0	0	111.2	S807	Q805-S807 PolarHBondContact O-N 3.11Å
806	P	50.1	Low	55.5	Low	80 Å²	80	90.1 Å²	90.1	52%	0.519	55%	0.548	S	S	.	.			trans	-56.1	113.2	-178.5	22.7	-32.7	0	0	0	109.2	R808	P806-R808 PolarHBondContact O-N 3Å
807	S	57.9	Low	58.1	Low	79 Å²	79	85.9 Å²	85.9	55%	0.552	53%	0.53	S	S	*	.			trans	-61.2	115	175.8	175.6	0	0	0	0	107.5	Q805 V809	Q805-S807 PolarHBondContact O-N 3.11Å; S807-V809 WeakPolarHBondContact CB-O 3.45Å; S807-V809 PolarHBondContact O-N 3.22Å; S807-V809 PolarHBondContact OG-N 2.86Å; S807-V809 PolarHBondContact OG-O 2.89Å
808	R	71.4	Confident	61.1	Low	151 Å²	151	80.4 Å²	80.4	57%	0.57	50%	0.503	S	S	*	.	S	Bend	trans	-58.6	-16.7	176.9	-74.7	-174	168.6	-170.3	-7.5	113.1	A749 P753 P806	A749-R808 WeakPolarHBondContact CA-O 3.36Å; P753-R808 HydrophobicContact CG-CG 4.3Å; P806-R808 PolarHBondContact O-N 3Å
809	V	85.6	Confident	64.1	Low	15 Å²	15	74.7 Å²	74.7	9%	0.091	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.6	172.6	178.8	0	0	0	0	110.4	Q510 L511 R747 V748 A749 S807	Q510-V809 HydrophobicContact CB-CG2 4.37Å; L511-V809 HydrophobicContact CD2-CB 4.28Å; L511-V809 HydrophobicContact CD2-CG1 3.56Å; L511-V809 HydrophobicContact CD2-CG2 3.83Å; L511-V809 HydrophobicContact CG-CG2 4.21Å; R747-V809 HydrophobicContact CB-CG1 4.1Å; R747-V809 HydrophobicContact CG-CG1 4.35Å; V748-V809 WeakPolarHBondContact O-CA 3.43Å; A749-V809 HydrophobicContact CB-CG2 4.28Å; S807-V809 WeakPolarHBondContact CB-O 3.45Å; S807-V809 PolarHBondContact O-N 3.22Å; S807-V809 PolarHBondContact OG-N 2.86Å; S807-V809 PolarHBondContact OG-O 2.89Å
810	T	87.6	Confident	67.3	Low	40 Å²	40	74.9 Å²	74.9	25%	0.245	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133	171.3	-60.6	0	0	0	0	110	R747 V748 F758	R747-T810 WeakPolarHBondContact CA-O 3.48Å; V748-T810 PolarHBondContact N-O 2.89Å; V748-T810 PolarHBondContact O-N 3.19Å; F758-T810 HydrophobicContact CD2-CG2 4.43Å
811	E	88.1	Confident	70.3	Confident	127 Å²	127	75.2 Å²	75.2	59%	0.593	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	136.9	169.9	-61.2	-160.8	128.1	0	0	110.5	R747	R747-E811 HydrophobicContact CG-CG 4.14Å; R747-E811 IonicContact CZ-OE1 3.79Å; R747-E811 IonicContact NE-OE1 2.93Å; R747-E811 PolarHBondContact NE-OE1 2.69Å; R747-E811 IonicContact NH2-OE1 2.77Å; R747-E811 PolarHBondContact NH2-OE1 3.11Å
812	I	89.3	Confident	73.1	Confident	11 Å²	11	73.6 Å²	73.6	6%	0.056	46%	0.459	C	S	.	.			trans	-90.9	122.7	-177.5	-65.4	171.9	0	0	0	108.8	F735 L746 V748 F758 I814 L827 F846	F735-I812 HydrophobicContact CD2-CG2 4.47Å; F735-I812 HydrophobicContact CE1-CD1 3.8Å; F735-I812 HydrophobicContact CE2-CG2 3.89Å; F735-I812 HydrophobicContact CZ-CD1 3.69Å; F735-I812 HydrophobicContact CZ-CG2 4.01Å; L746-I812 HydrophobicContact CB-CB 4.37Å; L746-I812 HydrophobicContact CD1-CD1 4.19Å; L746-I812 HydrophobicContact CD2-CB 3.85Å; L746-I812 HydrophobicContact CD2-CD1 3.91Å; L746-I812 HydrophobicContact CD2-CG1 4.44Å; L746-I812 HydrophobicContact CD2-CG2 3.68Å; L746-I812 HydrophobicContact CG-CB 3.84Å; L746-I812 HydrophobicContact CG-CD1 3.69Å; L746-I812 HydrophobicContact CG-CG1 4.23Å; L746-I812 HydrophobicContact CG-CG2 4.26Å; L746-I812 PolarHBondContact O-N 3.4Å; V748-I812 HydrophobicContact CB-CD1 4.01Å; V748-I812 HydrophobicContact CG1-CD1 3.99Å; V748-I812 HydrophobicContact CG1-CG1 4.17Å; F758-I812 HydrophobicContact CD2-CG1 4.01Å; F758-I812 HydrophobicContact CE2-CD1 4.01Å; F758-I812 HydrophobicContact CE2-CG1 3.61Å; F758-I812 HydrophobicContact CZ-CD1 4.03Å; F758-I812 HydrophobicContact CZ-CG1 4.05Å; I812-I814 VanDerWaalsContact C-N 3.33Å; I812-I814 PolarHBondContact O-N 3.41Å; I812-L827 HydrophobicContact CG2-CD1 3.53Å; I812-F846 HydrophobicContact CD1-CD1 3.76Å; I812-F846 HydrophobicContact CD1-CE1 4.05Å
813	P	83.8	Confident	75.8	Confident	48 Å²	48	73.1 Å²	73.1	31%	0.312	44%	0.44	S	S	.	.			trans	-78	76.2	-169.3	31.5	-36.7	0	0	0	112.8	F758 L827	F758-P813 HydrophobicContact CB-CG 4.04Å; P813-L827 HydrophobicContact CG-CD1 4.17Å
814	I	84.1	Confident	78.6	Confident	21 Å²	21	70.3 Å²	70.3	11%	0.108	42%	0.422	C	S	.	.			trans	-77.4	129.7	170	-53.1	178.3	0	0	0	109.8	L743 L746 I812 G816 G817 L819	L743-I814 HydrophobicContact CD1-CD1 4.3Å; L746-I814 HydrophobicContact CB-CD1 3.7Å; L746-I814 HydrophobicContact CD2-CD1 3.7Å; L746-I814 HydrophobicContact CD2-CG1 4.18Å; L746-I814 HydrophobicContact CG-CD1 4.33Å; I812-I814 VanDerWaalsContact C-N 3.33Å; I812-I814 PolarHBondContact O-N 3.41Å; I814-G816 PolarHBondContact O-N 2.93Å; I814-G817 PolarHBondContact O-N 2.94Å; I814-G817 VanDerWaalsContact O-N 3.09Å; I814-L819 HydrophobicContact CD1-CB 4.37Å
815	H	74.8	Confident	81.3	Confident	98 Å²	98	66.6 Å²	66.6	45%	0.454	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	121.3	170.7	-83.7	-86.5	0	0	0	111.3	Q761 G817	Q761-H815 VanDerWaalsContact CB-NE2 3.33Å; Q761-H815 WeakPolarHBondContact CB-NE2 3.4Å; Q761-H815 PolarHBondContact OE1-CD2 2.92Å; H815-G817 VanDerWaalsContact C-N 3.3Å; H815-G817 PolarHBondContact O-N 3.42Å
816	G	74.6	Confident	83.8	Confident	79 Å²	79	63 Å²	63	81%	0.814	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	0.9	-177	0	0	0	0	0	115.2	I814 T818	I814-G816 PolarHBondContact O-N 2.93Å; G816-T818 PolarHBondContact O-N 3.24Å
817	G	84.1	Confident	85.7	Confident	41 Å²	41	59.1 Å²	59.1	42%	0.423	35%	0.349	S	S	.	.	S	Bend	trans	69.2	-2.3	173.7	0	0	0	0	0	116.5	I814 H815	I814-G817 PolarHBondContact O-N 2.94Å; I814-G817 VanDerWaalsContact O-N 3.09Å; H815-G817 VanDerWaalsContact C-N 3.3Å; H815-G817 PolarHBondContact O-N 3.42Å
818	T	91.5	Very high	87.1	Confident	43 Å²	43	56.5 Å²	56.5	26%	0.264	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	138.4	-177.6	-55.1	0	0	0	0	109.4	A742 L743 G816 T851	A742-T818 HydrophobicContact CB-CG2 3.86Å; L743-T818 CarbonylContact O-C 3.28Å; L743-T818 VanDerWaalsContact O-CA 3.3Å; L743-T818 WeakPolarHBondContact O-CA 3.48Å; L743-T818 WeakPolarHBondContact O-CG2 3.43Å; G816-T818 PolarHBondContact O-N 3.24Å; T818-T851 HydrophobicContact CG2-CG2 3.87Å
819	L	92.8	Very high	87.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.3	176.2	-173.1	72.9	0	0	0	109.1	N737 L743 I814 Q823 V825	N737-L819 HydrophobicContact CB-CD2 3.97Å; N737-L819 HydrophobicContact CB-CG 4.09Å; N737-L819 PolarHBondContact ND2-O 3.07Å; L743-L819 HydrophobicContact CD1-CB 3.7Å; L743-L819 HydrophobicContact CD1-CD2 4.31Å; L743-L819 HydrophobicContact CD2-CD2 4.33Å; L743-L819 HydrophobicContact CG-CB 3.9Å; L743-L819 HydrophobicContact CG-CD2 4.43Å; L743-L819 PolarHBondContact N-O 3.42Å; L743-L819 PolarHBondContact O-N 2.89Å; I814-L819 HydrophobicContact CD1-CB 4.37Å; L819-Q823 HydrophobicContact CD1-CB 3.85Å; L819-Q823 HydrophobicContact CD1-CG 3.65Å; L819-Q823 HydrophobicContact CG-CB 4.16Å; L819-Q823 HydrophobicContact CG-CG 4.5Å; L819-V825 HydrophobicContact CD1-CB 4.02Å; L819-V825 HydrophobicContact CD1-CG1 3.88Å; L819-V825 HydrophobicContact CD2-CG1 4.16Å
820	Q	94.3	Very high	87.9	Confident	99 Å²	99	50.5 Å²	50.5	46%	0.463	31%	0.306	S	S	.	.			trans	-73.4	160.5	-171.4	-63.4	-60	-26.1	0	0	112.5	N737 G822 Q823	N737-Q820 WeakPolarHBondContact CB-O 3.42Å; N737-Q820 PolarHBondContact ND2-O 3.18Å; Q820-G822 PolarHBondContact O-N 2.96Å; Q820-Q823 HydrophobicContact CB-CB 4.24Å; Q820-Q823 WeakPolarHBondContact O-CB 3.48Å; Q820-Q823 PolarHBondContact O-N 2.95Å
821	P	93.4	Very high	87.8	Confident	59 Å²	59	48.7 Å²	48.7	38%	0.383	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	129.9	172.4	-30.8	38.3	0	0	0	112.7	S739 A740 Q823	S739-P821 WeakPolarHBondContact O-CA 3.47Å; S739-P821 WeakPolarHBondContact O-CB 3.23Å; A740-P821 VanDerWaalsContact O-CG 3.32Å; A740-P821 WeakPolarHBondContact O-CG 3.36Å; P821-Q823 PolarHBondContact O-N 2.97Å
822	G	90.1	Very high	87.7	Confident	69 Å²	69	44.7 Å²	44.7	71%	0.711	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	-1.8	-178.3	0	0	0	0	0	115.9	N737 Q820	N737-G822 CarbonylContact O-C 3.44Å; N737-G822 WeakPolarHBondContact O-CA 3.41Å; N737-G822 PolarHBondContact O-N 2.92Å; Q820-G822 PolarHBondContact O-N 2.96Å
823	Q	92.3	Very high	87.3	Confident	88 Å²	88	44.2 Å²	44.2	41%	0.411	27%	0.271	S	S	.	.			trans	-82.7	139.5	-178.6	-165.4	-175.7	0.4	0	0	111.4	N737 L819 Q820 P821	N737-Q823 PolarHBondContact N-O 3.18Å; L819-Q823 HydrophobicContact CD1-CB 3.85Å; L819-Q823 HydrophobicContact CD1-CG 3.65Å; L819-Q823 HydrophobicContact CG-CB 4.16Å; L819-Q823 HydrophobicContact CG-CG 4.5Å; Q820-Q823 HydrophobicContact CB-CB 4.24Å; Q820-Q823 WeakPolarHBondContact O-CB 3.48Å; Q820-Q823 PolarHBondContact O-N 2.95Å; P821-Q823 PolarHBondContact O-N 2.97Å
824	S	91.6	Very high	87.4	Confident	59 Å²	59	42.7 Å²	42.7	41%	0.413	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	151.7	166.2	79.8	0	0	0	0	112.9	E734 F735 C736	E734-S824 PolarHBondContact OE1-OG 2.98Å; F735-S824 CarbonylContact O-C 3.52Å; F735-S824 VanDerWaalsContact O-CA 3.23Å; F735-S824 WeakPolarHBondContact O-CA 3.39Å; C736-S824 WeakPolarHBondContact SG-CB 3.3Å
825	V	91.4	Very high	87.2	Confident	11 Å²	11	46.7 Å²	46.7	7%	0.067	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	121.5	173.4	61.6	0	0	0	0	109.7	E734 F735 L819 L827	E734-V825 WeakPolarHBondContact CA-O 3.41Å; F735-V825 HydrophobicContact CB-CG1 3.95Å; F735-V825 HydrophobicContact CD2-CG1 4.38Å; F735-V825 PolarHBondContact N-O 3.46Å; F735-V825 PolarHBondContact O-N 3.37Å; L819-V825 HydrophobicContact CD1-CB 4.02Å; L819-V825 HydrophobicContact CD1-CG1 3.88Å; L819-V825 HydrophobicContact CD2-CG1 4.16Å; V825-L827 HydrophobicContact CG2-CD2 4.15Å; V825-L827 HydrophobicContact CG2-CG 4.34Å
826	R	91.3	Very high	87.7	Confident	104 Å²	104	49.2 Å²	49.2	39%	0.392	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.4	175.7	-175.8	175.4	172	174.8	-0.3	110.5	Y732 V733 E734 Q761	Y732-R826 HydrophobicContact CD1-CG 4.13Å; Y732-R826 VanDerWaalsContact CD1-NE 3.34Å; Y732-R826 VanDerWaalsContact CD2-NH2 3.29Å; Y732-R826 VanDerWaalsContact CG-NH2 3.31Å; V733-R826 CarbonylContact O-C 3.49Å; V733-R826 WeakPolarHBondContact O-CA 3.26Å; E734-R826 HydrophobicContact CB-CB 4.5Å; Q761-R826 PolarHBondContact NE2-O 3.42Å
827	L	90.1	Very high	88.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	144.6	178.4	-62.2	179.3	0	0	0	110.7	Y732 V733 F735 F758 Q761 I812 P813 V825	Y732-L827 WeakPolarHBondContact CA-O 3.34Å; V733-L827 PolarHBondContact N-O 3.26Å; V733-L827 PolarHBondContact O-N 3.09Å; F735-L827 HydrophobicContact CD2-CD1 4.47Å; F735-L827 HydrophobicContact CE2-CD1 4.13Å; F758-L827 HydrophobicContact CD1-CB 4.34Å; F758-L827 HydrophobicContact CD1-CD1 4.4Å; Q761-L827 HydrophobicContact CG-CD2 4.12Å; I812-L827 HydrophobicContact CG2-CD1 3.53Å; P813-L827 HydrophobicContact CG-CD1 4.17Å; V825-L827 HydrophobicContact CG2-CD2 4.15Å; V825-L827 HydrophobicContact CG2-CG 4.34Å
828	P	87.8	Confident	88.5	Confident	24 Å²	24	50 Å²	50	16%	0.156	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.3	167.5	30.5	-32.1	0	0	0	109.7	Y732 G759	Y732-P828 HydrophobicContact CD1-CB 4.4Å; Y732-P828 HydrophobicContact CE1-CB 4.26Å; G759-P828 PolarHBondContact N-O 2.85Å
829	L	88.5	Confident	88.6	Confident	2 Å²	2	53 Å²	53	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	125.4	174.6	178.7	67.1	0	0	0	108.5	F719 A731 V733 F756 F758 L831	F719-L829 HydrophobicContact CD2-CD2 4.37Å; F719-L829 HydrophobicContact CE2-CD2 3.77Å; A731-L829 HydrophobicContact CB-CB 4.48Å; A731-L829 PolarHBondContact N-O 3.35Å; A731-L829 PolarHBondContact O-N 2.76Å; A731-L829 VanDerWaalsContact O-O 3.1Å; V733-L829 HydrophobicContact CG2-CB 3.96Å; V733-L829 HydrophobicContact CG2-CD2 3.58Å; V733-L829 HydrophobicContact CG2-CG 4.31Å; F756-L829 HydrophobicContact CB-CD1 3.99Å; F756-L829 HydrophobicContact CD2-CD1 3.85Å; F756-L829 HydrophobicContact CG-CD1 4.35Å; F758-L829 HydrophobicContact CD1-CD1 3.97Å; F758-L829 HydrophobicContact CE1-CD1 3.76Å; F758-L829 HydrophobicContact CG-CD1 4.48Å; F758-L829 HydrophobicContact CZ-CD1 4.1Å; L829-L831 HydrophobicContact CD1-CD2 4.34Å; L829-L831 HydrophobicContact CD2-CD1 4.49Å; L829-L831 HydrophobicContact CD2-CD2 3.63Å; L829-L831 HydrophobicContact CD2-CG 4.2Å; L829-L831 HydrophobicContact CG-CD2 3.75Å; L829-L831 HydrophobicContact CG-CG 4.16Å
830	W	85.6	Confident	88.5	Confident	37 Å²	37	54.6 Å²	54.6	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.9	171.6	-66.5	101.2	0	0	0	109	I728 K730 F756 T757 C777 A779	I728-W830 HydrophobicContact CG2-CE3 3.82Å; I728-W830 HydrophobicContact CG2-CZ3 4.43Å; K730-W830 HydrophobicContact CB-CE3 3.92Å; K730-W830 HydrophobicContact CB-CH2 3.7Å; K730-W830 HydrophobicContact CB-CZ2 4.34Å; K730-W830 HydrophobicContact CB-CZ3 3.49Å; K730-W830 VanDerWaalsContact CB-CZ3 3.49Å; K730-W830 HydrophobicContact CD-CH2 3.76Å; K730-W830 HydrophobicContact CD-CZ2 3.89Å; K730-W830 HydrophobicContact CD-CZ3 4.42Å; K730-W830 HydrophobicContact CG-CD2 4.36Å; K730-W830 HydrophobicContact CG-CE3 4.22Å; K730-W830 HydrophobicContact CG-CH2 3.72Å; K730-W830 HydrophobicContact CG-CZ2 3.86Å; K730-W830 HydrophobicContact CG-CZ3 3.93Å; F756-W830 CarbonylContact C-O 3.48Å; F756-W830 WeakPolarHBondContact CA-O 3.07Å; F756-W830 WeakPolarHBondContact CB-O 3.34Å; T757-W830 HydrophobicContact CG2-CB 3.9Å; T757-W830 PolarHBondContact N-O 2.88Å; T757-W830 PolarHBondContact O-N 2.94Å; C777-W830 HydrophobicContact CB-CZ2 4.33Å; C777-W830 WeakPolarHBondContact O-CH2 3.43Å; C777-W830 WeakPolarHBondContact O-CZ2 3.36Å; A779-W830 HydrophobicContact CB-CD2 3.71Å; A779-W830 HydrophobicContact CB-CE3 4.09Å; A779-W830 HydrophobicContact CB-CG 3.88Å
831	L	84.6	Confident	88.5	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136	-177.5	-61.5	176.8	0	0	0	109.5	F719 P720 L723 I728 R729 A731 F755 F756 L829	F719-L831 HydrophobicContact CD1-CD1 4.36Å; F719-L831 HydrophobicContact CD2-CD1 3.96Å; F719-L831 HydrophobicContact CE1-CD1 4.04Å; F719-L831 HydrophobicContact CE2-CD1 3.66Å; F719-L831 HydrophobicContact CE2-CD2 4.18Å; F719-L831 HydrophobicContact CG-CD1 4.33Å; F719-L831 HydrophobicContact CZ-CD1 3.71Å; F719-L831 HydrophobicContact CZ-CD2 4.16Å; P720-L831 HydrophobicContact CG-CD1 3.7Å; L723-L831 HydrophobicContact CD1-CB 4.49Å; I728-L831 CarbonylContact C-O 3.6Å; I728-L831 VanDerWaalsContact CA-O 3.31Å; I728-L831 WeakPolarHBondContact CA-O 3.42Å; R729-L831 PolarHBondContact N-O 3.01Å; R729-L831 PolarHBondContact O-N 3.11Å; A731-L831 HydrophobicContact CB-CD1 3.99Å; F755-L831 HydrophobicContact CD1-CD2 4.04Å; F755-L831 HydrophobicContact CE1-CD2 3.53Å; F755-L831 HydrophobicContact CE1-CG 4.44Å; F755-L831 HydrophobicContact CZ-CB 4.29Å; F755-L831 HydrophobicContact CZ-CD2 4.09Å; F755-L831 CarbonylContact O-C 3.58Å; F755-L831 WeakPolarHBondContact O-CA 3.37Å; F756-L831 HydrophobicContact CB-CD2 3.78Å; L829-L831 HydrophobicContact CD1-CD2 4.34Å; L829-L831 HydrophobicContact CD2-CD1 4.49Å; L829-L831 HydrophobicContact CD2-CD2 3.63Å; L829-L831 HydrophobicContact CD2-CG 4.2Å; L829-L831 HydrophobicContact CG-CD2 3.75Å; L829-L831 HydrophobicContact CG-CG 4.16Å
832	R	84.9	Confident	88.4	Confident	44 Å²	44	50.8 Å²	50.8	17%	0.166	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.5	179.1	-179.3	-179.3	-177.8	-92.3	-10.6	109.9	E727 I728 F755 D835 F959	E727-R832 CarbonylContact O-C 3.57Å; E727-R832 VanDerWaalsContact O-CA 3.3Å; E727-R832 WeakPolarHBondContact O-CA 3.48Å; I728-R832 HydrophobicContact CG1-CB 4.48Å; I728-R832 HydrophobicContact CG1-CG 4.45Å; F755-R832 WeakPolarHBondContact CD2-O 3.33Å; F755-R832 VanDerWaalsContact CE2-O 3.26Å; F755-R832 WeakPolarHBondContact CE2-O 3.11Å; F755-R832 PolarHBondContact O-N 3.27Å; R832-D835 IonicContact CZ-OD1 3.64Å; R832-D835 IonicContact CZ-OD2 2.87Å; R832-D835 IonicContact NH1-OD1 2.78Å; R832-D835 PolarHBondContact NH1-OD1 3.31Å; R832-D835 IonicContact NH1-OD2 3.62Å; R832-D835 PolarHBondContact NH1-OD2 3.23Å; R832-D835 IonicContact NH2-OD1 3.9Å; R832-D835 PolarHBondContact NH2-OD1 3.02Å; R832-D835 IonicContact NH2-OD2 3.9Å; R832-D835 PolarHBondContact NH2-OD2 2.94Å; R832-F959 PolarHBondContact NH2-O 2.96Å
833	G	81.4	Confident	88.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.245	C	C	.	.			trans	-56.2	133.3	176.8	0	0	0	0	0	112.1	G726 E727	G726-G833 WeakPolarHBondContact CA-O 3.47Å; G726-G833 PolarHBondContact N-O 2.88Å; E727-G833 PolarHBondContact O-N 3.43Å
834	P	85.5	Confident	88.7	Confident	16 Å²	16	43.6 Å²	43.6	10%	0.104	23%	0.226	C	C	.	.			trans	-53.8	145.2	177.1	-27.8	35.7	0	0	0	113	C725 F755 Q836 H840 A870	C725-P834 VanDerWaalsContact CA-O 3.23Å; C725-P834 WeakPolarHBondContact CA-O 3.21Å; C725-P834 VanDerWaalsContact CB-O 3.31Å; C725-P834 WeakPolarHBondContact CB-O 3.19Å; C725-P834 PolarHBondContact SG-O 3.02Å; F755-P834 HydrophobicContact CD2-CG 4.44Å; P834-Q836 VanDerWaalsContact C-N 3.26Å; P834-Q836 PolarHBondContact O-N 2.82Å; P834-H840 HydrophobicContact CG-CB 4.04Å; P834-A870 HydrophobicContact CB-CB 4.18Å; P834-A870 HydrophobicContact CG-CB 4.32Å
835	D	81.9	Confident	88.9	Confident	106 Å²	106	40.9 Å²	40.9	57%	0.567	21%	0.207	S	C	*	.	S	Bend	trans	-71.7	-18	-175.8	-69	-65.1	0	0	0	114.3	R832	R832-D835 IonicContact CZ-OD1 3.64Å; R832-D835 IonicContact CZ-OD2 2.87Å; R832-D835 IonicContact NH1-OD1 2.78Å; R832-D835 PolarHBondContact NH1-OD1 3.31Å; R832-D835 IonicContact NH1-OD2 3.62Å; R832-D835 PolarHBondContact NH1-OD2 3.23Å; R832-D835 IonicContact NH2-OD1 3.9Å; R832-D835 PolarHBondContact NH2-OD1 3.02Å; R832-D835 IonicContact NH2-OD2 3.9Å; R832-D835 PolarHBondContact NH2-OD2 2.94Å
836	Q	84.2	Confident	89.1	Confident	150 Å²	150	40.4 Å²	40.4	70%	0.701	20%	0.204	S	C	*	.	S	Bend	trans	-104.3	145.5	177.5	-61.1	-178.8	19.7	0	0	110.1	P834 H840 A870	P834-Q836 VanDerWaalsContact C-N 3.26Å; P834-Q836 PolarHBondContact O-N 2.82Å; Q836-H840 PolarHBondContact O-NE2 2.76Å; Q836-A870 VanDerWaalsContact O-CB 3.28Å; Q836-A870 WeakPolarHBondContact O-CB 3.23Å
837	E	86.5	Confident	89.3	Confident	102 Å²	102	35.5 Å²	35.5	48%	0.477	19%	0.186	S	C	.	.	S	Bend	trans	-70.4	156	173.7	70.6	-173.9	147.4	0	0	112	A870 R872	E837-A870 CarbonylContact C-O 3.53Å; E837-A870 VanDerWaalsContact CA-O 3.27Å; E837-A870 WeakPolarHBondContact CA-O 3.41Å; E837-R872 HydrophobicContact CB-CG 4.1Å; E837-R872 IonicContact OE1-CZ 3.58Å; E837-R872 VanDerWaalsContact OE1-CZ 3.32Å; E837-R872 IonicContact OE1-NE 2.73Å; E837-R872 PolarHBondContact OE1-NE 2.9Å; E837-R872 VanDerWaalsContact OE1-NE 3.13Å; E837-R872 IonicContact OE1-NH2 3.61Å; E837-R872 PolarHBondContact OE1-NH2 2.69Å; E837-R872 WeakPolarHBondContact OE2-CD 3.49Å; E837-R872 VanDerWaalsContact OE2-CG 3.22Å; E837-R872 WeakPolarHBondContact OE2-CG 3.35Å; E837-R872 IonicContact OE2-CZ 2.92Å; E837-R872 IonicContact OE2-NE 2.68Å; E837-R872 PolarHBondContact OE2-NE 3.13Å; E837-R872 IonicContact OE2-NH2 3.32Å
838	G	89.3	Confident	89.5	Confident	34 Å²	34	35.9 Å²	35.9	35%	0.351	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	119.5	-170.8	175.3	0	0	0	0	0	113.6	H840 A870	G838-H840 PolarHBondContact O-CD2 3.09Å; G838-H840 VanDerWaalsContact O-CD2 3.3Å; G838-A870 PolarHBondContact N-O 3.24Å; G838-A870 PolarHBondContact O-N 3.22Å
839	V	92.7	Very high	89.8	Confident	107 Å²	107	36.1 Å²	36.1	65%	0.648	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.8	176.9	-178.6	0	0	0	0	109.3	F867 I868	V839-F867 HydrophobicContact CG1-CB 4.2Å; V839-F867 HydrophobicContact CG1-CD1 4.32Å; V839-I868 WeakPolarHBondContact CA-O 3.42Å
840	H	91.6	Very high	90	Very high	33 Å²	33	36.2 Å²	36.2	15%	0.153	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.2	-179.8	-63	-92.2	0	0	0	110	P834 Q836 G838 I842 F867 I868	P834-H840 HydrophobicContact CG-CB 4.04Å; Q836-H840 PolarHBondContact O-NE2 2.76Å; G838-H840 PolarHBondContact O-CD2 3.09Å; G838-H840 VanDerWaalsContact O-CD2 3.3Å; H840-I842 HydrophobicContact CB-CG1 4.43Å; H840-F867 WeakPolarHBondContact O-CA 3.3Å; H840-I868 PolarHBondContact N-O 2.87Å; H840-I868 PolarHBondContact O-N 3.17Å
841	E	93.1	Very high	90.1	Very high	78 Å²	78	37.5 Å²	37.5	36%	0.364	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.7	170.5	-173.5	-174.1	141.9	0	0	109.8	H752 N843 T865 F867	H752-E841 PolarHBondContact CE1-O 3.17Å; E841-N843 PolarHBondContact OE1-ND2 3.16Å; E841-T865 HydrophobicContact CG-CG2 3.66Å; E841-F867 HydrophobicContact CB-CD1 3.98Å; E841-F867 HydrophobicContact CB-CE1 3.75Å; E841-F867 HydrophobicContact CG-CD1 4.12Å; E841-F867 HydrophobicContact CG-CE1 3.56Å; E841-F867 HydrophobicContact CG-CZ 4.05Å
842	I	91.9	Very high	90.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	106.5	-176.4	-53	-176.4	0	0	0	108.7	H752 F755 H840 F844 V866 I868	H752-I842 HydrophobicContact CB-CG2 4.21Å; F755-I842 HydrophobicContact CB-CD1 4.5Å; F755-I842 HydrophobicContact CD1-CD1 3.71Å; F755-I842 HydrophobicContact CD1-CG2 3.98Å; F755-I842 HydrophobicContact CD2-CD1 3.41Å; F755-I842 VanDerWaalsContact CD2-CD1 3.41Å; F755-I842 HydrophobicContact CE1-CD1 3.64Å; F755-I842 HydrophobicContact CE1-CG2 4.34Å; F755-I842 HydrophobicContact CE2-CD1 3.4Å; F755-I842 VanDerWaalsContact CE2-CD1 3.4Å; F755-I842 HydrophobicContact CG-CD1 3.61Å; F755-I842 HydrophobicContact CG-CG2 4.49Å; F755-I842 HydrophobicContact CZ-CD1 3.53Å; H840-I842 HydrophobicContact CB-CG1 4.43Å; I842-F844 HydrophobicContact CB-CE2 4.39Å; I842-F844 HydrophobicContact CG2-CD2 4.32Å; I842-F844 HydrophobicContact CG2-CE2 3.68Å; I842-F844 HydrophobicContact CG2-CZ 3.85Å; I842-V866 PolarHBondContact N-O 3.21Å; I842-V866 PolarHBondContact O-N 2.83Å; I842-I868 HydrophobicContact CD1-CB 4.46Å; I842-I868 HydrophobicContact CD1-CG1 3.97Å
843	N	94.3	Very high	90.2	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131.8	175.4	-73.2	-59.1	0	0	0	111	W504 S750 T751 E841 H864 T865	W504-N843 HydrophobicContact CH2-CB 3.69Å; W504-N843 WeakPolarHBondContact CH2-OD1 3.25Å; W504-N843 HydrophobicContact CZ2-CB 4.19Å; W504-N843 VanDerWaalsContact CZ2-OD1 3.29Å; W504-N843 WeakPolarHBondContact CZ2-OD1 3.44Å; W504-N843 HydrophobicContact CZ3-CB 4.2Å; S750-N843 WeakPolarHBondContact CA-O 3.44Å; S750-N843 WeakPolarHBondContact CB-O 3.46Å; S750-N843 PolarHBondContact OG-O 2.83Å; T751-N843 HydrophobicContact CG2-CB 3.96Å; T751-N843 PolarHBondContact N-O 2.82Å; T751-N843 VanDerWaalsContact N-O 3.16Å; T751-N843 PolarHBondContact OG1-N 2.65Å; T751-N843 PolarHBondContact OG1-O 2.94Å; E841-N843 PolarHBondContact OE1-ND2 3.16Å; N843-H864 CarbonylContact C-O 3.44Å; N843-H864 WeakPolarHBondContact CA-O 3.21Å; N843-T865 VanDerWaalsContact OD1-CB 3.31Å; N843-T865 WeakPolarHBondContact OD1-CB 3.27Å; N843-T865 VanDerWaalsContact OD1-CG2 3.25Å; N843-T865 WeakPolarHBondContact OD1-CG2 3.27Å; N843-T865 PolarHBondContact OD1-OG1 2.93Å
844	F	94.1	Very high	90	Very high	3 Å²	3	51.9 Å²	51.9	1%	0.013	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.4	173.2	-60.9	-93.7	0	0	0	109.4	W504 F719 V748 A749 F755 F756 I842 F846 H864 V866	W504-F844 WeakPolarHBondContact CZ3-O 3.18Å; F719-F844 HydrophobicContact CZ-CE2 4.38Å; F719-F844 HydrophobicContact CZ-CZ 4.44Å; V748-F844 HydrophobicContact CG2-CB 4.19Å; V748-F844 HydrophobicContact CG2-CD1 4.14Å; A749-F844 WeakPolarHBondContact O-CA 3.45Å; F755-F844 AromaticContact CD1-CZ 3.96Å; F755-F844 HydrophobicContact CD1-CZ 3.96Å; F755-F844 HydrophobicContact CE1-CZ 4.03Å; F756-F844 HydrophobicContact CD1-CD1 4.43Å; F756-F844 AromaticContact CD1-CE1 3.6Å; F756-F844 HydrophobicContact CD1-CE1 3.6Å; F756-F844 HydrophobicContact CD1-CZ 4.43Å; F756-F844 HydrophobicContact CD2-CE1 4.29Å; F756-F844 HydrophobicContact CE1-CD1 4.17Å; F756-F844 AromaticContact CE1-CE1 3.79Å; F756-F844 HydrophobicContact CE1-CE1 3.79Å; F756-F844 HydrophobicContact CE2-CE1 4.45Å; F756-F844 AromaticContact CG-CE1 3.88Å; F756-F844 HydrophobicContact CG-CE1 3.88Å; F756-F844 HydrophobicContact CZ-CD1 4.32Å; F756-F844 HydrophobicContact CZ-CE1 4.21Å; I842-F844 HydrophobicContact CB-CE2 4.39Å; I842-F844 HydrophobicContact CG2-CD2 4.32Å; I842-F844 HydrophobicContact CG2-CE2 3.68Å; I842-F844 HydrophobicContact CG2-CZ 3.85Å; F844-F846 HydrophobicContact CB-CE2 4.04Å; F844-F846 HydrophobicContact CB-CZ 4.22Å; F844-H864 HydrophobicContact CB-CB 4.35Å; F844-H864 PolarHBondContact N-O 3.04Å; F844-H864 PolarHBondContact O-N 3.4Å; F844-V866 HydrophobicContact CE2-CG2 4.35Å
845	L	96.1	Very high	89.9	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	110.4	170.7	-171.9	63.2	0	0	0	108.8	W504 L507 E508 L511 V748 A749 V861 R863	W504-L845 HydrophobicContact CE3-CB 4.21Å; W504-L845 HydrophobicContact CE3-CD1 3.9Å; W504-L845 HydrophobicContact CE3-CG 4.46Å; W504-L845 HydrophobicContact CZ3-CB 4.01Å; W504-L845 HydrophobicContact CZ3-CD1 4.12Å; L507-L845 HydrophobicContact CB-CB 4.07Å; L507-L845 HydrophobicContact CB-CD2 3.61Å; L507-L845 HydrophobicContact CD1-CB 4.32Å; E508-L845 HydrophobicContact CB-CD2 3.76Å; E508-L845 HydrophobicContact CG-CD2 4.43Å; E508-L845 VanDerWaalsContact N-CD2 3.32Å; L511-L845 HydrophobicContact CD1-CB 3.91Å; L511-L845 HydrophobicContact CD1-CD2 3.81Å; L511-L845 HydrophobicContact CD1-CG 3.75Å; L511-L845 VanDerWaalsContact CD1-O 3.24Å; L511-L845 WeakPolarHBondContact CD1-O 3.49Å; V748-L845 CarbonylContact C-O 3.59Å; V748-L845 VanDerWaalsContact CA-O 3.28Å; V748-L845 WeakPolarHBondContact CA-O 3.46Å; V748-L845 WeakPolarHBondContact CG2-O 3.36Å; A749-L845 PolarHBondContact N-O 3.14Å; A749-L845 PolarHBondContact O-N 2.92Å; L845-V861 HydrophobicContact CD1-CB 3.71Å; L845-V861 HydrophobicContact CD1-CG1 4.31Å; L845-V861 HydrophobicContact CD1-CG2 4.01Å; L845-V861 HydrophobicContact CD2-CG1 4.46Å; L845-V861 HydrophobicContact CG-CB 4.22Å; L845-V861 HydrophobicContact CG-CG1 4.33Å; L845-R863 HydrophobicContact CD1-CG 3.66Å
846	F	95.6	Very high	90.1	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	138.3	172.3	-57.7	-81.9	0	0	0	109.3	M712 V714 F716 F735 R747 V748 F758 I812 F844 V861 L862 H864	M712-F846 HydrophobicContact CE-CB 3.88Å; M712-F846 HydrophobicContact CE-CG 4.45Å; V714-F846 HydrophobicContact CG1-CE2 4.38Å; V714-F846 HydrophobicContact CG1-CZ 4.38Å; F716-F846 HydrophobicContact CE1-CZ 4.39Å; F716-F846 AromaticContact CZ-CE2 3.96Å; F716-F846 HydrophobicContact CZ-CE2 3.96Å; F716-F846 AromaticContact CZ-CZ 3.79Å; F716-F846 HydrophobicContact CZ-CZ 3.79Å; F735-F846 AromaticContact CE1-CD1 3.78Å; F735-F846 HydrophobicContact CE1-CD1 3.78Å; F735-F846 AromaticContact CE1-CE1 3.71Å; F735-F846 HydrophobicContact CE1-CE1 3.71Å; F735-F846 HydrophobicContact CZ-CD1 4.46Å; F735-F846 HydrophobicContact CZ-CE1 4.05Å; R747-F846 CarbonylContact O-C 3.55Å; R747-F846 WeakPolarHBondContact O-CA 3.42Å; V748-F846 HydrophobicContact CB-CD1 3.72Å; V748-F846 HydrophobicContact CB-CE1 3.91Å; V748-F846 HydrophobicContact CG2-CD1 3.74Å; V748-F846 HydrophobicContact CG2-CE1 3.66Å; V748-F846 HydrophobicContact CG2-CG 4.32Å; V748-F846 HydrophobicContact CG2-CZ 4.19Å; F758-F846 HydrophobicContact CZ-CE1 4.48Å; I812-F846 HydrophobicContact CD1-CD1 3.76Å; I812-F846 HydrophobicContact CD1-CE1 4.05Å; F844-F846 HydrophobicContact CB-CE2 4.04Å; F844-F846 HydrophobicContact CB-CZ 4.22Å; F846-V861 CarbonylContact O-C 3.56Å; F846-V861 WeakPolarHBondContact O-CA 3.36Å; F846-V861 WeakPolarHBondContact O-CB 3.45Å; F846-L862 HydrophobicContact CB-CB 4.25Å; F846-L862 HydrophobicContact CD2-CD2 4.43Å; F846-L862 WeakPolarHBondContact CD2-O 3.49Å; F846-L862 PolarHBondContact N-O 2.9Å; F846-L862 PolarHBondContact O-N 2.64Å; F846-H864 HydrophobicContact CE2-CB 4.25Å
847	Y	95.8	Very high	90.3	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.6	178.8	170.1	-77	0	0	0	109.1	L511 A512 A515 L746 R747 E849 H859 R860 V861	L511-Y847 HydrophobicContact CB-CD2 3.72Å; L511-Y847 HydrophobicContact CB-CE2 4.46Å; L511-Y847 HydrophobicContact CB-CG 3.97Å; A512-Y847 HydrophobicContact CB-CE2 4.27Å; A515-Y847 HydrophobicContact CB-CE1 3.82Å; A515-Y847 VanDerWaalsContact CB-OH 3.32Å; A515-Y847 WeakPolarHBondContact CB-OH 3.18Å; L746-Y847 WeakPolarHBondContact CA-O 3.39Å; R747-Y847 HydrophobicContact CB-CD1 4.44Å; R747-Y847 PolarHBondContact N-O 2.97Å; R747-Y847 PolarHBondContact O-N 3.28Å; Y847-E849 HydrophobicContact CD1-CG 4.36Å; Y847-E849 HydrophobicContact CE1-CG 3.46Å; Y847-E849 VanDerWaalsContact CE1-CG 3.46Å; Y847-E849 WeakPolarHBondContact CE1-OE1 3.39Å; Y847-E849 PolarHBondContact OH-OE1 3.5Å; Y847-H859 HydrophobicContact CD2-CB 4.13Å; Y847-H859 AromaticContact CD2-CD2 3.4Å; Y847-H859 WeakPolarHBondContact CD2-CD2 3.31Å; Y847-H859 AromaticContact CD2-CG 3.99Å; Y847-H859 HydrophobicContact CE1-CB 4.29Å; Y847-H859 HydrophobicContact CE2-CB 3.45Å; Y847-H859 VanDerWaalsContact CE2-CB 3.45Å; Y847-H859 AromaticContact CE2-CD2 3.14Å; Y847-H859 WeakPolarHBondContact CE2-CD2 3.33Å; Y847-H859 AromaticContact CE2-CG 3.33Å; Y847-H859 AromaticContact CE2-NE2 3.89Å; Y847-H859 AromaticContact CZ-CG 3.89Å; Y847-R860 WeakPolarHBondContact CA-O 3.43Å; Y847-V861 HydrophobicContact CD2-CG1 4.35Å
848	Y	95.1	Very high	90.4	Very high	7 Å²	7	46 Å²	46	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	157.3	177.2	59.9	-83.3	0	0	0	111.3	P710 M712 L743 H859 R860	P710-Y848 HydrophobicContact CB-CD2 4.08Å; P710-Y848 HydrophobicContact CB-CE2 4Å; P710-Y848 HydrophobicContact CG-CD2 4.06Å; P710-Y848 HydrophobicContact CG-CE2 4.13Å; P710-Y848 WeakPolarHBondContact O-CE2 3.39Å; M712-Y848 HydrophobicContact CB-CD1 4.24Å; M712-Y848 HydrophobicContact CB-CE1 3.84Å; M712-Y848 HydrophobicContact CB-CE2 4.15Å; M712-Y848 HydrophobicContact CE-CD1 3.71Å; M712-Y848 HydrophobicContact CE-CE1 3.96Å; M712-Y848 PolarHBondContact N-OH 2.97Å; M712-Y848 HydrophobicContact SD-CD1 4.44Å; L743-Y848 HydrophobicContact CB-CD2 4.26Å; L743-Y848 HydrophobicContact CD2-CD2 4.41Å; Y848-H859 WeakPolarHBondContact O-CA 3.35Å; Y848-R860 HydrophobicContact CD1-CB 4.47Å; Y848-R860 HydrophobicContact CD2-CB 4.19Å; Y848-R860 HydrophobicContact CE1-CB 3.92Å; Y848-R860 HydrophobicContact CE2-CB 3.6Å; Y848-R860 HydrophobicContact CE2-CG 4.46Å; Y848-R860 VanDerWaalsContact CZ-CB 3.45Å; Y848-R860 PolarHBondContact N-O 3.33Å; Y848-R860 PolarHBondContact O-N 3.47Å
849	E	93.9	Very high	90.5	Very high	30 Å²	30	44.7 Å²	44.7	14%	0.14	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	156.9	-170.9	-56.1	-178.2	155.5	0	0	111.5	C744 Y847 K853 H859	C744-E849 PolarHBondContact N-O 3.33Å; C744-E849 PolarHBondContact O-N 3.28Å; Y847-E849 HydrophobicContact CD1-CG 4.36Å; Y847-E849 HydrophobicContact CE1-CG 3.46Å; Y847-E849 VanDerWaalsContact CE1-CG 3.46Å; Y847-E849 WeakPolarHBondContact CE1-OE1 3.39Å; Y847-E849 PolarHBondContact OH-OE1 3.5Å; E849-K853 IonicContact OE2-NZ 2.89Å; E849-K853 PolarHBondContact OE2-NZ 3.46Å; E849-H859 HydrophobicContact CG-CB 4.25Å
850	N	92.6	Very high	90.6	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.016	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	145.8	162.4	-164	-30.6	0	0	0	109.3	M709 P710 C744 E852 K853 L855	M709-N850 HydrophobicContact CE-CB 4.18Å; M709-N850 HydrophobicContact SD-CB 3.99Å; P710-N850 HydrophobicContact CG-CB 4.22Å; C744-N850 PolarHBondContact SG-O 2.97Å; N850-E852 PolarHBondContact O-N 3.36Å; N850-E852 PolarHBondContact OD1-N 2.81Å; N850-K853 PolarHBondContact O-NZ 3.01Å; N850-K853 VanDerWaalsContact O-NZ 3.1Å; N850-L855 HydrophobicContact CB-CD1 4.04Å; N850-L855 WeakPolarHBondContact ND2-CD1 3.41Å
851	T	87.9	Confident	90.7	Very high	65 Å²	65	39.7 Å²	39.7	40%	0.399	22%	0.217	S	C	.	.	S	Bend	trans	-61.7	-31.5	168.5	44.8	0	0	0	0	111.9	A742 C744 T818	A742-T851 HydrophobicContact CB-CG2 3.98Å; C744-T851 HydrophobicContact CB-CG2 4.04Å; T818-T851 HydrophobicContact CG2-CG2 3.87Å
852	E	86.5	Confident	90.8	Very high	127 Å²	127	36.9 Å²	36.9	59%	0.593	20%	0.204	S	C	*	.	S	Bend	trans	-77.9	137.8	171.1	-63.5	-174.8	174	0	0	111.5	N850 L855	N850-E852 PolarHBondContact O-N 3.36Å; N850-E852 PolarHBondContact OD1-N 2.81Å; E852-L855 HydrophobicContact CB-CD1 4.31Å
853	K	84.4	Confident	90.9	Very high	135 Å²	135	37.9 Å²	37.9	59%	0.587	21%	0.208	S	C	*	.			trans	-109.6	149.6	179.8	-60.3	-53	-175.8	-160.9	0	111.1	E849 N850	E849-K853 IonicContact OE2-NZ 2.89Å; E849-K853 PolarHBondContact OE2-NZ 3.46Å; N850-K853 PolarHBondContact O-NZ 3.01Å; N850-K853 VanDerWaalsContact O-NZ 3.1Å
854	G	77.9	Confident	90.8	Very high	85 Å²	85	37.7 Å²	37.7	88%	0.876	21%	0.207	S	C	*	.	S	Bend	trans	93.3	5.5	179.3	0	0	0	0	0	115.5
855	L	82.6	Confident	90.8	Very high	46 Å²	46	39 Å²	39	24%	0.241	22%	0.216	C	C	.	.			trans	-68.2	156	172.5	-60.2	177.3	0	0	0	111.8	M709 N850 E852 I857	M709-L855 HydrophobicContact SD-CD1 3.75Å; N850-L855 HydrophobicContact CB-CD1 4.04Å; N850-L855 WeakPolarHBondContact ND2-CD1 3.41Å; E852-L855 HydrophobicContact CB-CD1 4.31Å; L855-I857 VanDerWaalsContact C-N 3.27Å; L855-I857 PolarHBondContact O-N 2.87Å
856	K	85.1	Confident	90.6	Very high	113 Å²	113	39.5 Å²	39.5	49%	0.491	22%	0.219	S	C	.	.	S	Bend	trans	-58.9	-38	176.4	-74.1	-173.8	177.5	177.3	0	112.6	L542 P579 I704 T706	L542-K856 HydrophobicContact CD1-CB 4.33Å; P579-K856 VanDerWaalsContact CG-NZ 3.3Å; I704-K856 HydrophobicContact CG2-CD 4.24Å; T706-K856 HydrophobicContact CG2-CB 4.09Å; T706-K856 HydrophobicContact CG2-CD 4.26Å
857	I	88.6	Confident	90.5	Very high	25 Å²	25	45 Å²	45	13%	0.128	24%	0.243	C	C	.	.	S	Bend	trans	-93.7	109.6	170.1	-55.6	175.7	0	0	0	106.9	L542 V544 T706 M709 L855 H859 R860	L542-I857 HydrophobicContact CB-CD1 3.99Å; L542-I857 HydrophobicContact CB-CG1 3.92Å; L542-I857 HydrophobicContact CD1-CG1 3.64Å; L542-I857 HydrophobicContact CG-CG1 4.41Å; V544-I857 HydrophobicContact CG2-CD1 3.54Å; T706-I857 HydrophobicContact CG2-CD1 4.36Å; T706-I857 HydrophobicContact CG2-CG1 4.34Å; T706-I857 WeakPolarHBondContact OG1-CD1 3.37Å; M709-I857 HydrophobicContact CE-CB 4Å; M709-I857 HydrophobicContact CE-CG2 3.67Å; M709-I857 HydrophobicContact CG-CB 4.34Å; M709-I857 HydrophobicContact CG-CD1 4.26Å; M709-I857 HydrophobicContact SD-CB 4.24Å; L855-I857 VanDerWaalsContact C-N 3.27Å; L855-I857 PolarHBondContact O-N 2.87Å; I857-H859 WeakPolarHBondContact CG2-O 3.49Å; I857-R860 HydrophobicContact CG2-CG 4.3Å
858	S	88.8	Confident	90.2	Very high	66 Å²	66	45 Å²	45	46%	0.462	24%	0.243	S	C	.	.			trans	-77.8	-30.1	-177.9	54.8	0	0	0	0	113.4
859	H	92.9	Very high	90.1	Very high	7 Å²	7	47.2 Å²	47.2	3%	0.032	26%	0.259	C	S	.	.			trans	-156.3	169.9	-175.2	67	-72.7	0	0	0	110.6	E508 F524 Y847 Y848 E849 I857	E508-H859 IonicContact OE1-CE1 3.21Å; E508-H859 IonicContact OE1-NE2 2.7Å; E508-H859 PolarHBondContact OE1-NE2 3.02Å; E508-H859 VanDerWaalsContact OE1-NE2 3.16Å; F524-H859 AromaticContact CE2-CE1 3.71Å; F524-H859 AromaticContact CE2-NE2 3.9Å; Y847-H859 HydrophobicContact CD2-CB 4.13Å; Y847-H859 AromaticContact CD2-CD2 3.4Å; Y847-H859 WeakPolarHBondContact CD2-CD2 3.31Å; Y847-H859 AromaticContact CD2-CG 3.99Å; Y847-H859 HydrophobicContact CE1-CB 4.29Å; Y847-H859 HydrophobicContact CE2-CB 3.45Å; Y847-H859 VanDerWaalsContact CE2-CB 3.45Å; Y847-H859 AromaticContact CE2-CD2 3.14Å; Y847-H859 WeakPolarHBondContact CE2-CD2 3.33Å; Y847-H859 AromaticContact CE2-CG 3.33Å; Y847-H859 AromaticContact CE2-NE2 3.89Å; Y847-H859 AromaticContact CZ-CG 3.89Å; Y848-H859 WeakPolarHBondContact O-CA 3.35Å; E849-H859 HydrophobicContact CG-CB 4.25Å; I857-H859 WeakPolarHBondContact CG2-O 3.49Å
860	R	93.6	Very high	89.8	Confident	28 Å²	28	45.9 Å²	45.9	11%	0.106	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	157	172.4	-79.3	177.9	153.6	-155	-19.1	110.2	V544 E547 M709 P710 Y847 Y848 I857	V544-R860 VanDerWaalsContact CG2-NH2 3.25Å; E547-R860 IonicContact OE1-CZ 3.17Å; E547-R860 VanDerWaalsContact OE1-CZ 3.24Å; E547-R860 IonicContact OE1-NH1 3.23Å; E547-R860 PolarHBondContact OE1-NH1 2.9Å; E547-R860 IonicContact OE1-NH2 2.88Å; E547-R860 PolarHBondContact OE1-NH2 2.65Å; E547-R860 IonicContact OE2-CZ 3.38Å; E547-R860 IonicContact OE2-NH1 3.47Å; E547-R860 IonicContact OE2-NH2 2.73Å; E547-R860 PolarHBondContact OE2-NH2 3.36Å; M709-R860 HydrophobicContact CE-CG 4.18Å; P710-R860 WeakPolarHBondContact O-CD 3.4Å; P710-R860 PolarHBondContact O-NH1 3.3Å; Y847-R860 WeakPolarHBondContact CA-O 3.43Å; Y848-R860 HydrophobicContact CD1-CB 4.47Å; Y848-R860 HydrophobicContact CD2-CB 4.19Å; Y848-R860 HydrophobicContact CE1-CB 3.92Å; Y848-R860 HydrophobicContact CE2-CB 3.6Å; Y848-R860 HydrophobicContact CE2-CG 4.46Å; Y848-R860 VanDerWaalsContact CZ-CB 3.45Å; Y848-R860 PolarHBondContact N-O 3.33Å; Y848-R860 PolarHBondContact O-N 3.47Å; I857-R860 HydrophobicContact CG2-CG 4.3Å
861	V	94.8	Very high	89.4	Confident	8 Å²	8	46.5 Å²	46.5	5%	0.048	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.7	178.6	-61.1	0	0	0	0	113	E508 T527 L845 F846 Y847	E508-V861 HydrophobicContact CG-CG1 3.98Å; T527-V861 HydrophobicContact CG2-CG2 3.98Å; L845-V861 HydrophobicContact CD1-CB 3.71Å; L845-V861 HydrophobicContact CD1-CG1 4.31Å; L845-V861 HydrophobicContact CD1-CG2 4.01Å; L845-V861 HydrophobicContact CD2-CG1 4.46Å; L845-V861 HydrophobicContact CG-CB 4.22Å; L845-V861 HydrophobicContact CG-CG1 4.33Å; F846-V861 CarbonylContact O-C 3.56Å; F846-V861 WeakPolarHBondContact O-CA 3.36Å; F846-V861 WeakPolarHBondContact O-CB 3.45Å; Y847-V861 HydrophobicContact CD2-CG1 4.35Å
862	L	94.3	Very high	89.1	Confident	18 Å²	18	49.4 Å²	49.4	9%	0.094	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124	173	-172.6	82.7	0	0	0	109.1	A487 H489 M712 V714 F846	A487-L862 HydrophobicContact CB-CD2 3.76Å; A487-L862 HydrophobicContact CB-CG 4.25Å; H489-L862 HydrophobicContact CB-CD1 4.45Å; H489-L862 VanDerWaalsContact CD2-CD1 3.49Å; H489-L862 WeakPolarHBondContact CD2-CD1 3.15Å; M712-L862 HydrophobicContact CE-CD2 4.41Å; V714-L862 HydrophobicContact CB-CD2 3.69Å; V714-L862 HydrophobicContact CG2-CD2 3.43Å; V714-L862 VanDerWaalsContact CG2-CD2 3.43Å; F846-L862 HydrophobicContact CB-CB 4.25Å; F846-L862 HydrophobicContact CD2-CD2 4.43Å; F846-L862 WeakPolarHBondContact CD2-O 3.49Å; F846-L862 PolarHBondContact N-O 2.9Å; F846-L862 PolarHBondContact O-N 2.64Å
863	R	93.5	Very high	88.6	Confident	21 Å²	21	43.8 Å²	43.8	8%	0.079	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	139.4	-178.5	-59.5	176	-172.7	-170.9	4.9	111.1	H489 W504 T527 L845	H489-R863 WeakPolarHBondContact CA-O 3.39Å; H489-R863 PolarHBondContact N-O 3.42Å; W504-R863 VanDerWaalsContact CD1-NH1 3.27Å; W504-R863 HydrophobicContact CD2-CB 4.47Å; W504-R863 HydrophobicContact CD2-CG 3.9Å; W504-R863 HydrophobicContact CE3-CB 4.28Å; W504-R863 HydrophobicContact CE3-CG 3.76Å; W504-R863 HydrophobicContact CH2-CB 3.8Å; W504-R863 HydrophobicContact CH2-CG 4.21Å; W504-R863 HydrophobicContact CZ2-CB 4Å; W504-R863 HydrophobicContact CZ2-CG 4.34Å; W504-R863 HydrophobicContact CZ3-CB 3.94Å; W504-R863 HydrophobicContact CZ3-CG 3.92Å; T527-R863 PolarHBondContact O-NH2 3.45Å; L845-R863 HydrophobicContact CD1-CG 3.66Å
864	H	93.6	Very high	88	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	136.8	166.3	-174.2	38.5	0	0	0	112.1	A487 T488 F716 N843 F844 F846 V866	A487-H864 HydrophobicContact CB-CB 4.15Å; T488-H864 PolarHBondContact N-ND1 3.42Å; T488-H864 VanDerWaalsContact N-ND1 3.16Å; T488-H864 VanDerWaalsContact OG1-CA 3.3Å; T488-H864 WeakPolarHBondContact OG1-CA 3.33Å; T488-H864 PolarHBondContact OG1-ND1 2.93Å; F716-H864 AromaticContact CD2-CD2 3.74Å; F716-H864 AromaticContact CD2-NE2 3.48Å; F716-H864 WeakPolarHBondContact CD2-NE2 3.42Å; F716-H864 AromaticContact CE1-CD2 3.9Å; F716-H864 HydrophobicContact CE2-CB 4.43Å; F716-H864 AromaticContact CE2-CD2 3.1Å; F716-H864 WeakPolarHBondContact CE2-CD2 3.22Å; F716-H864 AromaticContact CE2-CG 3.8Å; F716-H864 AromaticContact CE2-NE2 3.38Å; F716-H864 WeakPolarHBondContact CE2-NE2 3.28Å; F716-H864 HydrophobicContact CZ-CB 4.49Å; F716-H864 AromaticContact CZ-CD2 3.2Å; F716-H864 WeakPolarHBondContact CZ-CD2 3.3Å; F716-H864 AromaticContact CZ-NE2 3.82Å; N843-H864 CarbonylContact C-O 3.44Å; N843-H864 WeakPolarHBondContact CA-O 3.21Å; F844-H864 HydrophobicContact CB-CB 4.35Å; F844-H864 PolarHBondContact N-O 3.04Å; F844-H864 PolarHBondContact O-N 3.4Å; F846-H864 HydrophobicContact CE2-CB 4.25Å; H864-V866 WeakPolarHBondContact NE2-CG2 3.41Å
865	T	93.3	Very high	87.7	Confident	32 Å²	32	36.9 Å²	36.9	20%	0.196	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.3	176.5	-50.8	0	0	0	0	108.7	T488 E841 N843 F867	T488-T865 PolarHBondContact OG1-N 3.22Å; E841-T865 HydrophobicContact CG-CG2 3.66Å; N843-T865 VanDerWaalsContact OD1-CB 3.31Å; N843-T865 WeakPolarHBondContact OD1-CB 3.27Å; N843-T865 VanDerWaalsContact OD1-CG2 3.25Å; N843-T865 WeakPolarHBondContact OD1-CG2 3.27Å; N843-T865 PolarHBondContact OD1-OG1 2.93Å; T865-F867 HydrophobicContact CG2-CE2 4.18Å; T865-F867 HydrophobicContact CG2-CZ 4.13Å
866	V	92.1	Very high	87	Confident	11 Å²	11	36.1 Å²	36.1	7%	0.067	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	144.6	172.6	-168.5	0	0	0	0	110.4	F719 I842 F844 H864 I868	F719-V866 HydrophobicContact CD1-CG1 3.96Å; F719-V866 HydrophobicContact CE1-CB 4.07Å; F719-V866 HydrophobicContact CE1-CG1 3.59Å; F719-V866 HydrophobicContact CE1-CG2 3.92Å; F719-V866 HydrophobicContact CZ-CG2 4.13Å; I842-V866 PolarHBondContact N-O 3.21Å; I842-V866 PolarHBondContact O-N 2.83Å; F844-V866 HydrophobicContact CE2-CG2 4.35Å; H864-V866 WeakPolarHBondContact NE2-CG2 3.41Å; V866-I868 HydrophobicContact CG1-CD1 4.21Å
867	F	93.3	Very high	85.9	Confident	117 Å²	117	37.2 Å²	37.2	51%	0.513	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	123.3	171.3	-59.9	-83.5	0	0	0	109.5	V839 H840 E841 T865	V839-F867 HydrophobicContact CG1-CB 4.2Å; V839-F867 HydrophobicContact CG1-CD1 4.32Å; H840-F867 WeakPolarHBondContact O-CA 3.3Å; E841-F867 HydrophobicContact CB-CD1 3.98Å; E841-F867 HydrophobicContact CB-CE1 3.75Å; E841-F867 HydrophobicContact CG-CD1 4.12Å; E841-F867 HydrophobicContact CG-CE1 3.56Å; E841-F867 HydrophobicContact CG-CZ 4.05Å; T865-F867 HydrophobicContact CG2-CE2 4.18Å; T865-F867 HydrophobicContact CG2-CZ 4.13Å
868	I	90.6	Very high	84.8	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.7	177.4	-64	-63.3	0	0	0	109.3	F719 P720 L723 F755 V839 H840 I842 V866 A870	F719-I868 HydrophobicContact CE1-CD1 4.05Å; P720-I868 WeakPolarHBondContact O-CD1 3.39Å; L723-I868 HydrophobicContact CB-CG2 4.29Å; L723-I868 HydrophobicContact CD1-CG2 4.24Å; L723-I868 HydrophobicContact CG-CG2 4.4Å; F755-I868 HydrophobicContact CE2-CG1 4.2Å; F755-I868 HydrophobicContact CZ-CD1 4.22Å; F755-I868 HydrophobicContact CZ-CG1 3.81Å; V839-I868 WeakPolarHBondContact CA-O 3.42Å; H840-I868 PolarHBondContact N-O 2.87Å; H840-I868 PolarHBondContact O-N 3.17Å; I842-I868 HydrophobicContact CD1-CB 4.46Å; I842-I868 HydrophobicContact CD1-CG1 3.97Å; V866-I868 HydrophobicContact CG1-CD1 4.21Å; I868-A870 PolarHBondContact O-N 2.9Å
869	C	91.1	Very high	83.4	Confident	54 Å²	54	37.6 Å²	37.6	37%	0.365	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	112.9	165.3	-167.1	0	0	0	0	109.5	T721 A722 L723	T721-C869 PolarHBondContact O-N 3.08Å; A722-C869 VanDerWaalsContact CA-O 3.28Å; A722-C869 WeakPolarHBondContact CA-O 3.47Å; A722-C869 HydrophobicContact CB-CB 4.24Å; L723-C869 PolarHBondContact N-O 2.77Å
870	A	88.8	Confident	82.1	Confident	3 Å²	3	40.8 Å²	40.8	3%	0.025	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	113.6	174	0	0	0	0	0	109.8	L723 P834 Q836 E837 G838 I868	L723-A870 VanDerWaalsContact O-CA 3.31Å; L723-A870 WeakPolarHBondContact O-CA 3.36Å; P834-A870 HydrophobicContact CB-CB 4.18Å; P834-A870 HydrophobicContact CG-CB 4.32Å; Q836-A870 VanDerWaalsContact O-CB 3.28Å; Q836-A870 WeakPolarHBondContact O-CB 3.23Å; E837-A870 CarbonylContact C-O 3.53Å; E837-A870 VanDerWaalsContact CA-O 3.27Å; E837-A870 WeakPolarHBondContact CA-O 3.41Å; G838-A870 PolarHBondContact N-O 3.24Å; G838-A870 PolarHBondContact O-N 3.22Å; I868-A870 PolarHBondContact O-N 2.9Å
871	S	84.2	Confident	80.6	Confident	15 Å²	15	42 Å²	42	11%	0.105	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	143.3	177.1	-76.2	0	0	0	0	110.8	L723 L724 C725 E912	L723-S871 PolarHBondContact O-N 3.41Å; L724-S871 CarbonylContact C-O 3.32Å; L724-S871 WeakPolarHBondContact CA-O 3.26Å; C725-S871 PolarHBondContact N-O 3.37Å; C725-S871 PolarHBondContact SG-O 3.09Å; C725-S871 VanDerWaalsContact SG-O 3.37Å; S871-E912 WeakPolarHBondContact CB-OE1 3.22Å; S871-E912 PolarHBondContact OG-OE1 3.28Å
872	R	80.8	Confident	78.9	Confident	127 Å²	127	52.6 Å²	52.6	48%	0.479	28%	0.28	S	S	.	.			trans	-52.9	142.1	179	-66.3	-171.8	-177	-168.3	-2	111.7	E837 V908 N909	E837-R872 HydrophobicContact CB-CG 4.1Å; E837-R872 IonicContact OE1-CZ 3.58Å; E837-R872 VanDerWaalsContact OE1-CZ 3.32Å; E837-R872 IonicContact OE1-NE 2.73Å; E837-R872 PolarHBondContact OE1-NE 2.9Å; E837-R872 VanDerWaalsContact OE1-NE 3.13Å; E837-R872 IonicContact OE1-NH2 3.61Å; E837-R872 PolarHBondContact OE1-NH2 2.69Å; E837-R872 WeakPolarHBondContact OE2-CD 3.49Å; E837-R872 VanDerWaalsContact OE2-CG 3.22Å; E837-R872 WeakPolarHBondContact OE2-CG 3.35Å; E837-R872 IonicContact OE2-CZ 2.92Å; E837-R872 IonicContact OE2-NE 2.68Å; E837-R872 PolarHBondContact OE2-NE 3.13Å; E837-R872 IonicContact OE2-NH2 3.32Å; R872-V908 HydrophobicContact CB-CG2 4.16Å; R872-N909 VanDerWaalsContact O-CB 3.24Å; R872-N909 WeakPolarHBondContact O-CB 3.28Å
873	S	75.8	Confident	77.3	Confident	8 Å²	8	52.5 Å²	52.5	6%	0.056	28%	0.281	C	S	.	.			trans	-120.2	-93.6	-177.2	58.9	0	0	0	0	112.7	C725 N907 V908 N909	C725-S873 WeakPolarHBondContact O-CB 3.25Å; C725-S873 PolarHBondContact O-OG 2.82Å; S873-N907 PolarHBondContact O-OD1 2.61Å; S873-V908 VanDerWaalsContact O-CG2 3.31Å; S873-V908 WeakPolarHBondContact O-CG2 3.21Å; S873-V908 PolarHBondContact O-N 3.08Å; S873-N909 PolarHBondContact O-N 2.9Å
874	L	73.4	Confident	75.3	Confident	15 Å²	15	57.7 Å²	57.7	8%	0.079	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.2	-176.2	-67.3	174.3	0	0	0	109.7	V876 V905 E906 N907 F918 F958 F969	L874-V876 HydrophobicContact CB-CG2 4.26Å; L874-V905 HydrophobicContact CB-CG1 4.19Å; L874-V905 HydrophobicContact CD1-CG1 4.03Å; L874-V905 HydrophobicContact CD2-CG1 3.71Å; L874-V905 HydrophobicContact CG-CG1 4.19Å; L874-E906 CarbonylContact C-O 3.58Å; L874-E906 WeakPolarHBondContact CA-O 3.42Å; L874-N907 HydrophobicContact CD2-CB 4.14Å; L874-F918 HydrophobicContact CD1-CD1 3.94Å; L874-F918 HydrophobicContact CD1-CE1 3.84Å; L874-F918 HydrophobicContact CD2-CD1 3.42Å; L874-F918 VanDerWaalsContact CD2-CD1 3.42Å; L874-F918 HydrophobicContact CD2-CE1 3.36Å; L874-F918 HydrophobicContact CD2-CG 4.35Å; L874-F918 HydrophobicContact CD2-CZ 4.2Å; L874-F918 HydrophobicContact CG-CD1 3.95Å; L874-F918 HydrophobicContact CG-CE1 3.55Å; L874-F958 HydrophobicContact CD1-CB 4.15Å; L874-F958 HydrophobicContact CD1-CD2 4.04Å; L874-F958 HydrophobicContact CD1-CG 4.05Å; L874-F969 HydrophobicContact CD1-CB 3.66Å; L874-F969 VanDerWaalsContact CD1-O 3.27Å; L874-F969 WeakPolarHBondContact CD1-O 3.34Å
875	S	70.6	Confident	73.2	Confident	60 Å²	60	59.6 Å²	59.6	42%	0.42	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	135	159	-178.9	0	0	0	0	108	V905 E906	S875-V905 CarbonylContact O-C 3.42Å; S875-V905 WeakPolarHBondContact O-CA 3.34Å; S875-E906 PolarHBondContact N-O 3.11Å; S875-E906 PolarHBondContact O-N 3.1Å
876	V	67.7	Low	71.1	Confident	30 Å²	30	61.9 Å²	61.9	18%	0.182	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	125.3	179.9	-178.1	0	0	0	0	110	L874 I903 D904 V905 L960 F969	L874-V876 HydrophobicContact CB-CG2 4.26Å; V876-I903 HydrophobicContact CG1-CG2 3.37Å; V876-D904 WeakPolarHBondContact CA-O 3.39Å; V876-V905 HydrophobicContact CG1-CG2 4.23Å; V876-V905 HydrophobicContact CG2-CG1 4.24Å; V876-V905 HydrophobicContact CG2-CG2 4.11Å; V876-L960 HydrophobicContact CB-CD2 3.49Å; V876-L960 VanDerWaalsContact CB-CD2 3.49Å; V876-L960 HydrophobicContact CG1-CD2 4.06Å; V876-L960 HydrophobicContact CG2-CD1 3.76Å; V876-L960 HydrophobicContact CG2-CD2 3.59Å; V876-L960 HydrophobicContact CG2-CG 4.28Å; V876-F969 HydrophobicContact CG1-CD2 4.41Å; V876-F969 HydrophobicContact CG1-CE1 4.29Å; V876-F969 HydrophobicContact CG1-CE2 3.86Å; V876-F969 HydrophobicContact CG1-CZ 3.76Å; V876-F969 HydrophobicContact CG2-CD2 3.92Å; V876-F969 HydrophobicContact CG2-CE2 4.14Å; V876-F969 HydrophobicContact CG2-CG 4.29Å
877	Q	63.1	Low	69.2	Low	137 Å²	137	63.6 Å²	63.6	64%	0.64	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	118.3	173.9	-175.1	172.6	1.6	0	0	108.6	D904	Q877-D904 HydrophobicContact CB-CB 4.44Å; Q877-D904 PolarHBondContact N-O 3.31Å; Q877-D904 PolarHBondContact O-N 2.77Å
878	A	64.4	Low	67	Low	42 Å²	42	65.6 Å²	65.6	35%	0.347	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	134.3	172.2	0	0	0	0	0	110.1	V901 F902 I903 L962	A878-V901 HydrophobicContact CB-CG1 4.33Å; A878-F902 VanDerWaalsContact CA-O 3.32Å; A878-F902 WeakPolarHBondContact CA-O 3.49Å; A878-I903 HydrophobicContact CB-CG1 4.45Å; A878-L962 HydrophobicContact CB-CD1 3.45Å; A878-L962 VanDerWaalsContact CB-CD1 3.45Å
879	S	60.4	Low	64.9	Low	56 Å²	56	75 Å²	75	39%	0.392	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	139.2	169.9	64.3	0	0	0	0	109.9	V901 F902	S879-V901 CarbonylContact O-C 3.52Å; S879-V901 WeakPolarHBondContact O-CA 3.39Å; S879-F902 PolarHBondContact N-O 3.06Å; S879-F902 PolarHBondContact O-N 3.23Å
880	A	65.4	Low	62.4	Low	74 Å²	74	75.3 Å²	75.3	61%	0.612	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	131.5	-177.5	0	0	0	0	0	110.1	T899 L900 V901	A880-T899 HydrophobicContact CB-CG2 4Å; A880-L900 CarbonylContact C-O 3.59Å; A880-L900 WeakPolarHBondContact CA-O 3.31Å; A880-V901 HydrophobicContact CB-CG2 4.31Å
881	C	61.8	Low	60.2	Low	54 Å²	54	83.4 Å²	83.4	37%	0.365	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	153.9	171.2	81.1	0	0	0	0	110.6	S883 T899 L900	C881-S883 PolarHBondContact O-N 2.88Å; C881-T899 CarbonylContact O-C 3.58Å; C881-T899 WeakPolarHBondContact O-CA 3.33Å; C881-T899 WeakPolarHBondContact O-CG2 3.47Å; C881-L900 PolarHBondContact N-O 3.47Å; C881-L900 PolarHBondContact O-N 3.04Å
882	R	59.5	Low	58.5	Low	231 Å²	231	90.6 Å²	90.6	87%	0.872	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	129	172.3	-76.2	-178.3	170.7	171.7	-2.4	109.6
883	S	59.7	Low	56.7	Low	15 Å²	15	88.5 Å²	88.5	11%	0.105	50%	0.5	C	S	.	.			trans	-73.6	128.7	172.4	-168.4	0	0	0	0	109.9	C881 A885 G898 Q980	C881-S883 PolarHBondContact O-N 2.88Å; S883-A885 PolarHBondContact OG-N 3.11Å; S883-G898 WeakPolarHBondContact CB-O 3.48Å; S883-G898 PolarHBondContact N-O 3.24Å; S883-Q980 PolarHBondContact OG-NE2 2.92Å
884	S	51.8	Low	55.2	Low	131 Å²	131	98.5 Å²	98.5	92%	0.916	54%	0.542	S	S	*	.			trans	-90.8	-2.8	166.4	54	0	0	0	0	112.9	S886	S884-S886 PolarHBondContact O-N 3.39Å
885	A	50.5	Low	54	Low	40 Å²	40	101.1 Å²	101.1	33%	0.331	57%	0.573	S	S	.	*			trans	-79.4	119.4	-178.7	0	0	0	0	0	111.3	S883 Q980	S883-A885 PolarHBondContact OG-N 3.11Å; A885-Q980 PolarHBondContact O-NE2 3.03Å
886	S	48.8	Very low	52.9	Low	79 Å²	79	99.5 Å²	99.5	55%	0.552	56%	0.562	S	S	*	*			trans	-62.8	138.7	174.4	56.9	0	0	0	0	111.4	S884 H888	S884-S886 PolarHBondContact O-N 3.39Å; S886-H888 PolarHBondContact O-N 3.19Å
887	P	50.9	Low	52.2	Low	48 Å²	48	100.5 Å²	100.5	31%	0.312	58%	0.578	S	S	.	*			trans	-64.5	107.4	173.9	26.5	-33	0	0	0	110.3	H889	P887-H889 PolarHBondContact O-N 3.09Å
888	H	47.5	Very low	52	Low	158 Å²	158	94.2 Å²	94.2	73%	0.731	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	124.8	166.1	-77.3	-67.6	0	0	0	108.6	S886	S886-H888 PolarHBondContact O-N 3.19Å
889	H	46.2	Very low	51.8	Low	197 Å²	197	93.7 Å²	93.7	91%	0.912	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	54.6	-169.7	-62.1	-81.8	0	0	0	117.5	P887	P887-H889 PolarHBondContact O-N 3.09Å
890	S	39.6	Very low	52	Low	61 Å²	61	92.6 Å²	92.6	43%	0.427	53%	0.532	S	S	.	.			trans	-143.2	110.2	136	55.6	0	0	0	0	110.6
891	L	43.4	Very low	51.8	Low	173 Å²	173	89.5 Å²	89.5	91%	0.906	51%	0.505	S	S	*	.	S	Bend	trans	-66.3	134.6	153.7	-79.7	150.9	0	0	0	106.2
892	D	46.8	Very low	51.9	Low	166 Å²	166	89.7 Å²	89.7	89%	0.888	50%	0.5	S	S	*	.	S	Bend	trans	67.4	62.8	-177.3	-54.8	-28	0	0	0	117.5
893	D	43.5	Very low	52.1	Low	84 Å²	84	79.4 Å²	79.4	45%	0.449	46%	0.462	S	S	.	.			trans	-147.1	124.8	136.2	-168.2	18.5	0	0	0	112.5	S896	D893-S896 PolarHBondContact OD2-OG 3.24Å
894	K	44.5	Very low	52.3	Low	217 Å²	217	81.2 Å²	81.2	94%	0.943	47%	0.471	S	S	*	.	S	Bend	trans	-110.8	81.2	173.4	-81.3	-170.4	-179.5	179.6	0	109.2
895	G	47.4	Very low	53.1	Low	71 Å²	71	75.4 Å²	75.4	73%	0.732	43%	0.43	S	S	*	.			trans	169.3	-15.9	169.6	0	0	0	0	0	118.5	G897	G895-G897 PolarHBondContact O-N 3.39Å
896	S	48.3	Very low	54	Low	26 Å²	26	78.3 Å²	78.3	18%	0.182	44%	0.436	C	S	.	.			trans	-75.6	93.1	-175.8	36.7	0	0	0	0	112.9	D893 G898 S983	D893-S896 PolarHBondContact OD2-OG 3.24Å; S896-G898 PolarHBondContact O-N 2.92Å; S896-S983 WeakPolarHBondContact CB-O 3.24Å
897	G	53.8	Low	55.1	Low	51 Å²	51	76.6 Å²	76.6	53%	0.526	42%	0.421	S	S	.	.			trans	-68.9	112.6	171.9	0	0	0	0	0	111.4	G895	G895-G897 PolarHBondContact O-N 3.39Å
898	G	57.4	Low	56.2	Low	5 Å²	5	76.5 Å²	76.5	5%	0.052	42%	0.419	C	S	.	.			trans	-69.2	157.4	175.6	0	0	0	0	0	112.5	S883 S896 F981	S883-G898 WeakPolarHBondContact CB-O 3.48Å; S883-G898 PolarHBondContact N-O 3.24Å; S896-G898 PolarHBondContact O-N 2.92Å; G898-F981 CarbonylContact C-O 3.5Å; G898-F981 WeakPolarHBondContact CA-O 3.15Å
899	T	60.8	Low	57.3	Low	30 Å²	30	69.9 Å²	69.9	18%	0.184	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	128.5	168.5	-61	0	0	0	0	108.8	A880 C881 V901 W930 F981	A880-T899 HydrophobicContact CB-CG2 4Å; C881-T899 CarbonylContact O-C 3.58Å; C881-T899 WeakPolarHBondContact O-CA 3.33Å; C881-T899 WeakPolarHBondContact O-CG2 3.47Å; T899-V901 HydrophobicContact CG2-CG2 4.41Å; T899-W930 WeakPolarHBondContact OG1-CH2 3.48Å; T899-F981 PolarHBondContact N-O 2.84Å; T899-F981 PolarHBondContact O-N 3.07Å
900	L	64.1	Low	57.9	Low	34 Å²	34	65.4 Å²	65.4	18%	0.178	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.9	168.4	-59.6	176.2	0	0	0	108.3	A880 C881 F902 V978 L979 Q980	A880-L900 CarbonylContact C-O 3.59Å; A880-L900 WeakPolarHBondContact CA-O 3.31Å; C881-L900 PolarHBondContact N-O 3.47Å; C881-L900 PolarHBondContact O-N 3.04Å; L900-F902 HydrophobicContact CB-CE2 4.39Å; L900-V978 HydrophobicContact CB-CG1 4.03Å; L900-V978 HydrophobicContact CD1-CG1 4.2Å; L900-V978 HydrophobicContact CD2-CG1 4.04Å; L900-V978 HydrophobicContact CG-CG1 4.31Å; L900-L979 CarbonylContact C-O 3.56Å; L900-L979 VanDerWaalsContact CA-O 3.27Å; L900-L979 WeakPolarHBondContact CA-O 3.27Å; L900-Q980 HydrophobicContact CD2-CB 3.63Å; L900-Q980 HydrophobicContact CD2-CG 3.85Å
901	V	62.3	Low	58.7	Low	8 Å²	8	67 Å²	67	5%	0.048	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.1	168.1	-176	0	0	0	0	107.7	A878 S879 A880 T899 I903 F965 L979 F981	A878-V901 HydrophobicContact CB-CG1 4.33Å; S879-V901 CarbonylContact O-C 3.52Å; S879-V901 WeakPolarHBondContact O-CA 3.39Å; A880-V901 HydrophobicContact CB-CG2 4.31Å; T899-V901 HydrophobicContact CG2-CG2 4.41Å; V901-I903 HydrophobicContact CG1-CD1 4.41Å; V901-I903 HydrophobicContact CG1-CG1 3.89Å; V901-F965 HydrophobicContact CG2-CE2 4.17Å; V901-F965 HydrophobicContact CG2-CZ 4.34Å; V901-L979 PolarHBondContact N-O 3.32Å; V901-L979 PolarHBondContact O-N 3.39Å; V901-F981 HydrophobicContact CB-CD2 4.46Å; V901-F981 HydrophobicContact CB-CE2 3.9Å; V901-F981 HydrophobicContact CG2-CD2 3.86Å; V901-F981 HydrophobicContact CG2-CE2 3.63Å
902	F	63.2	Low	59.2	Low	58 Å²	58	62.9 Å²	62.9	25%	0.254	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	137	165.1	-59.6	-88.3	0	0	0	108.2	A878 S879 L900 T976 K977 V978	A878-F902 VanDerWaalsContact CA-O 3.32Å; A878-F902 WeakPolarHBondContact CA-O 3.49Å; S879-F902 PolarHBondContact N-O 3.06Å; S879-F902 PolarHBondContact O-N 3.23Å; L900-F902 HydrophobicContact CB-CE2 4.39Å; F902-T976 HydrophobicContact CB-CG2 4.15Å; F902-T976 HydrophobicContact CD1-CG2 3.81Å; F902-T976 HydrophobicContact CG-CG2 4.44Å; F902-K977 WeakPolarHBondContact CA-O 3.44Å; F902-V978 HydrophobicContact CD1-CB 4.3Å; F902-V978 HydrophobicContact CD1-CG1 4.09Å; F902-V978 HydrophobicContact CD1-CG2 3.72Å; F902-V978 HydrophobicContact CE1-CB 4.2Å; F902-V978 HydrophobicContact CE1-CG1 3.74Å; F902-V978 HydrophobicContact CE1-CG2 3.52Å; F902-V978 HydrophobicContact CZ-CG1 4.12Å
903	I	64.8	Low	59.2	Low	16 Å²	16	60.2 Å²	60.2	8%	0.082	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	116.2	171.7	-43.7	171.9	0	0	0	109.2	V876 A878 V901 V905 A967 F969 K977 L979	V876-I903 HydrophobicContact CG1-CG2 3.37Å; A878-I903 HydrophobicContact CB-CG1 4.45Å; V901-I903 HydrophobicContact CG1-CD1 4.41Å; V901-I903 HydrophobicContact CG1-CG1 3.89Å; I903-V905 HydrophobicContact CG2-CG2 4.18Å; I903-A967 HydrophobicContact CD1-CB 4.21Å; I903-F969 HydrophobicContact CB-CE1 4.01Å; I903-F969 HydrophobicContact CB-CZ 4.44Å; I903-F969 HydrophobicContact CD1-CE1 3.84Å; I903-F969 HydrophobicContact CD1-CZ 3.88Å; I903-F969 HydrophobicContact CG1-CE1 4.5Å; I903-F969 HydrophobicContact CG2-CD1 4.38Å; I903-F969 HydrophobicContact CG2-CE1 3.36Å; I903-F969 HydrophobicContact CG2-CZ 3.54Å; I903-K977 PolarHBondContact N-O 3.19Å; I903-K977 PolarHBondContact O-N 3.38Å; I903-L979 HydrophobicContact CD1-CD1 3.95Å
904	D	63.8	Low	59.7	Low	53 Å²	53	59.4 Å²	59.4	28%	0.283	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	137	171.3	-63.6	-53.8	0	0	0	108.5	V876 Q877 T976	V876-D904 WeakPolarHBondContact CA-O 3.39Å; Q877-D904 HydrophobicContact CB-CB 4.44Å; Q877-D904 PolarHBondContact N-O 3.31Å; Q877-D904 PolarHBondContact O-N 2.77Å; D904-T976 VanDerWaalsContact OD1-CA 3.3Å; D904-T976 WeakPolarHBondContact OD1-CA 3.39Å; D904-T976 WeakPolarHBondContact OD1-CB 3.4Å; D904-T976 VanDerWaalsContact OD1-CG2 3.31Å; D904-T976 WeakPolarHBondContact OD1-CG2 3.47Å; D904-T976 PolarHBondContact OD1-OG1 3.26Å
905	V	66.7	Low	60.2	Low	9 Å²	9	51.1 Å²	51.1	6%	0.055	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.3	-176.1	178.4	0	0	0	0	108.4	L874 S875 V876 I903 F969 V971	L874-V905 HydrophobicContact CB-CG1 4.19Å; L874-V905 HydrophobicContact CD1-CG1 4.03Å; L874-V905 HydrophobicContact CD2-CG1 3.71Å; L874-V905 HydrophobicContact CG-CG1 4.19Å; S875-V905 CarbonylContact O-C 3.42Å; S875-V905 WeakPolarHBondContact O-CA 3.34Å; V876-V905 HydrophobicContact CG1-CG2 4.23Å; V876-V905 HydrophobicContact CG2-CG1 4.24Å; V876-V905 HydrophobicContact CG2-CG2 4.11Å; I903-V905 HydrophobicContact CG2-CG2 4.18Å; V905-F969 HydrophobicContact CG1-CB 4.24Å; V905-F969 HydrophobicContact CG2-CB 4.19Å; V905-F969 HydrophobicContact CG2-CD1 3.41Å; V905-F969 VanDerWaalsContact CG2-CD1 3.41Å; V905-F969 HydrophobicContact CG2-CE1 3.9Å; V905-F969 HydrophobicContact CG2-CG 3.9Å; V905-V971 HydrophobicContact CB-CB 3.68Å; V905-V971 HydrophobicContact CB-CG1 3.99Å; V905-V971 HydrophobicContact CB-CG2 3.79Å; V905-V971 HydrophobicContact CG1-CB 3.86Å; V905-V971 HydrophobicContact CG1-CG2 4.26Å; V905-V971 HydrophobicContact CG2-CB 4.48Å; V905-V971 HydrophobicContact CG2-CG2 4.06Å; V905-V971 WeakPolarHBondContact O-CG1 3.13Å
906	E	69.8	Low	60.6	Low	100 Å²	100	57.1 Å²	57.1	47%	0.467	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.8	175.8	-179	172.9	-148.9	0	0	109.7	L874 S875 V908	L874-E906 CarbonylContact C-O 3.58Å; L874-E906 WeakPolarHBondContact CA-O 3.42Å; S875-E906 PolarHBondContact N-O 3.11Å; S875-E906 PolarHBondContact O-N 3.1Å; E906-V908 HydrophobicContact CB-CG1 4.48Å; E906-V908 HydrophobicContact CG-CG1 4.03Å; E906-V908 PolarHBondContact O-N 2.89Å
907	N	72	Confident	61	Low	44 Å²	44	63 Å²	63	24%	0.235	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	113	167.2	179.5	9.2	0	0	0	108.9	S873 L874 N909 F918	S873-N907 PolarHBondContact O-OD1 2.61Å; L874-N907 HydrophobicContact CD2-CB 4.14Å; N907-N909 WeakPolarHBondContact OD1-CB 3.23Å; N907-N909 PolarHBondContact OD1-N 2.78Å; N907-F918 HydrophobicContact CB-CD2 4.39Å; N907-F918 HydrophobicContact CB-CE2 4.44Å; N907-F918 WeakPolarHBondContact ND2-CD2 3.46Å; N907-F918 VanDerWaalsContact ND2-CE2 3.26Å; N907-F918 WeakPolarHBondContact ND2-CE2 3.22Å
908	V	75.3	Confident	61.2	Low	45 Å²	45	61.1 Å²	61.1	27%	0.273	35%	0.349	S	S	.	.			trans	-105.8	3.9	-179.8	-67.1	0	0	0	0	112.6	R872 S873 E906 A910	R872-V908 HydrophobicContact CB-CG2 4.16Å; S873-V908 VanDerWaalsContact O-CG2 3.31Å; S873-V908 WeakPolarHBondContact O-CG2 3.21Å; S873-V908 PolarHBondContact O-N 3.08Å; E906-V908 HydrophobicContact CB-CG1 4.48Å; E906-V908 HydrophobicContact CG-CG1 4.03Å; E906-V908 PolarHBondContact O-N 2.89Å; V908-A910 PolarHBondContact O-N 3.4Å; V908-A910 VanDerWaalsContact O-N 3.16Å
909	N	69.8	Low	61.1	Low	20 Å²	20	66.8 Å²	66.8	11%	0.107	37%	0.374	C	S	.	.			trans	-72.2	104.1	170.6	-170.8	-7.6	0	0	0	109.9	L724 R872 S873 N907 S911 E912	L724-N909 WeakPolarHBondContact CD2-ND2 3.46Å; R872-N909 VanDerWaalsContact O-CB 3.24Å; R872-N909 WeakPolarHBondContact O-CB 3.28Å; S873-N909 PolarHBondContact O-N 2.9Å; N907-N909 WeakPolarHBondContact OD1-CB 3.23Å; N907-N909 PolarHBondContact OD1-N 2.78Å; N909-S911 PolarHBondContact OD1-N 3.46Å; N909-E912 PolarHBondContact OD1-N 3.29Å
910	A	59.8	Low	60.8	Low	102 Å²	102	67.5 Å²	67.5	84%	0.843	38%	0.377	S	S	*	.			trans	-104	-9	179.5	0	0	0	0	0	113.7	V908	V908-A910 PolarHBondContact O-N 3.4Å; V908-A910 VanDerWaalsContact O-N 3.16Å
911	S	55.4	Low	60.2	Low	94 Å²	94	70.4 Å²	70.4	66%	0.657	40%	0.395	S	S	*	.	S	Bend	trans	-111.7	-20.7	-157.9	46.5	0	0	0	0	115.8	N909	N909-S911 PolarHBondContact OD1-N 3.46Å
912	E	53.6	Low	59.9	Low	88 Å²	88	74.5 Å²	74.5	41%	0.411	41%	0.414	S	S	.	.			trans	-117	131.9	-175.2	-74	178	-151.3	0	0	113.6	S871 N909 G914	S871-E912 WeakPolarHBondContact CB-OE1 3.22Å; S871-E912 PolarHBondContact OG-OE1 3.28Å; N909-E912 PolarHBondContact OD1-N 3.29Å; E912-G914 PolarHBondContact O-N 3Å; E912-G914 VanDerWaalsContact O-N 3.11Å
913	S	47.3	Very low	59.5	Low	109 Å²	109	73.8 Å²	73.8	76%	0.762	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-6.1	-176.6	49.2	0	0	0	0	115.3
914	G	53.1	Low	59	Low	67 Å²	67	74.6 Å²	74.6	69%	0.691	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-35.2	-168.4	0	0	0	0	0	116.8	E912	E912-G914 PolarHBondContact O-N 3Å; E912-G914 VanDerWaalsContact O-N 3.11Å
915	V	56.6	Low	58.6	Low	44 Å²	44	74 Å²	74	27%	0.267	42%	0.422	S	S	.	.			trans	-128.5	91.3	-172.1	-170.4	0	0	0	0	110.8	L724 F918	L724-V915 HydrophobicContact CD1-CB 4.28Å; L724-V915 HydrophobicContact CD1-CG2 4.08Å; V915-F918 HydrophobicContact CG1-CD2 4.43Å; V915-F918 HydrophobicContact CG1-CE2 3.75Å; V915-F918 HydrophobicContact CG1-CZ 4.08Å
916	R	54.3	Low	57.8	Low	197 Å²	197	78.6 Å²	78.6	74%	0.743	45%	0.454	S	S	*	.			trans	-97.7	-31.9	-178.1	-62.8	-174.7	-177.7	-166.8	-1.3	114.2
917	E	56.6	Low	56.8	Low	148 Å²	148	75.7 Å²	75.7	69%	0.692	45%	0.445	S	S	*	.			trans	-118.1	154.7	-171.5	-75.4	-165.2	-171.2	0	0	112.9
918	F	59.5	Low	55.6	Low	12 Å²	12	81 Å²	81	5%	0.053	47%	0.468	C	S	.	.			trans	-149.2	113.8	-151.7	-92.9	-98.4	0	0	0	110	L874 N907 V915 F958 L970 V971	L874-F918 HydrophobicContact CD1-CD1 3.94Å; L874-F918 HydrophobicContact CD1-CE1 3.84Å; L874-F918 HydrophobicContact CD2-CD1 3.42Å; L874-F918 VanDerWaalsContact CD2-CD1 3.42Å; L874-F918 HydrophobicContact CD2-CE1 3.36Å; L874-F918 HydrophobicContact CD2-CG 4.35Å; L874-F918 HydrophobicContact CD2-CZ 4.2Å; L874-F918 HydrophobicContact CG-CD1 3.95Å; L874-F918 HydrophobicContact CG-CE1 3.55Å; N907-F918 HydrophobicContact CB-CD2 4.39Å; N907-F918 HydrophobicContact CB-CE2 4.44Å; N907-F918 WeakPolarHBondContact ND2-CD2 3.46Å; N907-F918 VanDerWaalsContact ND2-CE2 3.26Å; N907-F918 WeakPolarHBondContact ND2-CE2 3.22Å; V915-F918 HydrophobicContact CG1-CD2 4.43Å; V915-F918 HydrophobicContact CG1-CE2 3.75Å; V915-F918 HydrophobicContact CG1-CZ 4.08Å; F918-F958 HydrophobicContact CD1-CE2 4.37Å; F918-F958 AromaticContact CE1-CD2 3.91Å; F918-F958 HydrophobicContact CE1-CD2 3.91Å; F918-F958 AromaticContact CE1-CE2 3.43Å; F918-F958 HydrophobicContact CE1-CE2 3.43Å; F918-F958 VanDerWaalsContact CE1-CE2 3.43Å; F918-F958 HydrophobicContact CE1-CZ 4.11Å; F918-F958 AromaticContact CZ-CE2 3.92Å; F918-F958 HydrophobicContact CZ-CE2 3.92Å; F918-F958 HydrophobicContact CZ-CZ 4.27Å; F918-L970 VanDerWaalsContact C-C 3.46Å; F918-L970 CarbonylContact C-O 3.53Å; F918-L970 VanDerWaalsContact CA-CB 3.41Å; F918-L970 HydrophobicContact CB-CB 3.52Å; F918-L970 HydrophobicContact CB-CD2 3.99Å; F918-L970 HydrophobicContact CB-CG 4.22Å; F918-L970 HydrophobicContact CD1-CB 3.47Å; F918-L970 VanDerWaalsContact CD1-CB 3.47Å; F918-L970 HydrophobicContact CD1-CD2 3.34Å; F918-L970 HydrophobicContact CD1-CG 3.39Å; F918-L970 HydrophobicContact CE1-CD2 3.88Å; F918-L970 HydrophobicContact CE1-CG 4.05Å; F918-L970 HydrophobicContact CG-CB 3.89Å; F918-L970 HydrophobicContact CG-CD2 3.7Å; F918-L970 HydrophobicContact CG-CG 4.08Å; F918-L970 CarbonylContact O-C 3.54Å; F918-L970 VanDerWaalsContact O-C 3.32Å; F918-V971 PolarHBondContact O-N 3.48Å
919	H	54.1	Low	54.3	Low	124 Å²	124	85 Å²	85	57%	0.574	48%	0.484	S	S	*	.			trans	-122.2	124.2	177.3	-44.4	-63.7	0	0	0	118	V921 L970	H919-V921 PolarHBondContact O-N 2.92Å; H919-L970 VanDerWaalsContact C-CB 3.48Å; H919-L970 CarbonylContact C-O 3.59Å; H919-L970 WeakPolarHBondContact CA-O 3.08Å; H919-L970 VanDerWaalsContact O-CD1 3.32Å; H919-L970 WeakPolarHBondContact O-CD1 3.43Å
920	I	54	Low	53.7	Low	45 Å²	45	87.7 Å²	87.7	23%	0.231	49%	0.492	C	S	.	.			trans	-66.3	115.8	168.8	-71.6	158.7	0	0	0	110.7	V923 Y968 L970 V971 K977	I920-V923 HydrophobicContact CG2-CG2 4.26Å; I920-Y968 WeakPolarHBondContact CA-O 3.44Å; I920-Y968 WeakPolarHBondContact CG1-O 3.37Å; I920-L970 WeakPolarHBondContact CG1-O 3.4Å; I920-L970 PolarHBondContact N-O 3.01Å; I920-V971 HydrophobicContact CD1-CG2 3.72Å; I920-V971 HydrophobicContact CG1-CG2 4.41Å; I920-K977 HydrophobicContact CD1-CD 3.77Å
921	V	52.2	Low	53.3	Low	95 Å²	95	87.7 Å²	87.7	58%	0.576	47%	0.471	S	S	*	.			trans	-94.1	-38.2	178.3	-176.9	0	0	0	0	112.5	H919 F957	H919-V921 PolarHBondContact O-N 2.92Å; V921-F957 HydrophobicContact CB-CE1 4.3Å; V921-F957 HydrophobicContact CG1-CE1 4.35Å; V921-F957 HydrophobicContact CG2-CE1 4.49Å
922	Q	55.8	Low	53.4	Low	94 Å²	94	85.8 Å²	85.8	44%	0.439	45%	0.453	S	S	.	.			trans	-148	158	-173.7	179.9	169.5	-19	0	0	111.2	S924 Y968	Q922-S924 PolarHBondContact NE2-OG 3Å; Q922-Y968 HydrophobicContact CB-CD2 3.77Å; Q922-Y968 HydrophobicContact CB-CE2 4.35Å; Q922-Y968 HydrophobicContact CB-CG 4.36Å; Q922-Y968 HydrophobicContact CG-CD2 3.98Å; Q922-Y968 HydrophobicContact CG-CE2 4.13Å; Q922-Y968 VanDerWaalsContact O-CB 3.31Å; Q922-Y968 WeakPolarHBondContact O-CB 3.27Å; Q922-Y968 WeakPolarHBondContact O-CD2 3.44Å; Q922-Y968 PolarHBondContact O-N 2.77Å; Q922-Y968 VanDerWaalsContact O-N 3.12Å
923	V	55.1	Low	53.3	Low	43 Å²	43	86 Å²	86	26%	0.261	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	134.2	165.2	177.7	0	0	0	0	107.8	I920 L932 A967 L979	I920-V923 HydrophobicContact CG2-CG2 4.26Å; V923-L932 HydrophobicContact CB-CD2 4.17Å; V923-L932 HydrophobicContact CG1-CD1 4.05Å; V923-L932 HydrophobicContact CG1-CD2 3.89Å; V923-A967 HydrophobicContact CG1-CB 4.04Å; V923-A967 HydrophobicContact CG2-CB 4.2Å; V923-L979 HydrophobicContact CG1-CD1 3.88Å
924	S	54.8	Low	53.3	Low	34 Å²	34	90.2 Å²	90.2	24%	0.238	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	145.7	-178.4	-66.8	0	0	0	0	110.7	Q922 S966	Q922-S924 PolarHBondContact NE2-OG 3Å; S924-S966 CarbonylContact C-O 3.34Å; S924-S966 WeakPolarHBondContact CA-O 3.34Å; S924-S966 PolarHBondContact N-O 2.73Å; S924-S966 CarbonylContact O-C 3.57Å; S924-S966 PolarHBondContact O-N 3.05Å
925	S	54.6	Low	52.9	Low	41 Å²	41	93 Å²	93	29%	0.287	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.2	168.7	-173.3	0	0	0	0	108.6	W930	S925-W930 PolarHBondContact OG-O 3.36Å; S925-W930 VanDerWaalsContact OG-O 3.09Å
926	S	49.8	Very low	52.2	Low	105 Å²	105	97.5 Å²	97.5	73%	0.734	47%	0.47	S	S	*	.			trans	-120.5	93.7	168.6	-172.7	0	0	0	0	107.2
927	S	49.4	Very low	51.2	Low	39 Å²	39	93.5 Å²	93.5	27%	0.273	46%	0.464	S	S	.	.			trans	-154.3	139.6	-178.4	-174.7	0	0	0	0	110.4	H929 W930	S927-H929 PolarHBondContact O-N 3.38Å; S927-H929 PolarHBondContact OG-N 3.37Å; S927-W930 PolarHBondContact OG-N 3.18Å; S927-W930 VanDerWaalsContact OG-N 3.16Å
928	Q	46.2	Very low	50.1	Low	154 Å²	154	92 Å²	92	72%	0.72	47%	0.466	S	S	*	.	S	Bend	trans	-73.5	-13.8	171.3	-60.7	-177.3	13.1	0	0	112.5
929	H	49	Very low	48.7	Very low	131 Å²	131	96.4 Å²	96.4	61%	0.606	50%	0.498	S	S	*	.	S	Bend	trans	-125	-21.3	-169.8	-53.7	-49.6	0	0	0	114.5	S927	S927-H929 PolarHBondContact O-N 3.38Å; S927-H929 PolarHBondContact OG-N 3.37Å
930	W	56.4	Low	47.7	Very low	75 Å²	75	97.3 Å²	97.3	28%	0.284	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122	-172.9	-64.9	98.3	0	0	0	113.1	T899 S925 S927 F981	T899-W930 WeakPolarHBondContact OG1-CH2 3.48Å; S925-W930 PolarHBondContact OG-O 3.36Å; S925-W930 VanDerWaalsContact OG-O 3.09Å; S927-W930 PolarHBondContact OG-N 3.18Å; S927-W930 VanDerWaalsContact OG-N 3.16Å; W930-F981 HydrophobicContact CE3-CB 3.77Å; W930-F981 HydrophobicContact CZ3-CB 4.27Å
931	R	52	Low	46.5	Very low	102 Å²	102	101.8 Å²	101.8	39%	0.385	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	136.4	175.7	-62	-180	-168.1	-175.2	2.6	111.1	E795 F981 N984	E795-R931 IonicContact OE1-CZ 3.15Å; E795-R931 IonicContact OE1-NH1 2.69Å; E795-R931 PolarHBondContact OE1-NH1 3.03Å; E795-R931 IonicContact OE1-NH2 2.76Å; E795-R931 PolarHBondContact OE1-NH2 3.41Å; E795-R931 IonicContact OE2-CZ 3.93Å; E795-R931 IonicContact OE2-NH2 2.75Å; E795-R931 PolarHBondContact OE2-NH2 2.92Å; R931-F981 WeakPolarHBondContact O-CA 3.47Å; R931-F981 WeakPolarHBondContact O-CD1 3.4Å; R931-N984 VanDerWaalsContact CZ-ND2 3.27Å; R931-N984 PolarHBondContact NH1-ND2 3.14Å; R931-N984 PolarHBondContact NH2-ND2 3.35Å
932	L	56	Low	45.3	Very low	55 Å²	55	108.3 Å²	108.3	29%	0.288	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	122.5	172.6	-174	77.6	0	0	0	109.3	V923 L979 F981	V923-L932 HydrophobicContact CB-CD2 4.17Å; V923-L932 HydrophobicContact CG1-CD1 4.05Å; V923-L932 HydrophobicContact CG1-CD2 3.89Å; L932-L979 HydrophobicContact CD1-CB 4.37Å; L932-L979 HydrophobicContact CD1-CD1 4.29Å; L932-L979 HydrophobicContact CD1-CD2 4.32Å; L932-F981 HydrophobicContact CB-CD1 4.48Å; L932-F981 HydrophobicContact CB-CE1 4.05Å; L932-F981 HydrophobicContact CD1-CD1 4.31Å; L932-F981 HydrophobicContact CD1-CE1 3.43Å; L932-F981 VanDerWaalsContact CD1-CE1 3.43Å; L932-F981 HydrophobicContact CD1-CE2 4.26Å; L932-F981 HydrophobicContact CD1-CZ 3.4Å; L932-F981 VanDerWaalsContact CD1-CZ 3.4Å; L932-F981 HydrophobicContact CG-CE1 4.36Å
933	H	52.7	Low	44	Very low	93 Å²	93	107.2 Å²	107.2	43%	0.431	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.5	139.1	169.1	-76.9	-32.4	0	0	0	111.6	Y935 Q980	H933-Y935 VanDerWaalsContact C-N 3.33Å; H933-Y935 PolarHBondContact O-N 3.41Å; H933-Q980 PolarHBondContact N-O 3.1Å
934	K	46.3	Very low	42.5	Very low	197 Å²	197	114.7 Å²	114.7	86%	0.857	59%	0.59	S	S	*	*			trans	-83.7	73.8	-171.2	-161.5	178.1	-171.1	178	0	110.8
935	Y	45.1	Very low	40.9	Very low	124 Å²	124	118.7 Å²	118.7	49%	0.486	62%	0.618	S	S	.	*			trans	-89.8	120.3	175.2	-147.7	-92.8	0	0	0	110.5	H933	H933-Y935 VanDerWaalsContact C-N 3.33Å; H933-Y935 PolarHBondContact O-N 3.41Å
936	I	42.2	Very low	39.4	Very low	140 Å²	140	124.7 Å²	124.7	72%	0.718	65%	0.646	S	S	*	*			trans	-133.2	89.2	174.3	-55	176.4	0	0	0	108.5
937	N	32.3	Very low	38	Very low	113 Å²	113	127.8 Å²	127.8	60%	0.604	65%	0.653	S	S	*	*			trans	-171.2	129.8	145.2	-130.5	2.4	0	0	0	112.6
938	P	34.7	Very low	36.8	Very low	115 Å²	115	135.6 Å²	135.6	75%	0.747	68%	0.682	S	S	*	*			trans	-97.6	116.9	141.9	31.6	-21.8	0	0	0	108.7
939	C	30	Very low	35.5	Very low	106 Å²	106	132 Å²	132	72%	0.716	69%	0.687	S	S	*	*			trans	-68.2	136.1	176.7	-66.8	0	0	0	0	111.2
940	N	33.3	Very low	34.1	Very low	143 Å²	143	132.3 Å²	132.3	77%	0.765	70%	0.698	S	S	*	*	S	Bend	trans	25.5	99.5	159.6	-66.3	-6.1	0	0	0	118.2
941	N	28.7	Very low	32.4	Very low	139 Å²	139	135 Å²	135	74%	0.743	72%	0.722	S	S	*	*				178	159.5	97.7	-90.6	-30.2	0	0	0	113.5
942	Y	25.8	Very low	30.9	Very low	231 Å²	231	134.7 Å²	134.7	91%	0.906	74%	0.736	S	S	*	*	S	Bend	trans	73.4	118.5	-178.2	-60.7	-74	0	0	0	115.5
943	G	29.4	Very low	29.3	Very low	72 Å²	72	137.8 Å²	137.8	74%	0.742	75%	0.752	S	S	*	*			trans	-98.7	150.8	-155.8	0	0	0	0	0	115.1
944	K	23.1	Very low	27.8	Very low	200 Å²	200	137.7 Å²	137.7	87%	0.87	75%	0.754	S	S	*	*			trans	-154	110.6	135.7	-105.2	159	-175.4	179	0	109.2
945	S	22.8	Very low	26.7	Very low	118 Å²	118	133.1 Å²	133.1	83%	0.825	73%	0.734	S	S	*	*			trans	30.6	101.4	156.5	51	0	0	0	0	118.7
946	I	21.7	Very low	25.6	Very low	167 Å²	167	130 Å²	130	86%	0.856	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-87.7	123.7	163	-62.3	169.6	0	0	0	108.9
947	L	20.9	Very low	25.2	Very low	169 Å²	169	127 Å²	127	89%	0.885	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-100.1	125.1	165.5	-105.6	160.9	0	0	0	109.5
948	K	23.7	Very low	25.1	Very low	203 Å²	203	121.8 Å²	121.8	88%	0.883	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-87.4	130.6	166.1	-82.3	-177.4	173.8	178.8	0	108.9
949	G	20.2	Very low	25.1	Very low	80 Å²	80	118.3 Å²	118.3	83%	0.825	66%	0.657	S	S	*	*			trans	-161.8	135.9	172.8	0	0	0	0	0	111.1
950	T	19.1	Very low	25.3	Very low	136 Å²	136	115.2 Å²	115.2	83%	0.834	63%	0.633	S	S	*	*			trans	-96.7	137.1	-175.9	14.3	0	0	0	0	112.6
951	V	21.1	Very low	25.1	Very low	131 Å²	131	112.9 Å²	112.9	79%	0.794	63%	0.628	S	S	*	*			trans	75.2	141.5	149.5	176.7	0	0	0	0	118.8
952	S	19.7	Very low	25.1	Very low	97 Å²	97	109.5 Å²	109.5	68%	0.678	61%	0.609	S	S	*	*			trans	85.8	102.6	162.6	-74.2	0	0	0	0	122.2
953	L	21.9	Very low	25.1	Very low	120 Å²	120	103.7 Å²	103.7	63%	0.628	60%	0.603	S	S	*	*				72.3	130.2	122.3	-70.4	166.2	0	0	0	122.8
954	L	21.3	Very low	24.9	Very low	90 Å²	90	106 Å²	106	47%	0.471	59%	0.592	S	S	.	*			trans	69	146.7	155.8	-87.9	71.4	0	0	0	117.1	N776	N776-L954 WeakPolarHBondContact ND2-CD1 3.22Å; N776-L954 WeakPolarHBondContact ND2-CG 3.43Å
955	K	22.9	Very low	25.3	Very low	101 Å²	101	98.8 Å²	98.8	44%	0.439	56%	0.561	S	S	.	*			cis	-157.9	159.2	-5	-138	170.6	-158	175.2	0	108	E775 N776	E775-K955 IonicContact OE2-NZ 3.13Å; E775-K955 PolarHBondContact OE2-NZ 3.34Å; N776-K955 WeakPolarHBondContact OD1-CE 3.4Å
956	C	22.5	Very low	25.6	Very low	59 Å²	59	93.9 Å²	93.9	40%	0.399	53%	0.527	S	S	.	.			trans	116.2	127.7	174.5	-71.1	0	0	0	0	113.1	L970	C956-L970 HydrophobicContact CB-CD2 4.23Å; C956-L970 WeakPolarHBondContact O-CD1 3.41Å
957	F	33.2	Very low	26	Very low	77 Å²	77	86.2 Å²	86.2	34%	0.338	49%	0.489	S	S	.	.			trans	-137.6	122.1	-172.3	-63.1	-78.6	0	0	0	111.6	I728 V921 Y968	I728-F957 PolarHBondContact N-O 2.95Å; V921-F957 HydrophobicContact CB-CE1 4.3Å; V921-F957 HydrophobicContact CG1-CE1 4.35Å; V921-F957 HydrophobicContact CG2-CE1 4.49Å; F957-Y968 HydrophobicContact CD1-CD1 4.14Å
958	F	31.1	Very low	26.7	Very low	4 Å²	4	79 Å²	79	2%	0.018	45%	0.45	C	S	.	.	B	Isolated β-bridge	trans	-106.4	138.2	168.6	-74.9	-80.5	0	0	0	110.5	L724 C725 E727 L874 F918 L970	L724-F958 HydrophobicContact CB-CE1 3.56Å; L724-F958 HydrophobicContact CB-CZ 3.7Å; L724-F958 HydrophobicContact CD1-CE1 4.5Å; L724-F958 HydrophobicContact CD1-CZ 3.75Å; L724-F958 HydrophobicContact CG-CZ 4.35Å; C725-F958 WeakPolarHBondContact O-CD1 3.26Å; E727-F958 HydrophobicContact CB-CD1 4.43Å; E727-F958 HydrophobicContact CB-CE1 3.98Å; L874-F958 HydrophobicContact CD1-CB 4.15Å; L874-F958 HydrophobicContact CD1-CD2 4.04Å; L874-F958 HydrophobicContact CD1-CG 4.05Å; F918-F958 HydrophobicContact CD1-CE2 4.37Å; F918-F958 AromaticContact CE1-CD2 3.91Å; F918-F958 HydrophobicContact CE1-CD2 3.91Å; F918-F958 AromaticContact CE1-CE2 3.43Å; F918-F958 HydrophobicContact CE1-CE2 3.43Å; F918-F958 VanDerWaalsContact CE1-CE2 3.43Å; F918-F958 HydrophobicContact CE1-CZ 4.11Å; F918-F958 AromaticContact CZ-CE2 3.92Å; F918-F958 HydrophobicContact CZ-CE2 3.92Å; F918-F958 HydrophobicContact CZ-CZ 4.27Å; F958-L970 HydrophobicContact CD2-CD1 4.18Å; F958-L970 HydrophobicContact CD2-CD2 4.17Å; F958-L970 HydrophobicContact CD2-CG 3.87Å; F958-L970 HydrophobicContact CE2-CD2 4.19Å; F958-L970 HydrophobicContact CE2-CG 4.37Å
959	F	34.2	Very low	26.9	Very low	42 Å²	42	69.7 Å²	69.7	18%	0.184	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	108.5	179.5	-168.8	-92.8	0	0	0	111.5	G726 I728 Y780 R832 S966 Y968	G726-F959 PolarHBondContact O-N 3.23Å; I728-F959 HydrophobicContact CD1-CB 3.69Å; I728-F959 HydrophobicContact CD1-CD2 4.33Å; I728-F959 HydrophobicContact CD1-CG 4.11Å; I728-F959 HydrophobicContact CG1-CB 4.19Å; Y780-F959 HydrophobicContact CE1-CE2 4.01Å; Y780-F959 AromaticContact CZ-CD2 3.87Å; Y780-F959 AromaticContact CZ-CE2 3.68Å; Y780-F959 WeakPolarHBondContact OH-CD2 3.31Å; Y780-F959 WeakPolarHBondContact OH-CE2 3.4Å; R832-F959 PolarHBondContact NH2-O 2.96Å; F959-S966 WeakPolarHBondContact CE2-OG 3.38Å; F959-Y968 HydrophobicContact CD2-CE1 4.2Å
960	L	33.7	Very low	27.5	Very low	41 Å²	41	66.3 Å²	66.3	22%	0.215	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.5	171.8	-105.9	100.1	0	0	0	110.9	V876 F969	V876-L960 HydrophobicContact CB-CD2 3.49Å; V876-L960 VanDerWaalsContact CB-CD2 3.49Å; V876-L960 HydrophobicContact CG1-CD2 4.06Å; V876-L960 HydrophobicContact CG2-CD1 3.76Å; V876-L960 HydrophobicContact CG2-CD2 3.59Å; V876-L960 HydrophobicContact CG2-CG 4.28Å; L960-F969 HydrophobicContact CB-CD2 3.94Å; L960-F969 HydrophobicContact CB-CE2 3.67Å; L960-F969 HydrophobicContact CD1-CD2 4.05Å; L960-F969 HydrophobicContact CD1-CE2 4.45Å; L960-F969 HydrophobicContact CD2-CE2 4.35Å; L960-F969 HydrophobicContact CG-CD2 4.45Å; L960-F969 HydrophobicContact CG-CE2 4.38Å
961	S	30.3	Very low	28	Very low	93 Å²	93	60.1 Å²	60.1	65%	0.65	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	113.2	170.4	-175	0	0	0	0	109.3
962	L	29.4	Very low	28.2	Very low	68 Å²	68	58.3 Å²	58.3	36%	0.356	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	149	156.1	-76.7	158.8	0	0	0	106.4	A878 F964 F965	A878-L962 HydrophobicContact CB-CD1 3.45Å; A878-L962 VanDerWaalsContact CB-CD1 3.45Å; L962-F964 PolarHBondContact O-N 3.19Å; L962-F965 PolarHBondContact N-O 3.46Å; L962-F965 PolarHBondContact O-N 3.3Å; L962-F965 VanDerWaalsContact O-O 3.12Å
963	S	25.7	Very low	28.7	Very low	110 Å²	110	62.9 Å²	62.9	77%	0.769	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-4.2	-159.7	-41.8	0	0	0	0	118.2
964	F	24.3	Very low	29.4	Very low	119 Å²	119	60.8 Å²	60.8	52%	0.522	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.2	1.4	176	-64.6	-79.4	0	0	0	114.8	L962	L962-F964 PolarHBondContact O-N 3.19Å
965	F	30.9	Very low	30.2	Very low	50 Å²	50	58 Å²	58	22%	0.219	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	150.9	-167.1	-53	-65.5	0	0	0	114.2	V901 L962 F981	V901-F965 HydrophobicContact CG2-CE2 4.17Å; V901-F965 HydrophobicContact CG2-CZ 4.34Å; L962-F965 PolarHBondContact N-O 3.46Å; L962-F965 PolarHBondContact O-N 3.3Å; L962-F965 VanDerWaalsContact O-O 3.12Å; F965-F981 HydrophobicContact CD1-CD1 4.35Å; F965-F981 AromaticContact CD1-CE1 3.54Å; F965-F981 HydrophobicContact CD1-CE1 3.54Å; F965-F981 HydrophobicContact CD1-CE2 4.48Å; F965-F981 AromaticContact CD1-CZ 3.61Å; F965-F981 HydrophobicContact CD1-CZ 3.61Å; F965-F981 AromaticContact CE1-CD1 3.62Å; F965-F981 HydrophobicContact CE1-CD1 3.62Å; F965-F981 HydrophobicContact CE1-CD2 4.37Å; F965-F981 AromaticContact CE1-CE1 3.25Å; F965-F981 HydrophobicContact CE1-CE1 3.25Å; F965-F981 HydrophobicContact CE1-CE2 4.08Å; F965-F981 HydrophobicContact CE1-CG 4.17Å; F965-F981 AromaticContact CE1-CZ 3.5Å; F965-F981 HydrophobicContact CE1-CZ 3.5Å; F965-F981 HydrophobicContact CG-CZ 4.43Å; F965-F981 HydrophobicContact CZ-CD1 4.39Å; F965-F981 HydrophobicContact CZ-CE1 4.24Å; F965-F981 HydrophobicContact CZ-CE2 4.37Å; F965-F981 HydrophobicContact CZ-CZ 4.22Å
966	S	29.7	Very low	30.7	Very low	14 Å²	14	57.1 Å²	57.1	10%	0.098	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	105	172.9	175.7	0	0	0	0	110.9	S924 F959	S924-S966 CarbonylContact C-O 3.34Å; S924-S966 WeakPolarHBondContact CA-O 3.34Å; S924-S966 PolarHBondContact N-O 2.73Å; S924-S966 CarbonylContact O-C 3.57Å; S924-S966 PolarHBondContact O-N 3.05Å; F959-S966 WeakPolarHBondContact CE2-OG 3.38Å
967	A	30.8	Very low	31.7	Very low	7 Å²	7	59.1 Å²	59.1	6%	0.058	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.2	177.4	0	0	0	0	0	110.1	I903 V923 F969	I903-A967 HydrophobicContact CD1-CB 4.21Å; V923-A967 HydrophobicContact CG1-CB 4.04Å; V923-A967 HydrophobicContact CG2-CB 4.2Å; A967-F969 HydrophobicContact CB-CD1 4.2Å; A967-F969 HydrophobicContact CB-CE1 3.51Å; A967-F969 HydrophobicContact CB-CE2 3.87Å; A967-F969 HydrophobicContact CB-CZ 3.34Å; A967-F969 WeakPolarHBondContact O-CD2 3.18Å; A967-F969 WeakPolarHBondContact O-CE2 3.14Å; A967-F969 PolarHBondContact O-N 2.82Å
968	Y	34.3	Very low	31.7	Very low	16 Å²	16	58.3 Å²	58.3	6%	0.063	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	93.9	179.4	-60.8	-94.1	0	0	0	107.8	Y780 I920 Q922 F957 F959	Y780-Y968 WeakPolarHBondContact CD2-OH 3.35Å; Y780-Y968 HydrophobicContact CE2-CE1 4.02Å; Y780-Y968 VanDerWaalsContact CE2-OH 3.22Å; Y780-Y968 WeakPolarHBondContact CE2-OH 3.29Å; I920-Y968 WeakPolarHBondContact CA-O 3.44Å; I920-Y968 WeakPolarHBondContact CG1-O 3.37Å; Q922-Y968 HydrophobicContact CB-CD2 3.77Å; Q922-Y968 HydrophobicContact CB-CE2 4.35Å; Q922-Y968 HydrophobicContact CB-CG 4.36Å; Q922-Y968 HydrophobicContact CG-CD2 3.98Å; Q922-Y968 HydrophobicContact CG-CE2 4.13Å; Q922-Y968 VanDerWaalsContact O-CB 3.31Å; Q922-Y968 WeakPolarHBondContact O-CB 3.27Å; Q922-Y968 WeakPolarHBondContact O-CD2 3.44Å; Q922-Y968 PolarHBondContact O-N 2.77Å; Q922-Y968 VanDerWaalsContact O-N 3.12Å; F957-Y968 HydrophobicContact CD1-CD1 4.14Å; F959-Y968 HydrophobicContact CD2-CE1 4.2Å
969	F	29.4	Very low	32	Very low	8 Å²	8	59.6 Å²	59.6	4%	0.035	34%	0.342	C	S	.	.			trans	-85.7	138.5	-171.9	-61.5	-66.2	0	0	0	112.9	L874 V876 I903 V905 L960 A967	L874-F969 HydrophobicContact CD1-CB 3.66Å; L874-F969 VanDerWaalsContact CD1-O 3.27Å; L874-F969 WeakPolarHBondContact CD1-O 3.34Å; V876-F969 HydrophobicContact CG1-CD2 4.41Å; V876-F969 HydrophobicContact CG1-CE1 4.29Å; V876-F969 HydrophobicContact CG1-CE2 3.86Å; V876-F969 HydrophobicContact CG1-CZ 3.76Å; V876-F969 HydrophobicContact CG2-CD2 3.92Å; V876-F969 HydrophobicContact CG2-CE2 4.14Å; V876-F969 HydrophobicContact CG2-CG 4.29Å; I903-F969 HydrophobicContact CB-CE1 4.01Å; I903-F969 HydrophobicContact CB-CZ 4.44Å; I903-F969 HydrophobicContact CD1-CE1 3.84Å; I903-F969 HydrophobicContact CD1-CZ 3.88Å; I903-F969 HydrophobicContact CG1-CE1 4.5Å; I903-F969 HydrophobicContact CG2-CD1 4.38Å; I903-F969 HydrophobicContact CG2-CE1 3.36Å; I903-F969 HydrophobicContact CG2-CZ 3.54Å; V905-F969 HydrophobicContact CG1-CB 4.24Å; V905-F969 HydrophobicContact CG2-CB 4.19Å; V905-F969 HydrophobicContact CG2-CD1 3.41Å; V905-F969 VanDerWaalsContact CG2-CD1 3.41Å; V905-F969 HydrophobicContact CG2-CE1 3.9Å; V905-F969 HydrophobicContact CG2-CG 3.9Å; L960-F969 HydrophobicContact CB-CD2 3.94Å; L960-F969 HydrophobicContact CB-CE2 3.67Å; L960-F969 HydrophobicContact CD1-CD2 4.05Å; L960-F969 HydrophobicContact CD1-CE2 4.45Å; L960-F969 HydrophobicContact CD2-CE2 4.35Å; L960-F969 HydrophobicContact CG-CD2 4.45Å; L960-F969 HydrophobicContact CG-CE2 4.38Å; A967-F969 HydrophobicContact CB-CD1 4.2Å; A967-F969 HydrophobicContact CB-CE1 3.51Å; A967-F969 HydrophobicContact CB-CE2 3.87Å; A967-F969 HydrophobicContact CB-CZ 3.34Å; A967-F969 WeakPolarHBondContact O-CD2 3.18Å; A967-F969 WeakPolarHBondContact O-CE2 3.14Å; A967-F969 PolarHBondContact O-N 2.82Å
970	L	32.8	Very low	32	Very low	9 Å²	9	58.1 Å²	58.1	5%	0.047	34%	0.335	C	S	.	.			trans	-162.3	127.9	148.7	-71	102.8	0	0	0	107.3	F918 H919 I920 C956 F958	F918-L970 VanDerWaalsContact C-C 3.46Å; F918-L970 CarbonylContact C-O 3.53Å; F918-L970 VanDerWaalsContact CA-CB 3.41Å; F918-L970 HydrophobicContact CB-CB 3.52Å; F918-L970 HydrophobicContact CB-CD2 3.99Å; F918-L970 HydrophobicContact CB-CG 4.22Å; F918-L970 HydrophobicContact CD1-CB 3.47Å; F918-L970 VanDerWaalsContact CD1-CB 3.47Å; F918-L970 HydrophobicContact CD1-CD2 3.34Å; F918-L970 HydrophobicContact CD1-CG 3.39Å; F918-L970 HydrophobicContact CE1-CD2 3.88Å; F918-L970 HydrophobicContact CE1-CG 4.05Å; F918-L970 HydrophobicContact CG-CB 3.89Å; F918-L970 HydrophobicContact CG-CD2 3.7Å; F918-L970 HydrophobicContact CG-CG 4.08Å; F918-L970 CarbonylContact O-C 3.54Å; F918-L970 VanDerWaalsContact O-C 3.32Å; H919-L970 VanDerWaalsContact C-CB 3.48Å; H919-L970 CarbonylContact C-O 3.59Å; H919-L970 WeakPolarHBondContact CA-O 3.08Å; H919-L970 VanDerWaalsContact O-CD1 3.32Å; H919-L970 WeakPolarHBondContact O-CD1 3.43Å; I920-L970 WeakPolarHBondContact CG1-O 3.4Å; I920-L970 PolarHBondContact N-O 3.01Å; C956-L970 HydrophobicContact CB-CD2 4.23Å; C956-L970 WeakPolarHBondContact O-CD1 3.41Å; F958-L970 HydrophobicContact CD2-CD1 4.18Å; F958-L970 HydrophobicContact CD2-CD2 4.17Å; F958-L970 HydrophobicContact CD2-CG 3.87Å; F958-L970 HydrophobicContact CE2-CD2 4.19Å; F958-L970 HydrophobicContact CE2-CG 4.37Å
971	V	28	Very low	32	Very low	6 Å²	6	56.4 Å²	56.4	4%	0.036	33%	0.326	C	S	.	.			trans	-139.4	144.9	-165.2	151.8	0	0	0	0	113.5	V905 F918 I920 S975	V905-V971 HydrophobicContact CB-CB 3.68Å; V905-V971 HydrophobicContact CB-CG1 3.99Å; V905-V971 HydrophobicContact CB-CG2 3.79Å; V905-V971 HydrophobicContact CG1-CB 3.86Å; V905-V971 HydrophobicContact CG1-CG2 4.26Å; V905-V971 HydrophobicContact CG2-CB 4.48Å; V905-V971 HydrophobicContact CG2-CG2 4.06Å; V905-V971 WeakPolarHBondContact O-CG1 3.13Å; F918-V971 PolarHBondContact O-N 3.48Å; I920-V971 HydrophobicContact CD1-CG2 3.72Å; I920-V971 HydrophobicContact CG1-CG2 4.41Å; V971-S975 VanDerWaalsContact CG1-OG 3.28Å; V971-S975 WeakPolarHBondContact CG1-OG 3.33Å
972	P	26.1	Very low	32.2	Very low	94 Å²	94	52.7 Å²	52.7	61%	0.61	30%	0.299	S	S	*	.			trans	-77	149.4	168.7	33.3	-35.2	0	0	0	112	G974 S975	P972-G974 PolarHBondContact O-N 2.96Å; P972-S975 PolarHBondContact O-N 3.31Å
973	K	31.1	Very low	32.2	Very low	192 Å²	192	50.7 Å²	50.7	84%	0.835	29%	0.291	S	S	*	.	S	Bend	trans	-42.4	109.1	-172.8	-130	179.7	-174.3	-179.3	0	113.3
974	G	35.6	Very low	32.4	Very low	77 Å²	77	50.2 Å²	50.2	79%	0.794	28%	0.28	S	S	*	.	S	Bend	trans	78.5	53.4	178	0	0	0	0	0	115.3	P972	P972-G974 PolarHBondContact O-N 2.96Å
975	S	38.4	Very low	32.6	Very low	32 Å²	32	54.1 Å²	54.1	22%	0.224	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.5	171.9	114.2	0	0	0	0	112.3	V971 P972	V971-S975 VanDerWaalsContact CG1-OG 3.28Å; V971-S975 WeakPolarHBondContact CG1-OG 3.33Å; P972-S975 PolarHBondContact O-N 3.31Å
976	T	34.3	Very low	32.4	Very low	81 Å²	81	62.7 Å²	62.7	50%	0.497	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	132.5	170.2	-48.6	0	0	0	0	110.3	F902 D904	F902-T976 HydrophobicContact CB-CG2 4.15Å; F902-T976 HydrophobicContact CD1-CG2 3.81Å; F902-T976 HydrophobicContact CG-CG2 4.44Å; D904-T976 VanDerWaalsContact OD1-CA 3.3Å; D904-T976 WeakPolarHBondContact OD1-CA 3.39Å; D904-T976 WeakPolarHBondContact OD1-CB 3.4Å; D904-T976 VanDerWaalsContact OD1-CG2 3.31Å; D904-T976 WeakPolarHBondContact OD1-CG2 3.47Å; D904-T976 PolarHBondContact OD1-OG1 3.26Å
977	K	42.1	Very low	32.2	Very low	102 Å²	102	70.9 Å²	70.9	44%	0.443	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	144.6	167.1	-73.5	-169.3	-177.6	178.2	0	111.6	F902 I903 I920	F902-K977 WeakPolarHBondContact CA-O 3.44Å; I903-K977 PolarHBondContact N-O 3.19Å; I903-K977 PolarHBondContact O-N 3.38Å; I920-K977 HydrophobicContact CD1-CD 3.77Å
978	V	32.9	Very low	31.9	Very low	59 Å²	59	79.6 Å²	79.6	36%	0.358	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.3	-178.7	-159.3	0	0	0	0	110	L900 F902	L900-V978 HydrophobicContact CB-CG1 4.03Å; L900-V978 HydrophobicContact CD1-CG1 4.2Å; L900-V978 HydrophobicContact CD2-CG1 4.04Å; L900-V978 HydrophobicContact CG-CG1 4.31Å; F902-V978 HydrophobicContact CD1-CB 4.3Å; F902-V978 HydrophobicContact CD1-CG1 4.09Å; F902-V978 HydrophobicContact CD1-CG2 3.72Å; F902-V978 HydrophobicContact CE1-CB 4.2Å; F902-V978 HydrophobicContact CE1-CG1 3.74Å; F902-V978 HydrophobicContact CE1-CG2 3.52Å; F902-V978 HydrophobicContact CZ-CG1 4.12Å
979	L	37.9	Very low	31.4	Very low	32 Å²	32	85.8 Å²	85.8	17%	0.168	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.2	176.9	-63.9	171.4	0	0	0	110.2	L900 V901 I903 V923 L932 F981	L900-L979 CarbonylContact C-O 3.56Å; L900-L979 VanDerWaalsContact CA-O 3.27Å; L900-L979 WeakPolarHBondContact CA-O 3.27Å; V901-L979 PolarHBondContact N-O 3.32Å; V901-L979 PolarHBondContact O-N 3.39Å; I903-L979 HydrophobicContact CD1-CD1 3.95Å; V923-L979 HydrophobicContact CG1-CD1 3.88Å; L932-L979 HydrophobicContact CD1-CB 4.37Å; L932-L979 HydrophobicContact CD1-CD1 4.29Å; L932-L979 HydrophobicContact CD1-CD2 4.32Å; L979-F981 HydrophobicContact CB-CE2 3.75Å; L979-F981 HydrophobicContact CB-CZ 4.25Å
980	Q	33.9	Very low	31.1	Very low	10 Å²	10	92.4 Å²	92.4	5%	0.047	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	133.8	178.1	-170.7	169.2	-4.7	0	0	111.8	S883 A885 L900 H933	S883-Q980 PolarHBondContact OG-NE2 2.92Å; A885-Q980 PolarHBondContact O-NE2 3.03Å; L900-Q980 HydrophobicContact CD2-CB 3.63Å; L900-Q980 HydrophobicContact CD2-CG 3.85Å; H933-Q980 PolarHBondContact N-O 3.1Å
981	F	33.4	Very low	30.7	Very low	5 Å²	5	96.3 Å²	96.3	2%	0.022	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.2	176.3	-59.4	-96.4	0	0	0	110.2	G898 T899 V901 W930 R931 L932 F965 L979	G898-F981 CarbonylContact C-O 3.5Å; G898-F981 WeakPolarHBondContact CA-O 3.15Å; T899-F981 PolarHBondContact N-O 2.84Å; T899-F981 PolarHBondContact O-N 3.07Å; V901-F981 HydrophobicContact CB-CD2 4.46Å; V901-F981 HydrophobicContact CB-CE2 3.9Å; V901-F981 HydrophobicContact CG2-CD2 3.86Å; V901-F981 HydrophobicContact CG2-CE2 3.63Å; W930-F981 HydrophobicContact CE3-CB 3.77Å; W930-F981 HydrophobicContact CZ3-CB 4.27Å; R931-F981 WeakPolarHBondContact O-CA 3.47Å; R931-F981 WeakPolarHBondContact O-CD1 3.4Å; L932-F981 HydrophobicContact CB-CD1 4.48Å; L932-F981 HydrophobicContact CB-CE1 4.05Å; L932-F981 HydrophobicContact CD1-CD1 4.31Å; L932-F981 HydrophobicContact CD1-CE1 3.43Å; L932-F981 VanDerWaalsContact CD1-CE1 3.43Å; L932-F981 HydrophobicContact CD1-CE2 4.26Å; L932-F981 HydrophobicContact CD1-CZ 3.4Å; L932-F981 VanDerWaalsContact CD1-CZ 3.4Å; L932-F981 HydrophobicContact CG-CE1 4.36Å; F965-F981 HydrophobicContact CD1-CD1 4.35Å; F965-F981 AromaticContact CD1-CE1 3.54Å; F965-F981 HydrophobicContact CD1-CE1 3.54Å; F965-F981 HydrophobicContact CD1-CE2 4.48Å; F965-F981 AromaticContact CD1-CZ 3.61Å; F965-F981 HydrophobicContact CD1-CZ 3.61Å; F965-F981 AromaticContact CE1-CD1 3.62Å; F965-F981 HydrophobicContact CE1-CD1 3.62Å; F965-F981 HydrophobicContact CE1-CD2 4.37Å; F965-F981 AromaticContact CE1-CE1 3.25Å; F965-F981 HydrophobicContact CE1-CE1 3.25Å; F965-F981 HydrophobicContact CE1-CE2 4.08Å; F965-F981 HydrophobicContact CE1-CG 4.17Å; F965-F981 AromaticContact CE1-CZ 3.5Å; F965-F981 HydrophobicContact CE1-CZ 3.5Å; F965-F981 HydrophobicContact CG-CZ 4.43Å; F965-F981 HydrophobicContact CZ-CD1 4.39Å; F965-F981 HydrophobicContact CZ-CE1 4.24Å; F965-F981 HydrophobicContact CZ-CE2 4.37Å; F965-F981 HydrophobicContact CZ-CZ 4.22Å; L979-F981 HydrophobicContact CB-CE2 3.75Å; L979-F981 HydrophobicContact CB-CZ 4.25Å
982	N	34.5	Very low	30.5	Very low	16 Å²	16	106.6 Å²	106.6	9%	0.086	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	148.6	173.6	-68.7	-8.7	0	0	0	110.1
983	S	30.1	Very low	30.4	Very low	25 Å²	25	107.8 Å²	107.8	18%	0.175	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.2	133.3	172.2	66	0	0	0	0	111.1	S896	S896-S983 WeakPolarHBondContact CB-O 3.24Å
984	N	29.8	Very low	30	Very low	100 Å²	100	108 Å²	108	54%	0.535	56%	0.557	S	S	.	*			trans	-89.5	120.5	167.1	-72.7	7.4	0	0	0	109.4	R931	R931-N984 VanDerWaalsContact CZ-ND2 3.27Å; R931-N984 PolarHBondContact NH1-ND2 3.14Å; R931-N984 PolarHBondContact NH2-ND2 3.35Å
985	Y	28.2	Very low	29.4	Very low	201 Å²	201	111.1 Å²	111.1	79%	0.788	56%	0.555	S	S	*	*			trans	-128.7	109.7	174.3	-111.1	-74.6	0	0	0	111.1
986	Y	26.7	Very low	28.6	Very low	231 Å²	231	118.4 Å²	118.4	91%	0.906	59%	0.586	S	S	*	*			trans	-77.9	132.4	156	-97	-91.7	0	0	0	108.8	H988	Y986-H988 PolarHBondContact O-N 2.67Å
987	K	24.9	Very low	28	Very low	185 Å²	185	117.9 Å²	117.9	80%	0.804	60%	0.596	S	S	*	*			trans	-66.9	120	175.6	-84.5	-178.9	174.5	174.8	0	111
988	H	24.6	Very low	27	Very low	191 Å²	191	120.6 Å²	120.6	88%	0.884	62%	0.615	S	S	*	*			trans	-126	126	139.8	-101	-82.4	0	0	0	109.1	Y986	Y986-H988 PolarHBondContact O-N 2.67Å
989	N	23.9	Very low	26.6	Very low	145 Å²	145	125.8 Å²	125.8	78%	0.775	63%	0.633	S	S	*	*			trans	-70.1	130.3	178.6	-80.5	-13.9	0	0	0	110.6
990	T	23.8	Very low	25.9	Very low	148 Å²	148	132.2 Å²	132.2	91%	0.908	66%	0.659	S	S	*	*				-158.6	144.9	126.3	10.2	0	0	0	0	109.5
991	S	25.3	Very low	25.4	Very low	91 Å²	91	137.6 Å²	137.6	64%	0.636	69%	0.689	S	S	*	*			trans	-86.5	152.4	-169	51.9	0	0	0	0	113.3
992	Y	23.7	Very low	24.9	Very low	221 Å²	221	143.9 Å²	143.9	87%	0.867	72%	0.718	S	S	*	*				-171	160.7	106.9	-106.7	-76.1	0	0	0	112.1
993	C	23.7	Very low	24.5	Very low	120 Å²	120	150 Å²	150	81%	0.811	74%	0.744	S	S	*	*			trans	-81.9	157.8	-169	-56.8	0	0	0	0	114.1
994	M	22.4	Very low	24.2	Very low	196 Å²	196	155.6 Å²	155.6	97%	0.966	77%	0.767	S	S	*	*			trans	-135.6	135	145.1	-81.7	-161.6	-179.7	0	0	109.5
995	D	22	Very low	24	Very low	143 Å²	143	157 Å²	157	77%	0.765	77%	0.774	S	S	*	*			trans	-150.7	151.9	161.3	-146	-13.1	0	0	0	109.6
996	H	23.1	Very low	23.9	Very low	185 Å²	185	151.7 Å²	151.7	86%	0.856	77%	0.766	S	S	*	*			trans	62.3	157.1	-178	-68.4	-82.9	0	0	0	118.8
997	G	21.5	Very low	23.9	Very low	70 Å²	70	148 Å²	148	72%	0.722	76%	0.758	S	S	*	*			trans	-153.6	-161.5	-173	0	0	0	0	0	115.6
998	L	21.5	Very low	24	Very low	159 Å²	159	145.8 Å²	145.8	83%	0.832	75%	0.75	S	S	*	*			trans	75	105.1	176.6	-59.9	169.6	0	0	0	119
999	F	22.6	Very low	24.1	Very low	168 Å²	168	142.1 Å²	142.1	74%	0.737	74%	0.741	S	S	*	*			trans	77.2	134.6	133.5	-88.5	-81.7	0	0	0	125.9
1000	F	23.5	Very low	24.2	Very low	166 Å²	166	145.4 Å²	145.4	73%	0.728	74%	0.743	S	S	*	*			trans	103	114.8	137	-90.6	-54.4	0	0	0	124
1001	N	23.7	Very low	24.3	Very low	123 Å²	123	143.9 Å²	143.9	66%	0.658	73%	0.729	S	S	*	*			trans	59.8	141.1	138	-94.8	-29.3	0	0	0	121.3
1002	H	23.5	Very low	24.2	Very low	137 Å²	137	146.5 Å²	146.5	63%	0.634	74%	0.736	S	S	*	*				-171.4	145.2	64.2	-128	-11.9	0	0	0	116.5
1003	K	24.9	Very low	24.2	Very low	145 Å²	145	139 Å²	139	63%	0.63	73%	0.726	S	S	*	*			trans	57	154.9	137.7	-85.9	172.1	178.3	173.7	0	121.6
1004	H	25.7	Very low	24.1	Very low	142 Å²	142	145 Å²	145	66%	0.657	73%	0.732	S	S	*	*			cis	-156.9	142.4	32.1	-126	-55.9	0	0	0	115.4
1005	N	25.5	Very low	24.2	Very low	130 Å²	130	143.1 Å²	143.1	70%	0.695	73%	0.725	S	S	*	*			trans	48.4	152.5	139.9	-79.3	36.3	0	0	0	124.3
1006	S	25.8	Very low	24.2	Very low	89 Å²	89	143.8 Å²	143.8	62%	0.622	73%	0.728	S	S	*	*			cis	-162	143.1	5.6	41.1	0	0	0	0	115.5
1007	E	27.1	Very low	24.2	Very low	155 Å²	155	138 Å²	138	72%	0.724	72%	0.719	S	S	*	*			trans	62.6	148.8	136.2	-66.5	179.7	146.5	0	0	121.9
1008	H	27.1	Very low	24.2	Very low	137 Å²	137	142.3 Å²	142.3	63%	0.634	72%	0.724	S	S	*	*			cis	-160	141.4	16.1	-131.9	9.2	0	0	0	113.9
1009	T	25.8	Very low	24.3	Very low	115 Å²	115	141.5 Å²	141.5	71%	0.706	72%	0.72	S	S	*	*			trans	54.1	148.9	144.3	55.4	0	0	0	0	122.6
1010	R	26.3	Very low	24.3	Very low	214 Å²	214	139.6 Å²	139.6	81%	0.808	72%	0.722	S	S	*	*			cis	-166.2	154.6	9.2	-128.8	-162.8	170.4	144.9	-2	112.1
1011	N	25	Very low	24.2	Very low	116 Å²	116	141.1 Å²	141.1	62%	0.62	73%	0.729	S	S	*	*			trans	56.3	154.7	152.9	-69.4	38.6	0	0	0	119.3
1012	D	24.1	Very low	24.1	Very low	146 Å²	146	142 Å²	142	78%	0.781	73%	0.734	S	S	*	*			cis	-162	164.1	-19.3	-82.4	-30.9	0	0	0	105.6
1013	G	22.7	Very low	24	Very low	64 Å²	64	143.1 Å²	143.1	66%	0.66	74%	0.739	S	S	*	*			cis	159.8	159.1	-2.8	0	0	0	0	0	111.1
1014	R	23.1	Very low	23.8	Very low	246 Å²	246	140.9 Å²	140.9	93%	0.928	74%	0.742	S	S	*	*			trans	75.4	153.6	-178.5	-63.4	-179.9	173.8	179.7	-2.1	115.6
1015	L	23.9	Very low	23.7	Very low	156 Å²	156	139 Å²	139	82%	0.817	74%	0.744	S	S	*	*			cis	-151.3	159.8	19.8	-132	145.6	0	0	0	112.3
1016	N	22.3	Very low	23.5	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	75%	0.75	S	S	*	*			trans	-94.2	148.4	171.9	-80.8	-26.9	0	0	0	112.4
1017	G	22.7	Very low	23.3	Very low	65 Å²	65	142.6 Å²	142.6	67%	0.67	76%	0.755	S	S	*	*				95.2	108.9	122	0	0	0	0	0	121.9
1018	L	22.3	Very low	23.1	Very low	159 Å²	159	143 Å²	143	83%	0.832	76%	0.755	S	S	*	*			trans	75.5	124.2	134.4	-86	74.3	0	0	0	123.7
1019	L	22.1	Very low	22.8	Very low	143 Å²	143	144.1 Å²	144.1	75%	0.749	76%	0.76	S	S	*	*			trans	78.4	107.2	133.2	-64.3	177.5	0	0	0	123.6
1020	V	22.6	Very low	22.5	Very low	128 Å²	128	144 Å²	144	78%	0.776	76%	0.764	S	S	*	*				76.8	125.1	118.4	173.3	0	0	0	0	121.2
1021	F	21.7	Very low	22.3	Very low	198 Å²	198	139.2 Å²	139.2	87%	0.868	76%	0.762	S	S	*	*			trans	-75.9	155.8	164.6	-83.7	-107.1	0	0	0	112.7
1022	D	22	Very low	22.3	Very low	142 Å²	142	146.9 Å²	146.9	76%	0.759	79%	0.79	S	S	*	*				-175.2	165	103.9	-162.6	21.4	0	0	0	113.3
1023	Q	21.1	Very low	22.2	Very low	159 Å²	159	146.9 Å²	146.9	74%	0.743	79%	0.79	S	S	*	*			trans	99.7	103.5	159.3	-60.2	-155.4	-14.9	0	0	121.3
1024	S	21.6	Very low	22.2	Very low	99 Å²	99	151.3 Å²	151.3	69%	0.692	80%	0.797	S	S	*	*				95.2	104.4	121.2	73.8	0	0	0	0	121.3
1025	S	22.1	Very low	22.2	Very low	101 Å²	101	146 Å²	146	71%	0.706	79%	0.79	S	S	*	*				53.5	123.4	127.2	66.1	0	0	0	0	123.6
1026	L	22.1	Very low	22.1	Very low	156 Å²	156	145.4 Å²	145.4	82%	0.817	79%	0.789	S	S	*	*			trans	83.7	123	133.7	-75.8	164	0	0	0	122.1
1027	L	21.9	Very low	22	Very low	140 Å²	140	144.8 Å²	144.8	73%	0.733	79%	0.786	S	S	*	*			trans	87.9	120.7	140.4	-77.6	159.9	0	0	0	122.3
1028	K	22	Very low	22	Very low	164 Å²	164	150.1 Å²	150.1	71%	0.713	79%	0.793	S	S	*	*			trans	93.8	116.8	140.7	-76.3	178.9	174.8	-178.2	0	121.8
1029	Q	21.2	Very low	22	Very low	160 Å²	160	149.4 Å²	149.4	75%	0.748	79%	0.791	S	S	*	*			trans	55.5	110.8	130.5	-62.1	174.7	-71.3	0	0	118.7
1030	S	20.5	Very low	22	Very low	112 Å²	112	149.9 Å²	149.9	78%	0.783	79%	0.794	S	S	*	*				162.7	147.2	85.5	48.2	0	0	0	0	112.8
1031	C	20.7	Very low	21.9	Very low	114 Å²	114	151.8 Å²	151.8	77%	0.77	80%	0.795	S	S	*	*			trans	27.8	109.1	158.1	-57.2	0	0	0	0	119.8
1032	F	26.4	Very low	21.9	Very low	276 Å²	276	147.5 Å²	147.5	100%	1.211	79%	0.789	S	S	*	*				-157.8	0	82.3	-117.3	-82.2	0	0	0	111.9

Retrieved 1,032 of 1,032 residues in 640.8 ms (Link to these results)

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