A0A087XPD5_POEFO Loading...

Glutamate receptor

Receptor for glutamate that functions as a ligand-gated ion channel in the central nervous system and plays an important role in excitatory synaptic transmission. L-glutamate acts as an excitatory neurotransmitter at many synapses in the central nervous system.

AlphaFold DB , UniProt , Accession A0A087XPD5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 994 aa.

						>A0A087XPD5_POEFO|A0A087XPD5
MLTAWALLLFLAMWVRSTSGGPLSFRIAAILDDPMECSRGERLAITLAKNNINRSSNRSTTGKLEVDIFELLRDSEYEMGETMCQIMSKGVVAVLGPSASPASNSIISNICGEKEVPYVKVAPEDILKVQFPRFTTLDLRPTNTDISLAVAGLLTFFNSTASCLICAQADCLLNLEQLLRQFLISKETLSVRMLDDSQDPTPLLKEIRDDKTATIIVDANATMSHIILERASELGMLSVYYTYIFTSLEFTLLRLDDVADQRVNIVGFSVFNKTHPFFQEFVLSLNRSWQENCDHAPFAGTPLSSALLFDAVYAVVAAVQELNRSQNVGATQLSCKSSKIWEHGTSLMNYLRMVELEGLTGHIEFNSKGQRSNYALRIMQNSKEGLRQIGLWHSEDGLSMERTLPSINVTDTLFNTTLTITTILENPYVMLRPNHQELEGNDRYEGFCVDMLKELADILKFKYRIRLVGDGVYGVPGANGTWTGMVGELISRKADLAVAGLTITAEREKVIDFSKPFMTLGISIMYRVHLGRRPGYFSFLDPFSPGVWLFMLLAYLAVSCVLFLVARLTPYEWYNPHPCLKGRCNLLINQYSLGNSFWFPVGGFMQQGSTIAPRALSTRCVSGVWWAFTLIIISSYTANLAAFLTVQRMEMPIESVDDLADQTAIEYGTMHGGSTMTFFMNSRYQTYQRMWNFMNSKQPSVFVKSTEEGIARVLNSNYAYLLESTMNEYYRQRNCNLTQIGGLLDTKGYGIGMPLGSVYRDEFDLAILKLQEDNRLEILKRFWWEGGKCPKEEDHRAKGLRAILGVINRRLLLRSLISLTFALSSGLGMENIGGIFVVLVCGLLVAIFMAVLEFVWMLKQAPGNEQSVCEEMLRELHGIVLCRDSLQVRRRRAASLMRPRPLPLEERRARAAAVSLSNGKLCAGTGLPEPLSHRLAQEAALVARGCSHIRICPECRRFQGLRMRPAGAGEALPSPTHSEESIEWDKTTNSSEPE
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.9	Low	57.8	Low	194 Å²	194	121.8 Å²	121.8	96%	0.956	64%	0.637	S	S	*	*				0	-42.6	0	-68.1	-170.2	84.6	0	0	113.5	T3 A4	M1-T3 VanDerWaalsContact C-N 3.31Å; M1-T3 PolarHBondContact O-N 3.48Å; M1-A4 PolarHBondContact O-N 3.27Å
2	L	51.7	Low	57.6	Low	162 Å²	162	116.2 Å²	116.2	85%	0.848	62%	0.621	S	S	*	*	H	α-helix	trans	-56.1	-35.9	179.7	-84.3	147.2	0	0	0	115.1	A4 W5 A6	L2-A4 PolarHBondContact O-N 3.5Å; L2-W5 PolarHBondContact O-N 3.47Å; L2-A6 PolarHBondContact O-N 3.41Å
3	T	53.9	Low	57.2	Low	115 Å²	115	116.7 Å²	116.7	71%	0.706	62%	0.62	S	S	*	*	H	α-helix	trans	-68.9	-28.8	179.4	45.8	0	0	0	0	114.5	M1 L7	M1-T3 VanDerWaalsContact C-N 3.31Å; M1-T3 PolarHBondContact O-N 3.48Å; T3-L7 PolarHBondContact O-N 3.23Å
4	A	54.8	Low	56.3	Low	56 Å²	56	122.1 Å²	122.1	46%	0.463	63%	0.628	S	S	.	*	H	α-helix	trans	-74.4	-35.1	178.8	0	0	0	0	0	112.2	M1 L2 L8	M1-A4 PolarHBondContact O-N 3.27Å; L2-A4 PolarHBondContact O-N 3.5Å; A4-L8 PolarHBondContact O-N 2.91Å
5	W	58.6	Low	55.5	Low	176 Å²	176	120.9 Å²	120.9	67%	0.667	63%	0.628	S	S	*	*	H	α-helix	trans	-69.6	-35.8	176.4	-85.7	81.3	0	0	0	112.7	L2 L8 L9	L2-W5 PolarHBondContact O-N 3.47Å; W5-L8 PolarHBondContact O-N 3.34Å; W5-L9 WeakPolarHBondContact O-CB 3.43Å; W5-L9 PolarHBondContact O-N 2.84Å
6	A	60.5	Low	54.4	Low	52 Å²	52	127.1 Å²	127.1	43%	0.43	64%	0.64	S	S	.	*	H	α-helix	trans	-62.9	-41.6	175.4	0	0	0	0	0	112.2	L2 L9 F10	L2-A6 PolarHBondContact O-N 3.41Å; A6-L9 PolarHBondContact O-N 3.43Å; A6-F10 WeakPolarHBondContact O-CB 3.41Å; A6-F10 PolarHBondContact O-N 2.91Å
7	L	61.4	Low	53.2	Low	117 Å²	117	125.2 Å²	125.2	61%	0.613	64%	0.642	S	S	*	*	H	α-helix	trans	-67.3	-40.2	177.1	-97.9	154.8	0	0	0	112.8	T3 F10 L11	T3-L7 PolarHBondContact O-N 3.23Å; L7-F10 PolarHBondContact O-N 3.43Å; L7-L11 WeakPolarHBondContact O-CB 3.49Å; L7-L11 PolarHBondContact O-N 3.19Å
8	L	61.8	Low	52.3	Low	117 Å²	117	124.1 Å²	124.1	61%	0.613	64%	0.642	S	S	*	*	H	α-helix	trans	-66.4	-37.9	174.3	-88	159.6	0	0	0	112.6	A4 W5 A12	A4-L8 PolarHBondContact O-N 2.91Å; W5-L8 PolarHBondContact O-N 3.34Å; L8-A12 VanDerWaalsContact O-CB 3.23Å; L8-A12 WeakPolarHBondContact O-CB 3.44Å; L8-A12 PolarHBondContact O-N 2.9Å
9	L	62.4	Low	51.2	Low	102 Å²	102	123.2 Å²	123.2	53%	0.534	65%	0.648	S	S	.	*	H	α-helix	trans	-69.2	-38.8	173.9	-82.2	163.3	0	0	0	112.5	W5 A6 A12 M13	W5-L9 WeakPolarHBondContact O-CB 3.43Å; W5-L9 PolarHBondContact O-N 2.84Å; A6-L9 PolarHBondContact O-N 3.43Å; L9-A12 PolarHBondContact O-N 2.95Å; L9-M13 WeakPolarHBondContact O-CB 3.45Å; L9-M13 WeakPolarHBondContact O-CG 3.49Å; L9-M13 PolarHBondContact O-N 3.36Å
10	F	59.5	Low	50.4	Low	147 Å²	147	120.8 Å²	120.8	65%	0.645	65%	0.654	S	S	*	*	H	α-helix	trans	-66	-43.3	173.9	-101.7	-85.3	0	0	0	112.1	A6 L7 M13 W14	A6-F10 WeakPolarHBondContact O-CB 3.41Å; A6-F10 PolarHBondContact O-N 2.91Å; L7-F10 PolarHBondContact O-N 3.43Å; F10-M13 PolarHBondContact O-N 2.97Å; F10-W14 WeakPolarHBondContact O-CB 3.46Å; F10-W14 PolarHBondContact O-N 3.43Å
11	L	57.7	Low	49.7	Very low	102 Å²	102	117.6 Å²	117.6	53%	0.534	65%	0.649	S	S	.	*	H	α-helix	trans	-62.8	-41.6	173.3	-88.5	156.1	0	0	0	112.1	L7 M13 W14 V15	L7-L11 WeakPolarHBondContact O-CB 3.49Å; L7-L11 PolarHBondContact O-N 3.19Å; L11-M13 PolarHBondContact O-N 3.13Å; L11-W14 PolarHBondContact O-N 3.5Å; L11-V15 WeakPolarHBondContact O-CB 3.43Å; L11-V15 VanDerWaalsContact O-CG2 3.3Å; L11-V15 WeakPolarHBondContact O-CG2 3.23Å; L11-V15 PolarHBondContact O-N 2.89Å
12	A	55.5	Low	49.4	Very low	54 Å²	54	113.8 Å²	113.8	45%	0.446	64%	0.639	S	S	.	*	H	α-helix	trans	-65.3	-36.7	176	0	0	0	0	0	112.8	L8 L9 R16	L8-A12 VanDerWaalsContact O-CB 3.23Å; L8-A12 WeakPolarHBondContact O-CB 3.44Å; L8-A12 PolarHBondContact O-N 2.9Å; L9-A12 PolarHBondContact O-N 2.95Å; A12-R16 WeakPolarHBondContact O-CB 3.42Å; A12-R16 PolarHBondContact O-N 3.4Å; A12-R16 VanDerWaalsContact O-N 3.08Å
13	M	52.7	Low	49.9	Very low	123 Å²	123	110.3 Å²	110.3	61%	0.606	62%	0.621	S	S	*	*	H	α-helix	trans	-74.4	-34.4	174	-72.6	-150.6	-73.4	0	0	112.9	L9 F10 L11 R16 S17	L9-M13 WeakPolarHBondContact O-CB 3.45Å; L9-M13 WeakPolarHBondContact O-CG 3.49Å; L9-M13 PolarHBondContact O-N 3.36Å; F10-M13 PolarHBondContact O-N 2.97Å; L11-M13 PolarHBondContact O-N 3.13Å; M13-R16 PolarHBondContact O-N 3.43Å; M13-S17 WeakPolarHBondContact O-CB 3.3Å; M13-S17 PolarHBondContact O-N 2.9Å; M13-S17 VanDerWaalsContact O-N 3.13Å
14	W	45.3	Very low	50.8	Low	193 Å²	193	108.1 Å²	108.1	73%	0.731	61%	0.61	S	S	*	*	H	α-helix	trans	-66.3	-45	173.3	-120.3	55.7	0	0	0	111.8	F10 L11 R16 S17	F10-W14 WeakPolarHBondContact O-CB 3.46Å; F10-W14 PolarHBondContact O-N 3.43Å; L11-W14 PolarHBondContact O-N 3.5Å; W14-R16 VanDerWaalsContact C-N 3.3Å; W14-R16 PolarHBondContact O-N 3.08Å; W14-S17 WeakPolarHBondContact O-CA 3.47Å; W14-S17 WeakPolarHBondContact O-CB 3.41Å; W14-S17 PolarHBondContact O-N 3.44Å
15	V	44	Very low	52.2	Low	103 Å²	103	106.3 Å²	106.3	62%	0.624	59%	0.592	S	S	*	*	H	α-helix	trans	-66.7	-29.6	176.5	172.8	0	0	0	0	112	L11 S17 T18	L11-V15 WeakPolarHBondContact O-CB 3.43Å; L11-V15 VanDerWaalsContact O-CG2 3.3Å; L11-V15 WeakPolarHBondContact O-CG2 3.23Å; L11-V15 PolarHBondContact O-N 2.89Å; V15-S17 VanDerWaalsContact C-N 3.28Å; V15-S17 PolarHBondContact O-N 3.34Å; V15-T18 PolarHBondContact O-OG1 3.49Å
16	R	37.1	Very low	53.7	Low	221 Å²	221	101.3 Å²	101.3	83%	0.834	57%	0.573	S	S	*	*	H	α-helix	trans	-74.1	-13.5	168.7	-103.7	-179.6	169.9	168.4	-2.8	114.5	A12 M13 W14	A12-R16 WeakPolarHBondContact O-CB 3.42Å; A12-R16 PolarHBondContact O-N 3.4Å; A12-R16 VanDerWaalsContact O-N 3.08Å; M13-R16 PolarHBondContact O-N 3.43Å; W14-R16 VanDerWaalsContact C-N 3.3Å; W14-R16 PolarHBondContact O-N 3.08Å
17	S	35	Very low	55.2	Low	95 Å²	95	98.8 Å²	98.8	66%	0.664	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-0.4	-178.6	-166.7	0	0	0	0	113.7	M13 W14 V15	M13-S17 WeakPolarHBondContact O-CB 3.3Å; M13-S17 PolarHBondContact O-N 2.9Å; M13-S17 VanDerWaalsContact O-N 3.13Å; W14-S17 WeakPolarHBondContact O-CA 3.47Å; W14-S17 WeakPolarHBondContact O-CB 3.41Å; W14-S17 PolarHBondContact O-N 3.44Å; V15-S17 VanDerWaalsContact C-N 3.28Å; V15-S17 PolarHBondContact O-N 3.34Å
18	T	36	Very low	56.7	Low	105 Å²	105	93.2 Å²	93.2	64%	0.644	52%	0.523	S	S	*	.	S	Bend	trans	-115	12.6	-173.2	54.3	0	0	0	0	115.2	V15	V15-T18 PolarHBondContact O-OG1 3.49Å
19	S	31.9	Very low	58.3	Low	107 Å²	107	87.7 Å²	87.7	75%	0.748	49%	0.494	S	S	*	.			trans	-99.3	14.7	173.5	71.8	0	0	0	0	114.2	G21	S19-G21 VanDerWaalsContact C-N 3.31Å; S19-G21 PolarHBondContact O-N 3.24Å
20	G	34.6	Very low	59.7	Low	75 Å²	75	82.9 Å²	82.9	77%	0.773	47%	0.469	S	S	*	.			trans	-86.2	64.4	170.8	0	0	0	0	0	111.9
21	G	35.6	Very low	61.2	Low	54 Å²	54	76 Å²	76	56%	0.557	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-60.3	150.3	164	0	0	0	0	0	109.8	S19 L23	S19-G21 VanDerWaalsContact C-N 3.31Å; S19-G21 PolarHBondContact O-N 3.24Å; G21-L23 PolarHBondContact O-N 3.05Å
22	P	48.1	Very low	62.5	Low	114 Å²	114	71.9 Å²	71.9	74%	0.74	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-56.5	130.5	174.5	25.5	-33.5	0	0	0	108.5	S24	P22-S24 PolarHBondContact O-N 3.39Å
23	L	61.5	Low	63.2	Low	89 Å²	89	70.5 Å²	70.5	47%	0.466	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-52.2	133.1	174.6	-76.7	98.2	0	0	0	108.2	G21 G62 K63	G21-L23 PolarHBondContact O-N 3.05Å; L23-G62 CarbonylContact O-C 3.51Å; L23-G62 VanDerWaalsContact O-C 3.3Å; L23-G62 WeakPolarHBondContact O-CA 3.34Å; L23-K63 PolarHBondContact O-N 3.32Å
24	S	73.8	Confident	63.6	Low	69 Å²	69	68.9 Å²	68.9	48%	0.483	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	123.7	176	61.2	0	0	0	0	108.2	P22 K63	P22-S24 PolarHBondContact O-N 3.39Å; S24-K63 VanDerWaalsContact CA-O 3.28Å; S24-K63 WeakPolarHBondContact CA-O 3.32Å
25	F	83.3	Confident	64.2	Low	17 Å²	17	65.8 Å²	65.8	8%	0.075	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	143	178.7	56.1	-88	0	0	0	109.6	G62 K63 L64 E65 V92 V316 V319	F25-G62 WeakPolarHBondContact CE1-O 3.16Å; F25-K63 PolarHBondContact N-O 3.17Å; F25-L64 HydrophobicContact CD2-CD1 4.15Å; F25-L64 HydrophobicContact CE2-CD1 3.8Å; F25-E65 PolarHBondContact O-N 3.49Å; F25-V92 HydrophobicContact CB-CG1 3.96Å; F25-V92 HydrophobicContact CB-CG2 4.28Å; F25-V92 HydrophobicContact CD2-CG2 4.09Å; F25-V316 HydrophobicContact CE2-CG2 4.08Å; F25-V316 HydrophobicContact CZ-CG2 4.42Å; F25-V319 HydrophobicContact CD1-CG1 4.11Å; F25-V319 HydrophobicContact CD2-CG1 4.09Å; F25-V319 HydrophobicContact CE1-CG1 4.06Å; F25-V319 HydrophobicContact CE2-CB 4.43Å; F25-V319 HydrophobicContact CE2-CG1 4.01Å; F25-V319 HydrophobicContact CG-CG1 4.14Å; F25-V319 HydrophobicContact CZ-CG1 4Å
26	R	89.3	Confident	64.7	Low	71 Å²	71	69.5 Å²	69.5	27%	0.268	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.7	-170.2	-172.7	175.3	-72.9	139	2.6	110.4	E65 D67 K89 V91 V92	R26-E65 WeakPolarHBondContact CA-O 3.29Å; R26-E65 HydrophobicContact CB-CB 4.48Å; R26-E65 HydrophobicContact CG-CB 4.37Å; R26-E65 IonicContact CZ-OE2 2.67Å; R26-E65 IonicContact NE-OE2 3.61Å; R26-E65 IonicContact NH2-OE2 3.89Å; R26-E65 PolarHBondContact NH2-OE2 3.35Å; R26-D67 WeakPolarHBondContact CD-OD1 3.48Å; R26-D67 IonicContact NE-OD1 2.76Å; R26-K89 PolarHBondContact NH1-O 3.32Å; R26-V91 HydrophobicContact CG-CG1 4.17Å; R26-V91 CarbonylContact O-C 3.3Å; R26-V91 WeakPolarHBondContact O-CA 3.45Å; R26-V91 WeakPolarHBondContact O-CB 3.19Å; R26-V92 PolarHBondContact O-N 2.77Å
27	I	92.5	Very high	66	Low	0 Å²	0	61.2 Å²	61.2	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	141.1	169.5	-58.4	177.9	0	0	0	107.3	L64 E65 V66 D67 V92 L95 V315	I27-L64 HydrophobicContact CD1-CD1 3.74Å; I27-L64 HydrophobicContact CG1-CD1 4.05Å; I27-E65 PolarHBondContact N-O 3.26Å; I27-V66 HydrophobicContact CB-CG1 4.38Å; I27-V66 HydrophobicContact CB-CG2 4.4Å; I27-V66 WeakPolarHBondContact O-CA 3.43Å; I27-D67 PolarHBondContact O-N 3.48Å; I27-V92 HydrophobicContact CG1-CG2 4.14Å; I27-L95 HydrophobicContact CG2-CD1 4.2Å; I27-L95 HydrophobicContact CG2-CD2 4.38Å; I27-L95 HydrophobicContact CG2-CG 3.87Å; I27-V315 HydrophobicContact CD1-CB 4.02Å; I27-V315 HydrophobicContact CD1-CG1 3.58Å; I27-V315 HydrophobicContact CG1-CG1 4.12Å
28	A	94.1	Very high	67.5	Low	0 Å²	0	58 Å²	58	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	139.1	163.7	0	0	0	0	0	109.7	D67 F69 I86 V91 A93 V94 L95	A28-D67 CarbonylContact C-O 3.52Å; A28-D67 WeakPolarHBondContact CA-O 3.47Å; A28-F69 HydrophobicContact CB-CD2 4.44Å; A28-F69 HydrophobicContact CB-CE2 4.13Å; A28-I86 HydrophobicContact CB-CB 4.48Å; A28-I86 HydrophobicContact CB-CD1 4.17Å; A28-I86 HydrophobicContact CB-CG1 4.1Å; A28-I86 HydrophobicContact CB-CG2 3.58Å; A28-V91 HydrophobicContact CB-CG1 4.12Å; A28-A93 PolarHBondContact N-O 2.93Å; A28-A93 VanDerWaalsContact N-O 3.11Å; A28-V94 HydrophobicContact CB-CG2 4.33Å; A28-V94 CarbonylContact O-C 3.52Å; A28-V94 WeakPolarHBondContact O-CA 3.41Å; A28-L95 PolarHBondContact O-N 3.17Å
29	A	93.6	Very high	69.2	Low	0 Å²	0	57.9 Å²	57.9	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.4	170.1	0	0	0	0	0	109.3	I45 V66 D67 I68 F69 L95	A29-I45 HydrophobicContact CB-CD1 3.72Å; A29-V66 HydrophobicContact CB-CG1 4.19Å; A29-D67 PolarHBondContact N-O 3.44Å; A29-I68 CarbonylContact O-C 3.59Å; A29-I68 WeakPolarHBondContact O-CA 3.38Å; A29-F69 PolarHBondContact O-N 3.06Å; A29-L95 HydrophobicContact CB-CB 4.11Å; A29-L95 HydrophobicContact CB-CD1 4.25Å; A29-L95 HydrophobicContact CB-CG 4.46Å
30	I	92.9	Very high	71.6	Confident	1 Å²	1	53 Å²	53	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	121.3	179.5	-60.5	152.3	0	0	0	106.6	F69 L71 M79 M83 I86 V94 L95 G96 P97 I107	I30-F69 CarbonylContact C-O 3.54Å; I30-F69 WeakPolarHBondContact CA-O 3.32Å; I30-L71 HydrophobicContact CG2-CD1 3.46Å; I30-L71 VanDerWaalsContact CG2-CD1 3.46Å; I30-L71 HydrophobicContact CG2-CG 3.73Å; I30-M79 HydrophobicContact CD1-CE 3.39Å; I30-M79 HydrophobicContact CD1-SD 4Å; I30-M79 HydrophobicContact CG1-CE 4.04Å; I30-M79 HydrophobicContact CG1-SD 4.48Å; I30-M79 HydrophobicContact CG2-CE 4.44Å; I30-M79 HydrophobicContact CG2-SD 3.83Å; I30-M83 HydrophobicContact CD1-SD 4.38Å; I30-I86 HydrophobicContact CD1-CD1 3.86Å; I30-I86 HydrophobicContact CG1-CD1 3.84Å; I30-V94 HydrophobicContact CD1-CG1 3.59Å; I30-V94 HydrophobicContact CG1-CG1 4.45Å; I30-L95 PolarHBondContact N-O 3.15Å; I30-G96 CarbonylContact O-C 3.56Å; I30-G96 VanDerWaalsContact O-C 3.3Å; I30-P97 HydrophobicContact CG2-CG 4.37Å; I30-P97 WeakPolarHBondContact O-CA 2.93Å; I30-P97 VanDerWaalsContact O-N 3.16Å; I30-I107 HydrophobicContact CD1-CD1 3.64Å; I30-I107 HydrophobicContact CD1-CG1 4.03Å
31	L	90.4	Very high	74.2	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	139.2	-175.8	-58	-177.8	0	0	0	110.2	E41 R42 I45 I68 F69 E70 L71 L308	L31-E41 HydrophobicContact CD1-CB 4.4Å; L31-E41 HydrophobicContact CD2-CB 3.97Å; L31-R42 HydrophobicContact CD1-CB 3.79Å; L31-I45 HydrophobicContact CD1-CD1 4.42Å; L31-I45 HydrophobicContact CD2-CD1 3.85Å; L31-I68 HydrophobicContact CD1-CG2 3.6Å; L31-I68 HydrophobicContact CG-CG2 4.04Å; L31-F69 PolarHBondContact N-O 3.39Å; L31-E70 CarbonylContact O-C 3.58Å; L31-E70 WeakPolarHBondContact O-CA 3.49Å; L31-L71 PolarHBondContact O-N 3.29Å; L31-L308 HydrophobicContact CD2-CD1 3.84Å
32	D	84.8	Confident	76.7	Confident	16 Å²	16	53.2 Å²	53.2	9%	0.086	28%	0.275	C	S	.	.			trans	-112.3	42	180	59.7	-23.1	0	0	0	112.3	P34 L71 P97 S98 A99 S100	D32-P34 VanDerWaalsContact O-CD 3.24Å; D32-P34 WeakPolarHBondContact O-CD 3.41Å; D32-L71 HydrophobicContact CB-CB 4.37Å; D32-L71 HydrophobicContact CB-CD1 4.44Å; D32-P97 HydrophobicContact CB-CB 3.76Å; D32-P97 VanDerWaalsContact CG-CB 3.47Å; D32-S98 PolarHBondContact OD1-N 2.88Å; D32-S98 PolarHBondContact OD1-OG 2.76Å; D32-S98 PolarHBondContact OD2-N 2.83Å; D32-A99 VanDerWaalsContact OD2-C 3.25Å; D32-A99 VanDerWaalsContact OD2-CA 3.26Å; D32-A99 WeakPolarHBondContact OD2-CA 3.28Å; D32-A99 WeakPolarHBondContact OD2-CB 3.09Å; D32-A99 PolarHBondContact OD2-N 2.86Å; D32-S100 WeakPolarHBondContact CB-OG 3.4Å; D32-S100 WeakPolarHBondContact OD2-CB 3.45Å; D32-S100 PolarHBondContact OD2-N 3.24Å; D32-S100 PolarHBondContact OD2-OG 3.24Å
33	D	71.9	Confident	78.6	Confident	24 Å²	24	49.8 Å²	49.8	13%	0.128	25%	0.25	C	C	.	.			trans	-116.2	85.4	-173.5	-167.4	3.3	0	0	0	110.8	M35 S38 R39	D33-M35 VanDerWaalsContact C-N 3.31Å; D33-M35 PolarHBondContact O-N 3.17Å; D33-S38 WeakPolarHBondContact OD1-CA 3.32Å; D33-S38 WeakPolarHBondContact OD2-CA 3.49Å; D33-S38 WeakPolarHBondContact OD2-CB 3.31Å; D33-R39 PolarHBondContact OD2-N 2.93Å
34	P	59.7	Low	80	Confident	89 Å²	89	45.5 Å²	45.5	58%	0.578	23%	0.228	S	C	*	.			trans	-87	11.3	-170.9	35.9	-39.1	0	0	0	114.3	D32	D32-P34 VanDerWaalsContact O-CD 3.24Å; D32-P34 WeakPolarHBondContact O-CD 3.41Å
35	M	58.3	Low	80.9	Confident	129 Å²	129	42.3 Å²	42.3	64%	0.635	21%	0.205	S	C	*	.	S	Bend	trans	-101.4	146.8	-167.1	-75.9	-74.7	142.1	0	0	113.6	D33 C37 S38	D33-M35 VanDerWaalsContact C-N 3.31Å; D33-M35 PolarHBondContact O-N 3.17Å; M35-C37 PolarHBondContact O-N 3.07Å; M35-S38 PolarHBondContact O-N 2.77Å
36	E	55.3	Low	81.2	Confident	180 Å²	180	43.9 Å²	43.9	84%	0.841	22%	0.216	S	C	*	.	S	Bend	trans	-55.1	-36.2	164.6	-65	-179.3	151.1	0	0	110.6	S38	E36-S38 PolarHBondContact O-N 2.76Å
37	C	62.7	Low	81.3	Confident	47 Å²	47	42 Å²	42	32%	0.318	21%	0.211	S	C	.	.	S	Bend	trans	-95.2	69.2	171.1	-69	0	0	0	0	113	M35 W289 C293	M35-C37 PolarHBondContact O-N 3.07Å; C37-W289 HydrophobicContact CB-CH2 3.91Å; C37-W289 HydrophobicContact CB-CZ2 4.19Å; C37-W289 HydrophobicContact CB-CZ3 4.35Å; C37-C293 WeakPolarHBondContact CA-SG 3.45Å; C37-C293 HydrophobicContact CB-CB 4.32Å; C37-C293 WeakPolarHBondContact CB-SG 3.37Å; C37-C293 WeakPolarHBondContact SG-CB 3.47Å; C37-C293 CovalentContact SG-SG 2.03Å; C37-C293 PolarHBondContact SG-SG 3.21Å
38	S	67	Low	81.2	Confident	28 Å²	28	42 Å²	42	20%	0.196	21%	0.211	C	C	.	.			trans	-58.6	146.2	177.8	74.2	0	0	0	0	112.7	D33 M35 E36 G40 W289	D33-S38 WeakPolarHBondContact OD1-CA 3.32Å; D33-S38 WeakPolarHBondContact OD2-CA 3.49Å; D33-S38 WeakPolarHBondContact OD2-CB 3.31Å; M35-S38 PolarHBondContact O-N 2.77Å; E36-S38 PolarHBondContact O-N 2.76Å; S38-G40 PolarHBondContact O-N 3.1Å; S38-G40 PolarHBondContact OG-N 3.37Å; S38-W289 VanDerWaalsContact O-CZ3 3.31Å; S38-W289 WeakPolarHBondContact O-CZ3 3.28Å
39	R	72.2	Confident	81.1	Confident	103 Å²	103	44.9 Å²	44.9	39%	0.389	22%	0.224	S	C	.	.			trans	-59	-7.3	169	-64.7	177.5	179.9	164.3	3.1	113.7	D33 E41 S98 P302 S305	D33-R39 PolarHBondContact OD2-N 2.93Å; R39-E41 HydrophobicContact CB-CG 4.06Å; R39-E41 WeakPolarHBondContact CD-OE1 3.37Å; R39-E41 IonicContact NH1-OE1 3.29Å; R39-S98 PolarHBondContact NH1-OG 3.19Å; R39-P302 HydrophobicContact CB-CB 4.35Å; R39-P302 HydrophobicContact CB-CG 4.16Å; R39-P302 WeakPolarHBondContact O-CG 3.48Å; R39-S305 PolarHBondContact O-OG 2.88Å
40	G	82.3	Confident	80.9	Confident	4 Å²	4	48.4 Å²	48.4	4%	0.041	24%	0.242	C	C	.	.	S	Bend	trans	85.8	11.7	178.6	0	0	0	0	0	113.9	S38 R42 L43 A44 S305	S38-G40 PolarHBondContact O-N 3.1Å; S38-G40 PolarHBondContact OG-N 3.37Å; G40-R42 PolarHBondContact O-N 2.86Å; G40-L43 WeakPolarHBondContact O-CA 2.88Å; G40-L43 WeakPolarHBondContact O-CB 3.3Å; G40-L43 PolarHBondContact O-N 3.07Å; G40-L43 VanDerWaalsContact O-N 3.08Å; G40-A44 PolarHBondContact O-N 3.42Å; G40-S305 VanDerWaalsContact C-OG 3.3Å
41	E	88.3	Confident	80.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-45.6	-177.2	-66.1	178.4	-170.1	0	0	111.4	L31 R39 L43 A44 I45 S98 S304 S305 L308	L31-E41 HydrophobicContact CD1-CB 4.4Å; L31-E41 HydrophobicContact CD2-CB 3.97Å; R39-E41 HydrophobicContact CB-CG 4.06Å; R39-E41 WeakPolarHBondContact CD-OE1 3.37Å; R39-E41 IonicContact NH1-OE1 3.29Å; E41-L43 VanDerWaalsContact C-N 3.3Å; E41-L43 PolarHBondContact O-N 3.3Å; E41-A44 PolarHBondContact O-N 3.25Å; E41-I45 WeakPolarHBondContact O-CG1 3.41Å; E41-I45 PolarHBondContact O-N 2.84Å; E41-S98 WeakPolarHBondContact OE1-CB 3.18Å; E41-S98 PolarHBondContact OE1-OG 3.5Å; E41-S304 WeakPolarHBondContact OE1-CB 3.39Å; E41-S304 PolarHBondContact OE1-OG 2.82Å; E41-S305 WeakPolarHBondContact CA-OG 3.43Å; E41-S305 WeakPolarHBondContact CG-OG 3.45Å; E41-S305 PolarHBondContact N-OG 3.25Å; E41-S305 VanDerWaalsContact N-OG 3.16Å; E41-L308 HydrophobicContact CB-CD1 3.66Å; E41-L308 HydrophobicContact CG-CD1 3.81Å
42	R	88.7	Confident	80.4	Confident	133 Å²	133	50.9 Å²	50.9	50%	0.502	26%	0.256	S	S	.	.	H	α-helix	trans	-58.5	-39.1	172.4	-177.7	172.4	-179	166.4	-4.7	112.5	L31 G40 T46 I68 E70	L31-R42 HydrophobicContact CD1-CB 3.79Å; G40-R42 PolarHBondContact O-N 2.86Å; R42-T46 WeakPolarHBondContact O-CB 3.29Å; R42-T46 PolarHBondContact O-N 3.32Å; R42-T46 VanDerWaalsContact O-N 3.17Å; R42-T46 PolarHBondContact O-OG1 2.73Å; R42-I68 HydrophobicContact CG-CD1 3.95Å; R42-E70 IonicContact CZ-OE1 2.81Å; R42-E70 IonicContact NE-OE1 3.64Å; R42-E70 IonicContact NH1-OE1 2.79Å; R42-E70 PolarHBondContact NH1-OE1 3.34Å; R42-E70 IonicContact NH1-OE2 2.76Å
43	L	88.8	Confident	80.5	Confident	42 Å²	42	52.6 Å²	52.6	22%	0.22	27%	0.265	C	S	.	.	H	α-helix	trans	-68.6	-46.4	176.5	-177.1	71.5	0	0	0	110.5	G40 E41 I45 T46 L47 L285	G40-L43 WeakPolarHBondContact O-CA 2.88Å; G40-L43 WeakPolarHBondContact O-CB 3.3Å; G40-L43 PolarHBondContact O-N 3.07Å; G40-L43 VanDerWaalsContact O-N 3.08Å; E41-L43 VanDerWaalsContact C-N 3.3Å; E41-L43 PolarHBondContact O-N 3.3Å; L43-I45 PolarHBondContact O-N 3.27Å; L43-T46 CarbonylContact O-C 3.53Å; L43-T46 WeakPolarHBondContact O-CA 3.36Å; L43-T46 WeakPolarHBondContact O-CB 3.26Å; L43-T46 PolarHBondContact O-N 2.94Å; L43-L47 HydrophobicContact CD1-CG 4.4Å; L43-L47 HydrophobicContact CD2-CD1 4.29Å; L43-L47 HydrophobicContact CG-CD1 3.97Å; L43-L47 HydrophobicContact CG-CG 4.18Å; L43-L47 WeakPolarHBondContact O-CG 3.28Å; L43-L47 PolarHBondContact O-N 3.28Å; L43-L285 HydrophobicContact CD2-CD2 3.97Å; L43-L285 HydrophobicContact CD2-CG 4.39Å
44	A	90.8	Very high	81	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.2	-47.2	-179.2	0	0	0	0	0	112.3	G40 E41 T46 L47 A48 F281 S305 F309	G40-A44 PolarHBondContact O-N 3.42Å; E41-A44 PolarHBondContact O-N 3.25Å; A44-T46 VanDerWaalsContact C-N 3.3Å; A44-T46 PolarHBondContact O-N 2.88Å; A44-L47 PolarHBondContact O-N 2.77Å; A44-A48 PolarHBondContact O-N 3.17Å; A44-F281 HydrophobicContact CB-CE2 3.75Å; A44-F281 HydrophobicContact CB-CZ 4.02Å; A44-S305 WeakPolarHBondContact CB-O 3.26Å; A44-F309 HydrophobicContact CB-CB 4.34Å
45	I	91.7	Very high	81.6	Confident	1 Å²	1	61 Å²	61	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-41.4	173.4	-68.4	164.7	0	0	0	111.1	A29 L31 E41 L43 A48 K49 V66 I68 L308 V312	A29-I45 HydrophobicContact CB-CD1 3.72Å; L31-I45 HydrophobicContact CD1-CD1 4.42Å; L31-I45 HydrophobicContact CD2-CD1 3.85Å; E41-I45 WeakPolarHBondContact O-CG1 3.41Å; E41-I45 PolarHBondContact O-N 2.84Å; L43-I45 PolarHBondContact O-N 3.27Å; I45-A48 PolarHBondContact O-N 3.2Å; I45-K49 VanDerWaalsContact O-CB 3.26Å; I45-K49 WeakPolarHBondContact O-CB 3.35Å; I45-K49 PolarHBondContact O-N 3.29Å; I45-V66 HydrophobicContact CG2-CB 4.23Å; I45-V66 HydrophobicContact CG2-CG1 3.68Å; I45-V66 HydrophobicContact CG2-CG2 4.45Å; I45-I68 HydrophobicContact CG2-CD1 4.27Å; I45-L308 HydrophobicContact CD1-CB 4.39Å; I45-L308 HydrophobicContact CD1-CD1 4.3Å; I45-L308 HydrophobicContact CD1-CD2 4.48Å; I45-L308 HydrophobicContact CG1-CB 4.11Å; I45-V312 HydrophobicContact CG1-CG2 4.49Å; I45-V312 HydrophobicContact CG2-CG2 4.44Å
46	T	90.6	Very high	81.8	Confident	50 Å²	50	56.2 Å²	56.2	31%	0.307	28%	0.275	S	S	.	.	H	α-helix	trans	-67.9	-38.3	179.2	-59.7	0	0	0	0	112	R42 L43 A44 N50	R42-T46 WeakPolarHBondContact O-CB 3.29Å; R42-T46 PolarHBondContact O-N 3.32Å; R42-T46 VanDerWaalsContact O-N 3.17Å; R42-T46 PolarHBondContact O-OG1 2.73Å; L43-T46 CarbonylContact O-C 3.53Å; L43-T46 WeakPolarHBondContact O-CA 3.36Å; L43-T46 WeakPolarHBondContact O-CB 3.26Å; L43-T46 PolarHBondContact O-N 2.94Å; A44-T46 VanDerWaalsContact C-N 3.3Å; A44-T46 PolarHBondContact O-N 2.88Å; T46-N50 VanDerWaalsContact O-CB 3.29Å; T46-N50 WeakPolarHBondContact O-CB 3.46Å; T46-N50 PolarHBondContact O-N 2.94Å; T46-N50 PolarHBondContact O-ND2 3.05Å
47	L	90.9	Very high	81.9	Confident	31 Å²	31	53.7 Å²	53.7	16%	0.162	27%	0.267	C	S	.	.	H	α-helix	trans	-64.8	-47.9	174.1	-70.9	172.9	0	0	0	111	L43 A44 N50 N51 F281 F309	L43-L47 HydrophobicContact CD1-CG 4.4Å; L43-L47 HydrophobicContact CD2-CD1 4.29Å; L43-L47 HydrophobicContact CG-CD1 3.97Å; L43-L47 HydrophobicContact CG-CG 4.18Å; L43-L47 WeakPolarHBondContact O-CG 3.28Å; L43-L47 PolarHBondContact O-N 3.28Å; A44-L47 PolarHBondContact O-N 2.77Å; L47-N50 PolarHBondContact O-N 3.33Å; L47-N51 VanDerWaalsContact O-CB 3.31Å; L47-N51 WeakPolarHBondContact O-CB 3.35Å; L47-N51 PolarHBondContact O-N 2.83Å; L47-F281 HydrophobicContact CD1-CD2 4.12Å; L47-F309 HydrophobicContact CB-CE2 4.36Å
48	A	90.6	Very high	81.4	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-57.7	-51	175.2	0	0	0	0	0	111.4	A44 I45 N50 N51 I52 F309 V312 Y313	A44-A48 PolarHBondContact O-N 3.17Å; I45-A48 PolarHBondContact O-N 3.2Å; A48-N50 VanDerWaalsContact C-N 3.32Å; A48-N50 PolarHBondContact O-N 3.08Å; A48-N51 PolarHBondContact O-N 3.48Å; A48-I52 WeakPolarHBondContact O-CB 3.45Å; A48-I52 VanDerWaalsContact O-CG1 3.29Å; A48-I52 WeakPolarHBondContact O-CG1 3.47Å; A48-I52 PolarHBondContact O-N 2.99Å; A48-F309 HydrophobicContact CB-CD2 3.71Å; A48-F309 HydrophobicContact CB-CE2 3.92Å; A48-F309 HydrophobicContact CB-CG 4.26Å; A48-V312 HydrophobicContact CB-CB 3.89Å; A48-V312 HydrophobicContact CB-CG1 3.88Å; A48-V312 HydrophobicContact CB-CG2 4.37Å; A48-Y313 HydrophobicContact CB-CD2 4.25Å; A48-Y313 HydrophobicContact CB-CE2 3.92Å
49	K	91.3	Very high	80.5	Confident	62 Å²	62	66.7 Å²	66.7	27%	0.27	32%	0.322	S	S	.	.	H	α-helix	trans	-55	-44.4	176.5	177.9	-177.1	-178.7	177.7	0	112.5	I45 N53 L64 V66	I45-K49 VanDerWaalsContact O-CB 3.26Å; I45-K49 WeakPolarHBondContact O-CB 3.35Å; I45-K49 PolarHBondContact O-N 3.29Å; K49-N53 VanDerWaalsContact O-CB 3.32Å; K49-N53 WeakPolarHBondContact O-CB 3.49Å; K49-N53 PolarHBondContact O-N 3.29Å; K49-N53 VanDerWaalsContact O-N 3.17Å; K49-N53 PolarHBondContact O-ND2 2.99Å; K49-L64 HydrophobicContact CB-CD2 4.45Å; K49-V66 HydrophobicContact CB-CG2 4.33Å; K49-V66 HydrophobicContact CD-CB 4.21Å; K49-V66 HydrophobicContact CD-CG2 4.09Å; K49-V66 HydrophobicContact CG-CG2 4.31Å; K49-V66 PolarHBondContact NZ-O 2.89Å
50	N	89.8	Confident	79.6	Confident	73 Å²	73	66.6 Å²	66.6	39%	0.39	33%	0.333	S	S	.	.	H	α-helix	trans	-72.5	-38.2	-179	-74.5	-23.9	0	0	0	112.2	T46 L47 A48 R54	T46-N50 VanDerWaalsContact O-CB 3.29Å; T46-N50 WeakPolarHBondContact O-CB 3.46Å; T46-N50 PolarHBondContact O-N 2.94Å; T46-N50 PolarHBondContact O-ND2 3.05Å; L47-N50 PolarHBondContact O-N 3.33Å; A48-N50 VanDerWaalsContact C-N 3.32Å; A48-N50 PolarHBondContact O-N 3.08Å; N50-R54 WeakPolarHBondContact O-CB 3.26Å; N50-R54 WeakPolarHBondContact O-CD 3.17Å; N50-R54 WeakPolarHBondContact O-CG 3.47Å; N50-R54 PolarHBondContact O-N 3.38Å; N50-R54 VanDerWaalsContact O-N 3.15Å
51	N	87.4	Confident	78.4	Confident	49 Å²	49	67.4 Å²	67.4	26%	0.262	34%	0.337	S	S	.	.	H	α-helix	trans	-67.6	-48.4	178.9	-164.1	-3.9	0	0	0	111	L47 A48 N53 R54 S55 Y313	L47-N51 VanDerWaalsContact O-CB 3.31Å; L47-N51 WeakPolarHBondContact O-CB 3.35Å; L47-N51 PolarHBondContact O-N 2.83Å; A48-N51 PolarHBondContact O-N 3.48Å; N51-N53 PolarHBondContact O-N 3.03Å; N51-R54 WeakPolarHBondContact O-CB 3.41Å; N51-R54 PolarHBondContact O-N 3.49Å; N51-S55 PolarHBondContact O-N 3.39Å; N51-S55 PolarHBondContact O-OG 2.81Å; N51-S55 VanDerWaalsContact O-OG 3.07Å; N51-Y313 WeakPolarHBondContact CB-OH 3.43Å; N51-Y313 PolarHBondContact ND2-OH 3.3Å
52	I	86.6	Confident	77.4	Confident	7 Å²	7	67.9 Å²	67.9	4%	0.036	34%	0.342	C	S	.	.	H	α-helix	trans	-61	-42.8	177.7	-67.4	171.3	0	0	0	112.3	A48 R54 S55 S56 L64 V312 Y313 V316	A48-I52 WeakPolarHBondContact O-CB 3.45Å; A48-I52 VanDerWaalsContact O-CG1 3.29Å; A48-I52 WeakPolarHBondContact O-CG1 3.47Å; A48-I52 PolarHBondContact O-N 2.99Å; I52-R54 VanDerWaalsContact C-N 3.25Å; I52-R54 PolarHBondContact O-N 2.74Å; I52-S55 PolarHBondContact O-OG 2.94Å; I52-S56 VanDerWaalsContact O-CB 3.28Å; I52-S56 WeakPolarHBondContact O-CB 3.35Å; I52-S56 PolarHBondContact O-N 3.41Å; I52-S56 VanDerWaalsContact O-N 3.07Å; I52-S56 PolarHBondContact O-OG 3.26Å; I52-S56 VanDerWaalsContact O-OG 3.1Å; I52-L64 HydrophobicContact CB-CD2 4.35Å; I52-L64 HydrophobicContact CD1-CD2 4.22Å; I52-L64 HydrophobicContact CG2-CD2 4.13Å; I52-V312 HydrophobicContact CD1-CG1 3.85Å; I52-Y313 HydrophobicContact CD1-CD1 3.99Å; I52-Y313 HydrophobicContact CD1-CD2 4.04Å; I52-Y313 HydrophobicContact CD1-CE1 3.93Å; I52-Y313 HydrophobicContact CD1-CE2 3.94Å; I52-Y313 HydrophobicContact CD1-CG 4.06Å; I52-Y313 HydrophobicContact CG1-CD1 4.17Å; I52-Y313 HydrophobicContact CG1-CE1 3.62Å; I52-Y313 HydrophobicContact CG1-CE2 4.09Å; I52-V316 HydrophobicContact CD1-CB 4.24Å; I52-V316 HydrophobicContact CD1-CG1 4.31Å; I52-V316 HydrophobicContact CD1-CG2 3.99Å; I52-V316 HydrophobicContact CG2-CG1 3.91Å; I52-V316 HydrophobicContact CG2-CG2 4.45Å
53	N	86.8	Confident	77	Confident	52 Å²	52	67 Å²	67	28%	0.278	34%	0.342	S	S	.	.	H	α-helix	trans	-71.9	-16.5	177	-78.7	-58.5	0	0	0	113.4	K49 N51 L64	K49-N53 VanDerWaalsContact O-CB 3.32Å; K49-N53 WeakPolarHBondContact O-CB 3.49Å; K49-N53 PolarHBondContact O-N 3.29Å; K49-N53 VanDerWaalsContact O-N 3.17Å; K49-N53 PolarHBondContact O-ND2 2.99Å; N51-N53 PolarHBondContact O-N 3.03Å; N53-L64 PolarHBondContact ND2-O 2.92Å; N53-L64 VanDerWaalsContact ND2-O 3.08Å; N53-L64 PolarHBondContact OD1-N 2.96Å
54	R	82.4	Confident	77	Confident	209 Å²	209	65 Å²	65	79%	0.789	33%	0.331	S	S	*	.	H	α-helix	trans	-87.7	-38.4	173	-77.3	171.2	-178.6	179.5	1.9	112.6	N50 N51 I52	N50-R54 WeakPolarHBondContact O-CB 3.26Å; N50-R54 WeakPolarHBondContact O-CD 3.17Å; N50-R54 WeakPolarHBondContact O-CG 3.47Å; N50-R54 PolarHBondContact O-N 3.38Å; N50-R54 VanDerWaalsContact O-N 3.15Å; N51-R54 WeakPolarHBondContact O-CB 3.41Å; N51-R54 PolarHBondContact O-N 3.49Å; I52-R54 VanDerWaalsContact C-N 3.25Å; I52-R54 PolarHBondContact O-N 2.74Å
55	S	71.8	Confident	76.9	Confident	82 Å²	82	67.1 Å²	67.1	57%	0.573	34%	0.341	S	S	*	.	H	α-helix	trans	-83.5	-22.4	-177.1	58.8	0	0	0	0	114	N51 I52 N57	N51-S55 PolarHBondContact O-N 3.39Å; N51-S55 PolarHBondContact O-OG 2.81Å; N51-S55 VanDerWaalsContact O-OG 3.07Å; I52-S55 PolarHBondContact O-OG 2.94Å; S55-N57 PolarHBondContact O-N 3.36Å
56	S	61.9	Low	76.9	Confident	27 Å²	27	67.5 Å²	67.5	19%	0.189	34%	0.344	C	S	.	.	S	Bend	trans	-65	122.9	179.6	-87.6	0	0	0	0	114.2	I52 R58 T61	I52-S56 VanDerWaalsContact O-CB 3.28Å; I52-S56 WeakPolarHBondContact O-CB 3.35Å; I52-S56 PolarHBondContact O-N 3.41Å; I52-S56 VanDerWaalsContact O-N 3.07Å; I52-S56 PolarHBondContact O-OG 3.26Å; I52-S56 VanDerWaalsContact O-OG 3.1Å; S56-R58 PolarHBondContact O-N 3.3Å; S56-T61 WeakPolarHBondContact CB-OG1 3.27Å; S56-T61 WeakPolarHBondContact OG-CB 3.45Å; S56-T61 PolarHBondContact OG-OG1 3.22Å
57	N	56.9	Low	77	Confident	127 Å²	127	66.9 Å²	66.9	68%	0.679	34%	0.339	S	S	*	.			trans	-62.6	106.4	158.7	-89.8	-27	0	0	0	109.1	S55 S59 T60 T61	S55-N57 PolarHBondContact O-N 3.36Å; N57-S59 PolarHBondContact O-N 2.65Å; N57-T60 PolarHBondContact O-N 3.36Å; N57-T60 PolarHBondContact O-OG1 3.21Å; N57-T61 PolarHBondContact O-OG1 2.69Å
58	R	52	Low	77	Confident	238 Å²	238	68 Å²	68	90%	0.898	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-4.4	-174.1	-72.7	178.9	167.3	177.3	-4.7	116.8	S56	S56-R58 PolarHBondContact O-N 3.3Å
59	S	48.8	Very low	77	Confident	110 Å²	110	69.3 Å²	69.3	77%	0.769	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-22.1	179.9	51.7	0	0	0	0	114.6	N57	N57-S59 PolarHBondContact O-N 2.65Å
60	T	52.6	Low	76.8	Confident	101 Å²	101	71.6 Å²	71.6	62%	0.62	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-30	-175.4	50.8	0	0	0	0	113.7	N57 N323	N57-T60 PolarHBondContact O-N 3.36Å; N57-T60 PolarHBondContact O-OG1 3.21Å; T60-N323 PolarHBondContact O-ND2 2.86Å
61	T	57.2	Low	76.6	Confident	21 Å²	21	68.6 Å²	68.6	13%	0.129	35%	0.346	C	S	.	.	S	Bend	trans	-105	123.3	178.3	27.8	0	0	0	0	110.6	S56 N57 Q320	S56-T61 WeakPolarHBondContact CB-OG1 3.27Å; S56-T61 WeakPolarHBondContact OG-CB 3.45Å; S56-T61 PolarHBondContact OG-OG1 3.22Å; N57-T61 PolarHBondContact O-OG1 2.69Å; T61-Q320 HydrophobicContact CG2-CG 3.46Å; T61-Q320 VanDerWaalsContact CG2-CG 3.46Å
62	G	67.2	Low	76.3	Confident	11 Å²	11	72.6 Å²	72.6	11%	0.113	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-62.5	156.7	170.7	0	0	0	0	0	112.4	L23 F25 L64	L23-G62 CarbonylContact O-C 3.51Å; L23-G62 VanDerWaalsContact O-C 3.3Å; L23-G62 WeakPolarHBondContact O-CA 3.34Å; F25-G62 WeakPolarHBondContact CE1-O 3.16Å; G62-L64 PolarHBondContact O-N 3.12Å
63	K	81.8	Confident	76.2	Confident	113 Å²	113	81.4 Å²	81.4	49%	0.491	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	124.3	176.2	-177.9	-165.7	171.3	-148.8	0	109.5	L23 S24 F25 E65	L23-K63 PolarHBondContact O-N 3.32Å; S24-K63 VanDerWaalsContact CA-O 3.28Å; S24-K63 WeakPolarHBondContact CA-O 3.32Å; F25-K63 PolarHBondContact N-O 3.17Å; K63-E65 IonicContact NZ-OE1 3.85Å; K63-E65 PolarHBondContact NZ-OE1 3.18Å; K63-E65 PolarHBondContact O-N 3.34Å
64	L	87.5	Confident	76.2	Confident	0 Å²	0	82 Å²	82	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	119.1	177.5	171.1	63.8	0	0	0	110.5	F25 I27 K49 I52 N53 G62 V66 V312 V316	F25-L64 HydrophobicContact CD2-CD1 4.15Å; F25-L64 HydrophobicContact CE2-CD1 3.8Å; I27-L64 HydrophobicContact CD1-CD1 3.74Å; I27-L64 HydrophobicContact CG1-CD1 4.05Å; K49-L64 HydrophobicContact CB-CD2 4.45Å; I52-L64 HydrophobicContact CB-CD2 4.35Å; I52-L64 HydrophobicContact CD1-CD2 4.22Å; I52-L64 HydrophobicContact CG2-CD2 4.13Å; N53-L64 PolarHBondContact ND2-O 2.92Å; N53-L64 VanDerWaalsContact ND2-O 3.08Å; N53-L64 PolarHBondContact OD1-N 2.96Å; G62-L64 PolarHBondContact O-N 3.12Å; L64-V66 HydrophobicContact CD1-CG2 4.03Å; L64-V66 HydrophobicContact CD2-CG2 4.38Å; L64-V66 HydrophobicContact CG-CG2 4.09Å; L64-V312 HydrophobicContact CD2-CG1 3.92Å; L64-V316 HydrophobicContact CD1-CG2 4.25Å; L64-V316 HydrophobicContact CD2-CG2 3.9Å
65	E	90	Very high	76.6	Confident	45 Å²	45	74 Å²	74	21%	0.21	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	138.4	166.1	-58	-161.9	154.2	0	0	109.9	F25 R26 I27 K63	F25-E65 PolarHBondContact O-N 3.49Å; R26-E65 WeakPolarHBondContact CA-O 3.29Å; R26-E65 HydrophobicContact CB-CB 4.48Å; R26-E65 HydrophobicContact CG-CB 4.37Å; R26-E65 IonicContact CZ-OE2 2.67Å; R26-E65 IonicContact NE-OE2 3.61Å; R26-E65 IonicContact NH2-OE2 3.89Å; R26-E65 PolarHBondContact NH2-OE2 3.35Å; I27-E65 PolarHBondContact N-O 3.26Å; K63-E65 IonicContact NZ-OE1 3.85Å; K63-E65 PolarHBondContact NZ-OE1 3.18Å; K63-E65 PolarHBondContact O-N 3.34Å
66	V	91.6	Very high	77.3	Confident	10 Å²	10	75.5 Å²	75.5	6%	0.061	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.6	172.6	-169.5	0	0	0	0	106.8	I27 A29 I45 K49 L64	I27-V66 HydrophobicContact CB-CG1 4.38Å; I27-V66 HydrophobicContact CB-CG2 4.4Å; I27-V66 WeakPolarHBondContact O-CA 3.43Å; A29-V66 HydrophobicContact CB-CG1 4.19Å; I45-V66 HydrophobicContact CG2-CB 4.23Å; I45-V66 HydrophobicContact CG2-CG1 3.68Å; I45-V66 HydrophobicContact CG2-CG2 4.45Å; K49-V66 HydrophobicContact CB-CG2 4.33Å; K49-V66 HydrophobicContact CD-CB 4.21Å; K49-V66 HydrophobicContact CD-CG2 4.09Å; K49-V66 HydrophobicContact CG-CG2 4.31Å; K49-V66 PolarHBondContact NZ-O 2.89Å; L64-V66 HydrophobicContact CD1-CG2 4.03Å; L64-V66 HydrophobicContact CD2-CG2 4.38Å; L64-V66 HydrophobicContact CG-CG2 4.09Å
67	D	92.4	Very high	78.6	Confident	36 Å²	36	82.5 Å²	82.5	19%	0.193	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.7	175.3	-81.4	31.8	0	0	0	107.9	R26 I27 A28 A29 F69 K89	R26-D67 WeakPolarHBondContact CD-OD1 3.48Å; R26-D67 IonicContact NE-OD1 2.76Å; I27-D67 PolarHBondContact O-N 3.48Å; A28-D67 CarbonylContact C-O 3.52Å; A28-D67 WeakPolarHBondContact CA-O 3.47Å; A29-D67 PolarHBondContact N-O 3.44Å; D67-F69 HydrophobicContact CB-CE2 3.87Å; D67-K89 VanDerWaalsContact OD2-CD 3.27Å; D67-K89 WeakPolarHBondContact OD2-CD 3.34Å; D67-K89 WeakPolarHBondContact OD2-CE 3.34Å; D67-K89 IonicContact OD2-NZ 3.16Å; D67-K89 PolarHBondContact OD2-NZ 3.03Å
68	I	90.8	Very high	80.1	Confident	54 Å²	54	80 Å²	80	28%	0.277	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.6	-178	-58	179.9	0	0	0	108.7	A29 L31 R42 I45	A29-I68 CarbonylContact O-C 3.59Å; A29-I68 WeakPolarHBondContact O-CA 3.38Å; L31-I68 HydrophobicContact CD1-CG2 3.6Å; L31-I68 HydrophobicContact CG-CG2 4.04Å; R42-I68 HydrophobicContact CG-CD1 3.95Å; I45-I68 HydrophobicContact CG2-CD1 4.27Å
69	F	90.5	Very high	82	Confident	29 Å²	29	68.6 Å²	68.6	13%	0.127	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.3	175.4	-63.5	-101.4	0	0	0	108	A28 A29 I30 L31 D67 T82 I86 K89	A28-F69 HydrophobicContact CB-CD2 4.44Å; A28-F69 HydrophobicContact CB-CE2 4.13Å; A29-F69 PolarHBondContact O-N 3.06Å; I30-F69 CarbonylContact C-O 3.54Å; I30-F69 WeakPolarHBondContact CA-O 3.32Å; L31-F69 PolarHBondContact N-O 3.39Å; D67-F69 HydrophobicContact CB-CE2 3.87Å; F69-T82 HydrophobicContact CB-CG2 4.33Å; F69-T82 HydrophobicContact CD1-CG2 3.94Å; F69-T82 HydrophobicContact CG-CG2 4.36Å; F69-I86 HydrophobicContact CD1-CG1 4.39Å; F69-I86 HydrophobicContact CD2-CD1 3.99Å; F69-I86 HydrophobicContact CD2-CG1 3.92Å; F69-I86 HydrophobicContact CE1-CG1 3.97Å; F69-I86 HydrophobicContact CE2-CD1 4.06Å; F69-I86 HydrophobicContact CE2-CG1 3.47Å; F69-I86 VanDerWaalsContact CE2-CG1 3.47Å; F69-I86 HydrophobicContact CG-CD1 4.27Å; F69-I86 HydrophobicContact CG-CG1 4.36Å; F69-I86 HydrophobicContact CZ-CD1 4.37Å; F69-I86 HydrophobicContact CZ-CG1 3.46Å; F69-I86 VanDerWaalsContact CZ-CG1 3.46Å; F69-K89 HydrophobicContact CZ-CD 4.1Å; F69-K89 VanDerWaalsContact CZ-NZ 3.33Å
70	E	87.6	Confident	84	Confident	110 Å²	110	64.1 Å²	64.1	51%	0.514	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	123.1	-176.4	-71.9	167.3	173.3	0	0	109.1	L31 R42	L31-E70 CarbonylContact O-C 3.58Å; L31-E70 WeakPolarHBondContact O-CA 3.49Å; R42-E70 IonicContact CZ-OE1 2.81Å; R42-E70 IonicContact NE-OE1 3.64Å; R42-E70 IonicContact NH1-OE1 2.79Å; R42-E70 PolarHBondContact NH1-OE1 3.34Å; R42-E70 IonicContact NH1-OE2 2.76Å
71	L	85.8	Confident	85.8	Confident	10 Å²	10	64.6 Å²	64.6	5%	0.052	31%	0.307	C	S	.	.			trans	-84.6	127.6	175.4	-79.2	168.2	0	0	0	109.8	I30 L31 D32 M79 P97	I30-L71 HydrophobicContact CG2-CD1 3.46Å; I30-L71 VanDerWaalsContact CG2-CD1 3.46Å; I30-L71 HydrophobicContact CG2-CG 3.73Å; L31-L71 PolarHBondContact O-N 3.29Å; D32-L71 HydrophobicContact CB-CB 4.37Å; D32-L71 HydrophobicContact CB-CD1 4.44Å; L71-M79 HydrophobicContact CD1-SD 4.22Å; L71-M79 HydrophobicContact CD2-SD 3.98Å; L71-M79 HydrophobicContact CG-SD 4.45Å; L71-P97 HydrophobicContact CD1-CB 4.02Å; L71-P97 HydrophobicContact CD1-CG 3.95Å
72	L	81.3	Confident	87.5	Confident	133 Å²	133	64.9 Å²	64.9	70%	0.696	31%	0.309	S	S	*	.	S	Bend	trans	-87.6	-24.2	174.1	-64	175	0	0	0	112.6
73	R	84.3	Confident	88.7	Confident	192 Å²	192	64.4 Å²	64.4	73%	0.725	30%	0.304	S	S	*	.	S	Bend	trans	-151.5	148.3	-177.2	-64.4	-174.5	175.7	178.5	-2.1	110.4	S75	R73-S75 PolarHBondContact O-N 3Å
74	D	86.9	Confident	89.1	Confident	65 Å²	65	61.2 Å²	61.2	35%	0.348	30%	0.295	S	S	.	.			trans	-76.7	110.8	169.3	-168	24.1	0	0	0	109.7	S100 P101 A102 S103	D74-S100 WeakPolarHBondContact OD1-CB 3.37Å; D74-P101 VanDerWaalsContact OD2-CD 3.23Å; D74-P101 WeakPolarHBondContact OD2-CD 3.43Å; D74-A102 PolarHBondContact OD1-N 3.09Å; D74-A102 WeakPolarHBondContact OD2-CB 3.33Å; D74-A102 PolarHBondContact OD2-N 3.41Å; D74-S103 VanDerWaalsContact OD1-CB 3.28Å; D74-S103 WeakPolarHBondContact OD1-CB 3.22Å; D74-S103 PolarHBondContact OD1-N 2.96Å; D74-S103 PolarHBondContact OD1-OG 3.37Å
75	S	89.3	Confident	89.3	Confident	39 Å²	39	66.4 Å²	66.4	27%	0.273	32%	0.32	S	S	.	.			trans	-157.3	120.9	-174.5	177.5	0	0	0	0	111.6	R73 Y77 E78 M79	R73-S75 PolarHBondContact O-N 3Å; S75-Y77 PolarHBondContact O-N 3.42Å; S75-E78 PolarHBondContact O-N 3.39Å; S75-M79 WeakPolarHBondContact O-CB 3.33Å; S75-M79 PolarHBondContact O-N 3.44Å
76	E	87.2	Confident	89.5	Confident	115 Å²	115	64.3 Å²	64.3	54%	0.537	31%	0.31	S	S	.	.	H	α-helix	trans	-58	-33.8	178.8	-54.8	-169.6	146.9	0	0	112.4	G80 A102 S105 I106	E76-G80 PolarHBondContact O-N 3.47Å; E76-A102 HydrophobicContact CG-CB 3.9Å; E76-S105 PolarHBondContact OE1-OG 2.92Å; E76-I106 HydrophobicContact CB-CB 4.47Å; E76-I106 HydrophobicContact CB-CG2 4.5Å
77	Y	89.1	Confident	89.5	Confident	174 Å²	174	64 Å²	64	68%	0.682	31%	0.307	S	S	*	.	H	α-helix	trans	-74.4	-49.3	-177.3	-179.5	-100.2	0	0	0	112.6	S75 G80 E81	S75-Y77 PolarHBondContact O-N 3.42Å; Y77-G80 PolarHBondContact O-N 3.46Å; Y77-G80 VanDerWaalsContact O-N 3.16Å; Y77-E81 PolarHBondContact O-N 3.49Å
78	E	89.1	Confident	89.4	Confident	73 Å²	73	65.2 Å²	65.2	34%	0.341	32%	0.319	S	S	.	.	H	α-helix	trans	-67.1	-39.1	-179.5	-173.1	173.6	173.7	0	0	111.1	S75 E81 T82	S75-E78 PolarHBondContact O-N 3.39Å; E78-E81 PolarHBondContact O-N 2.91Å; E78-T82 WeakPolarHBondContact O-CB 3.48Å; E78-T82 PolarHBondContact O-N 2.95Å; E78-T82 PolarHBondContact O-OG1 3.41Å
79	M	91.4	Very high	89.3	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-67.2	-36.9	171.6	-171.5	64.5	-112.5	0	0	111.4	I30 L71 S75 E81 T82 M83 I86 I106 I107	I30-M79 HydrophobicContact CD1-CE 3.39Å; I30-M79 HydrophobicContact CD1-SD 4Å; I30-M79 HydrophobicContact CG1-CE 4.04Å; I30-M79 HydrophobicContact CG1-SD 4.48Å; I30-M79 HydrophobicContact CG2-CE 4.44Å; I30-M79 HydrophobicContact CG2-SD 3.83Å; L71-M79 HydrophobicContact CD1-SD 4.22Å; L71-M79 HydrophobicContact CD2-SD 3.98Å; L71-M79 HydrophobicContact CG-SD 4.45Å; S75-M79 WeakPolarHBondContact O-CB 3.33Å; S75-M79 PolarHBondContact O-N 3.44Å; M79-E81 PolarHBondContact O-N 3.1Å; M79-T82 HydrophobicContact CE-CG2 3.86Å; M79-T82 PolarHBondContact O-N 3.3Å; M79-M83 HydrophobicContact CE-CB 4.06Å; M79-M83 HydrophobicContact CE-SD 4.05Å; M79-M83 VanDerWaalsContact O-CB 3.25Å; M79-M83 WeakPolarHBondContact O-CB 3.46Å; M79-M83 PolarHBondContact O-N 2.88Å; M79-I86 HydrophobicContact CE-CD1 4.3Å; M79-I106 HydrophobicContact CB-CG2 3.73Å; M79-I106 HydrophobicContact CG-CG2 3.65Å; M79-I107 HydrophobicContact CE-CD1 4.3Å; M79-I107 HydrophobicContact CE-CG1 3.96Å; M79-I107 HydrophobicContact CG-CD1 4.01Å; M79-I107 HydrophobicContact CG-CG1 3.66Å; M79-I107 HydrophobicContact SD-CD1 3.81Å; M79-I107 HydrophobicContact SD-CG1 3.9Å
80	G	90.6	Very high	89.1	Confident	16 Å²	16	65 Å²	65	17%	0.165	32%	0.317	C	S	.	.	H	α-helix	trans	-56.7	-47.8	172.7	0	0	0	0	0	113.2	E76 Y77 M83 C84	E76-G80 PolarHBondContact O-N 3.47Å; Y77-G80 PolarHBondContact O-N 3.46Å; Y77-G80 VanDerWaalsContact O-N 3.16Å; G80-M83 PolarHBondContact O-N 2.98Å; G80-C84 PolarHBondContact O-N 2.94Å; G80-C84 PolarHBondContact O-SG 3.07Å
81	E	90.8	Very high	89.3	Confident	111 Å²	111	60.1 Å²	60.1	52%	0.519	30%	0.295	S	S	.	.	H	α-helix	trans	-64.5	-46.1	175.4	-66.8	-152.1	131.3	0	0	112.3	Y77 E78 M79 M83 C84 Q85	Y77-E81 PolarHBondContact O-N 3.49Å; E78-E81 PolarHBondContact O-N 2.91Å; M79-E81 PolarHBondContact O-N 3.1Å; E81-M83 VanDerWaalsContact C-N 3.29Å; E81-M83 PolarHBondContact O-N 3.4Å; E81-C84 PolarHBondContact O-N 2.92Å; E81-C84 VanDerWaalsContact O-N 3.11Å; E81-Q85 PolarHBondContact O-N 3.48Å; E81-Q85 VanDerWaalsContact O-N 3.14Å
82	T	91.8	Very high	89.5	Confident	27 Å²	27	59.7 Å²	59.7	17%	0.166	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-40.6	178.4	-60.1	0	0	0	0	111.5	F69 E78 M79 C84 Q85 I86	F69-T82 HydrophobicContact CB-CG2 4.33Å; F69-T82 HydrophobicContact CD1-CG2 3.94Å; F69-T82 HydrophobicContact CG-CG2 4.36Å; E78-T82 WeakPolarHBondContact O-CB 3.48Å; E78-T82 PolarHBondContact O-N 2.95Å; E78-T82 PolarHBondContact O-OG1 3.41Å; M79-T82 HydrophobicContact CE-CG2 3.86Å; M79-T82 PolarHBondContact O-N 3.3Å; T82-C84 VanDerWaalsContact C-N 3.31Å; T82-C84 PolarHBondContact O-N 3.48Å; T82-Q85 WeakPolarHBondContact O-CB 3.49Å; T82-Q85 PolarHBondContact O-N 2.92Å; T82-Q85 VanDerWaalsContact O-N 3.14Å; T82-I86 HydrophobicContact CG2-CD1 4.21Å; T82-I86 WeakPolarHBondContact O-CG1 3.34Å; T82-I86 PolarHBondContact O-N 2.83Å
83	M	92.6	Very high	90	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-35.8	177.4	-160.1	67	-168.3	0	0	112.2	I30 M79 G80 E81 Q85 I86 M87 V94 I107 I110 C111	I30-M83 HydrophobicContact CD1-SD 4.38Å; M79-M83 HydrophobicContact CE-CB 4.06Å; M79-M83 HydrophobicContact CE-SD 4.05Å; M79-M83 VanDerWaalsContact O-CB 3.25Å; M79-M83 WeakPolarHBondContact O-CB 3.46Å; M79-M83 PolarHBondContact O-N 2.88Å; G80-M83 PolarHBondContact O-N 2.98Å; E81-M83 VanDerWaalsContact C-N 3.29Å; E81-M83 PolarHBondContact O-N 3.4Å; M83-Q85 VanDerWaalsContact C-N 3.34Å; M83-I86 WeakPolarHBondContact O-CB 3.15Å; M83-I86 PolarHBondContact O-N 2.84Å; M83-I86 HydrophobicContact SD-CD1 4.18Å; M83-M87 HydrophobicContact CE-CE 3.45Å; M83-M87 VanDerWaalsContact CE-CE 3.45Å; M83-M87 VanDerWaalsContact O-CG 3.28Å; M83-M87 WeakPolarHBondContact O-CG 3.41Å; M83-M87 PolarHBondContact O-N 3.04Å; M83-V94 HydrophobicContact CE-CB 4.23Å; M83-V94 HydrophobicContact CE-CG1 4.13Å; M83-V94 HydrophobicContact CE-CG2 3.7Å; M83-V94 HydrophobicContact SD-CG1 4.45Å; M83-I107 HydrophobicContact CE-CG2 4.16Å; M83-I107 HydrophobicContact SD-CG1 4.34Å; M83-I107 HydrophobicContact SD-CG2 4.18Å; M83-I110 HydrophobicContact CB-CD1 3.76Å; M83-I110 HydrophobicContact CG-CB 3.97Å; M83-I110 HydrophobicContact CG-CD1 3.84Å; M83-I110 HydrophobicContact CG-CG2 3.66Å; M83-C111 WeakPolarHBondContact CE-SG 3.41Å
84	C	91.9	Very high	90.5	Very high	46 Å²	46	44.2 Å²	44.2	31%	0.311	23%	0.225	S	C	.	.	H	α-helix	trans	-70.7	-29.8	175.1	-61.5	0	0	0	0	113	G80 E81 T82 S88 C335	G80-C84 PolarHBondContact O-N 2.94Å; G80-C84 PolarHBondContact O-SG 3.07Å; E81-C84 PolarHBondContact O-N 2.92Å; E81-C84 VanDerWaalsContact O-N 3.11Å; T82-C84 VanDerWaalsContact C-N 3.31Å; T82-C84 PolarHBondContact O-N 3.48Å; C84-S88 PolarHBondContact O-N 3.08Å; C84-C335 WeakPolarHBondContact CA-SG 3.42Å; C84-C335 HydrophobicContact CB-CB 3.98Å; C84-C335 WeakPolarHBondContact CB-SG 3.22Å; C84-C335 WeakPolarHBondContact SG-CB 3.33Å; C84-C335 CovalentContact SG-SG 2.03Å; C84-C335 PolarHBondContact SG-SG 3.25Å
85	Q	91.8	Very high	90.8	Very high	110 Å²	110	41.1 Å²	41.1	51%	0.514	21%	0.208	S	C	.	.	H	α-helix	trans	-67.2	-44.6	168.1	-59.1	179.4	21.7	0	0	111	E81 T82 M83 M87 S88 K89	E81-Q85 PolarHBondContact O-N 3.48Å; E81-Q85 VanDerWaalsContact O-N 3.14Å; T82-Q85 WeakPolarHBondContact O-CB 3.49Å; T82-Q85 PolarHBondContact O-N 2.92Å; T82-Q85 VanDerWaalsContact O-N 3.14Å; M83-Q85 VanDerWaalsContact C-N 3.34Å; Q85-M87 PolarHBondContact O-N 3.44Å; Q85-S88 PolarHBondContact O-N 3.38Å; Q85-S88 PolarHBondContact O-OG 3.33Å; Q85-K89 PolarHBondContact O-N 3.47Å
86	I	92.5	Very high	90.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.6	-49.9	176.1	-72.6	165.9	0	0	0	111.2	A28 I30 F69 M79 T82 M83 S88 K89 V91 V94	A28-I86 HydrophobicContact CB-CB 4.48Å; A28-I86 HydrophobicContact CB-CD1 4.17Å; A28-I86 HydrophobicContact CB-CG1 4.1Å; A28-I86 HydrophobicContact CB-CG2 3.58Å; I30-I86 HydrophobicContact CD1-CD1 3.86Å; I30-I86 HydrophobicContact CG1-CD1 3.84Å; F69-I86 HydrophobicContact CD1-CG1 4.39Å; F69-I86 HydrophobicContact CD2-CD1 3.99Å; F69-I86 HydrophobicContact CD2-CG1 3.92Å; F69-I86 HydrophobicContact CE1-CG1 3.97Å; F69-I86 HydrophobicContact CE2-CD1 4.06Å; F69-I86 HydrophobicContact CE2-CG1 3.47Å; F69-I86 VanDerWaalsContact CE2-CG1 3.47Å; F69-I86 HydrophobicContact CG-CD1 4.27Å; F69-I86 HydrophobicContact CG-CG1 4.36Å; F69-I86 HydrophobicContact CZ-CD1 4.37Å; F69-I86 HydrophobicContact CZ-CG1 3.46Å; F69-I86 VanDerWaalsContact CZ-CG1 3.46Å; M79-I86 HydrophobicContact CE-CD1 4.3Å; T82-I86 HydrophobicContact CG2-CD1 4.21Å; T82-I86 WeakPolarHBondContact O-CG1 3.34Å; T82-I86 PolarHBondContact O-N 2.83Å; M83-I86 WeakPolarHBondContact O-CB 3.15Å; M83-I86 PolarHBondContact O-N 2.84Å; M83-I86 HydrophobicContact SD-CD1 4.18Å; I86-S88 VanDerWaalsContact C-N 3.27Å; I86-S88 PolarHBondContact O-N 3.24Å; I86-K89 WeakPolarHBondContact O-CB 3.38Å; I86-K89 PolarHBondContact O-N 3.17Å; I86-K89 VanDerWaalsContact O-N 3.09Å; I86-V91 HydrophobicContact CG2-CG1 4.21Å; I86-V91 HydrophobicContact CG2-CG2 3.7Å; I86-V94 HydrophobicContact CG2-CG2 4.02Å
87	M	92.1	Very high	91.1	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.015	17%	0.17	C	C	.	.	H	α-helix	trans	-58.9	-37.5	179.1	-72.6	-71.9	155.7	0	0	112.8	M83 Q85 K89 G90 I110 K114 V116 L333	M83-M87 HydrophobicContact CE-CE 3.45Å; M83-M87 VanDerWaalsContact CE-CE 3.45Å; M83-M87 VanDerWaalsContact O-CG 3.28Å; M83-M87 WeakPolarHBondContact O-CG 3.41Å; M83-M87 PolarHBondContact O-N 3.04Å; Q85-M87 PolarHBondContact O-N 3.44Å; M87-K89 PolarHBondContact O-N 3.05Å; M87-G90 PolarHBondContact O-N 2.92Å; M87-I110 HydrophobicContact CE-CG2 4.39Å; M87-K114 HydrophobicContact CE-CB 4.35Å; M87-K114 HydrophobicContact SD-CB 4.06Å; M87-K114 HydrophobicContact SD-CG 4.08Å; M87-V116 HydrophobicContact CE-CB 3.83Å; M87-V116 HydrophobicContact CE-CG1 4.11Å; M87-V116 HydrophobicContact CE-CG2 3.8Å; M87-V116 HydrophobicContact SD-CG2 3.95Å; M87-L333 CarbonylContact C-O 3.59Å; M87-L333 VanDerWaalsContact C-O 3.25Å; M87-L333 HydrophobicContact CB-CB 4.32Å; M87-L333 PolarHBondContact O-N 2.83Å; M87-L333 HydrophobicContact SD-CB 4.33Å; M87-L333 HydrophobicContact SD-CD1 4.15Å
88	S	90.4	Very high	91	Very high	62 Å²	62	25.9 Å²	25.9	43%	0.434	14%	0.14	S	C	.	.	H	α-helix	trans	-66.5	-24.5	178.6	79.3	0	0	0	0	113.7	C84 Q85 I86 G90 Q332 L333	C84-S88 PolarHBondContact O-N 3.08Å; Q85-S88 PolarHBondContact O-N 3.38Å; Q85-S88 PolarHBondContact O-OG 3.33Å; I86-S88 VanDerWaalsContact C-N 3.27Å; I86-S88 PolarHBondContact O-N 3.24Å; S88-G90 VanDerWaalsContact C-N 3.34Å; S88-Q332 VanDerWaalsContact O-CG 3.32Å; S88-Q332 WeakPolarHBondContact O-CG 3.3Å; S88-L333 WeakPolarHBondContact CA-O 3.33Å; S88-L333 PolarHBondContact N-O 3.42Å
89	K	89.1	Confident	90.7	Very high	75 Å²	75	25 Å²	25	33%	0.326	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.3	178.4	-69.6	-176.8	173.4	-175.6	0	114.1	R26 D67 F69 Q85 I86 M87	R26-K89 PolarHBondContact NH1-O 3.32Å; D67-K89 VanDerWaalsContact OD2-CD 3.27Å; D67-K89 WeakPolarHBondContact OD2-CD 3.34Å; D67-K89 WeakPolarHBondContact OD2-CE 3.34Å; D67-K89 IonicContact OD2-NZ 3.16Å; D67-K89 PolarHBondContact OD2-NZ 3.03Å; F69-K89 HydrophobicContact CZ-CD 4.1Å; F69-K89 VanDerWaalsContact CZ-NZ 3.33Å; Q85-K89 PolarHBondContact O-N 3.47Å; I86-K89 WeakPolarHBondContact O-CB 3.38Å; I86-K89 PolarHBondContact O-N 3.17Å; I86-K89 VanDerWaalsContact O-N 3.09Å; M87-K89 PolarHBondContact O-N 3.05Å
90	G	87.1	Confident	90.6	Very high	4 Å²	4	25.5 Å²	25.5	4%	0.041	15%	0.149	C	C	.	.			trans	68.4	91.3	-173	0	0	0	0	0	111.9	M87 S88 A330 T331	M87-G90 PolarHBondContact O-N 2.92Å; S88-G90 VanDerWaalsContact C-N 3.34Å; G90-A330 WeakPolarHBondContact O-CB 3.27Å; G90-T331 WeakPolarHBondContact CA-O 3.46Å
91	V	91	Very high	90.3	Very high	8 Å²	8	28 Å²	28	5%	0.048	16%	0.162	C	C	.	.			trans	-116.1	150	-179.9	-61.6	0	0	0	0	111.3	R26 A28 I86 V94 V116	R26-V91 HydrophobicContact CG-CG1 4.17Å; R26-V91 CarbonylContact O-C 3.3Å; R26-V91 WeakPolarHBondContact O-CA 3.45Å; R26-V91 WeakPolarHBondContact O-CB 3.19Å; A28-V91 HydrophobicContact CB-CG1 4.12Å; I86-V91 HydrophobicContact CG2-CG1 4.21Å; I86-V91 HydrophobicContact CG2-CG2 3.7Å; V91-V94 HydrophobicContact CG2-CG2 3.96Å; V91-V116 HydrophobicContact CG2-CG1 4.32Å
92	V	90	Very high	90	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-92.8	-19.3	179.8	-59.7	0	0	0	0	113.5	F25 R26 I27 P117 V319 V328 A330 W341 L347	F25-V92 HydrophobicContact CB-CG1 3.96Å; F25-V92 HydrophobicContact CB-CG2 4.28Å; F25-V92 HydrophobicContact CD2-CG2 4.09Å; R26-V92 PolarHBondContact O-N 2.77Å; I27-V92 HydrophobicContact CG1-CG2 4.14Å; V92-P117 WeakPolarHBondContact O-CD 3.46Å; V92-V319 HydrophobicContact CG2-CG2 4.3Å; V92-V328 HydrophobicContact CG1-CG1 4.43Å; V92-A330 HydrophobicContact CG1-CB 3.91Å; V92-W341 HydrophobicContact CB-CH2 3.75Å; V92-W341 HydrophobicContact CB-CZ2 4.31Å; V92-W341 HydrophobicContact CB-CZ3 4.42Å; V92-W341 HydrophobicContact CG1-CH2 3.94Å; V92-W341 HydrophobicContact CG1-CZ2 3.99Å; V92-W341 WeakPolarHBondContact O-CZ3 3.47Å; V92-L347 HydrophobicContact CB-CD2 4.48Å
93	A	91.8	Very high	89.9	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	160.7	174.9	0	0	0	0	0	110	A28 P117 V315	A28-A93 PolarHBondContact N-O 2.93Å; A28-A93 VanDerWaalsContact N-O 3.11Å; A93-P117 CarbonylContact C-O 3.59Å; A93-P117 VanDerWaalsContact CA-O 3.3Å; A93-P117 WeakPolarHBondContact CA-O 3.32Å; A93-P117 HydrophobicContact CB-CB 4.32Å; A93-V315 HydrophobicContact CB-CB 4.46Å; A93-V315 HydrophobicContact CB-CG1 3.65Å; A93-V315 HydrophobicContact CB-CG2 3.88Å
94	V	93.9	Very high	89.7	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.5	173.9	-176.8	0	0	0	0	109.9	A28 I30 M83 I86 V91 I107 V116 P117 Y118 V119	A28-V94 HydrophobicContact CB-CG2 4.33Å; A28-V94 CarbonylContact O-C 3.52Å; A28-V94 WeakPolarHBondContact O-CA 3.41Å; I30-V94 HydrophobicContact CD1-CG1 3.59Å; I30-V94 HydrophobicContact CG1-CG1 4.45Å; M83-V94 HydrophobicContact CE-CB 4.23Å; M83-V94 HydrophobicContact CE-CG1 4.13Å; M83-V94 HydrophobicContact CE-CG2 3.7Å; M83-V94 HydrophobicContact SD-CG1 4.45Å; I86-V94 HydrophobicContact CG2-CG2 4.02Å; V91-V94 HydrophobicContact CG2-CG2 3.96Å; V94-I107 HydrophobicContact CG1-CG2 4.24Å; V94-V116 HydrophobicContact CG2-CG1 4.24Å; V94-P117 PolarHBondContact N-O 3.48Å; V94-Y118 HydrophobicContact CB-CD2 4.46Å; V94-Y118 HydrophobicContact CG1-CD2 4.5Å; V94-Y118 WeakPolarHBondContact O-CA 3.36Å; V94-Y118 WeakPolarHBondContact O-CD2 3.47Å; V94-V119 PolarHBondContact O-N 2.97Å
95	L	94.6	Very high	89.3	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.8	172.8	-48.2	-176.3	0	0	0	109	I27 A28 A29 I30 V119 L308 A311 V312 V315	I27-L95 HydrophobicContact CG2-CD1 4.2Å; I27-L95 HydrophobicContact CG2-CD2 4.38Å; I27-L95 HydrophobicContact CG2-CG 3.87Å; A28-L95 PolarHBondContact O-N 3.17Å; A29-L95 HydrophobicContact CB-CB 4.11Å; A29-L95 HydrophobicContact CB-CD1 4.25Å; A29-L95 HydrophobicContact CB-CG 4.46Å; I30-L95 PolarHBondContact N-O 3.15Å; L95-V119 HydrophobicContact CD2-CB 3.83Å; L95-V119 HydrophobicContact CD2-CG1 4.49Å; L95-V119 HydrophobicContact CD2-CG2 4.18Å; L95-L308 HydrophobicContact CB-CD2 4.09Å; L95-L308 HydrophobicContact CD1-CD2 4.41Å; L95-A311 HydrophobicContact CD1-CB 4.36Å; L95-A311 HydrophobicContact CD2-CB 3.91Å; L95-V312 HydrophobicContact CD1-CG2 3.73Å; L95-V315 HydrophobicContact CD2-CG2 4.37Å
96	G	90.6	Very high	89.2	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-87.6	162.9	-174.5	0	0	0	0	0	115.7	I30 V119	I30-G96 CarbonylContact O-C 3.56Å; I30-G96 VanDerWaalsContact O-C 3.3Å; G96-V119 PolarHBondContact N-O 3.44Å
97	P	91.1	Very high	89	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-65.1	164.1	171.2	28.8	-34.6	0	0	0	112.1	I30 D32 L71 N104 I107 A122	I30-P97 HydrophobicContact CG2-CG 4.37Å; I30-P97 WeakPolarHBondContact O-CA 2.93Å; I30-P97 VanDerWaalsContact O-N 3.16Å; D32-P97 HydrophobicContact CB-CB 3.76Å; D32-P97 VanDerWaalsContact CG-CB 3.47Å; L71-P97 HydrophobicContact CD1-CB 4.02Å; L71-P97 HydrophobicContact CD1-CG 3.95Å; P97-N104 VanDerWaalsContact CD-OD1 3.29Å; P97-N104 WeakPolarHBondContact CD-OD1 3Å; P97-N104 WeakPolarHBondContact CG-OD1 3.23Å; P97-I107 HydrophobicContact CG-CD1 4.27Å; P97-A122 WeakPolarHBondContact O-CB 3.44Å
98	S	87.1	Confident	88.9	Confident	8 Å²	8	20.6 Å²	20.6	6%	0.056	14%	0.135	C	C	.	.	S	Bend	trans	-95.4	-26.1	-167.7	69	0	0	0	0	115.1	D32 R39 E41 A122 P123	D32-S98 PolarHBondContact OD1-N 2.88Å; D32-S98 PolarHBondContact OD1-OG 2.76Å; D32-S98 PolarHBondContact OD2-N 2.83Å; R39-S98 PolarHBondContact NH1-OG 3.19Å; E41-S98 WeakPolarHBondContact OE1-CB 3.18Å; E41-S98 PolarHBondContact OE1-OG 3.5Å; S98-A122 VanDerWaalsContact O-CA 3.29Å; S98-A122 WeakPolarHBondContact O-CA 3.45Å; S98-A122 VanDerWaalsContact O-CB 3.23Å; S98-A122 WeakPolarHBondContact O-CB 3.3Å; S98-P123 WeakPolarHBondContact O-CD 3.2Å
99	A	83.3	Confident	88.7	Confident	54 Å²	54	21 Å²	21	45%	0.446	13%	0.133	S	C	.	.	S	Bend	trans	-140.6	8	-170.6	0	0	0	0	0	114	D32 P101	D32-A99 VanDerWaalsContact OD2-C 3.25Å; D32-A99 VanDerWaalsContact OD2-CA 3.26Å; D32-A99 WeakPolarHBondContact OD2-CA 3.28Å; D32-A99 WeakPolarHBondContact OD2-CB 3.09Å; D32-A99 PolarHBondContact OD2-N 2.86Å; A99-P101 WeakPolarHBondContact O-CD 3.41Å
100	S	88.3	Confident	88.7	Confident	11 Å²	11	18.3 Å²	18.3	8%	0.077	12%	0.121	C	C	.	.			trans	-108.4	84.5	-174.2	-63.3	0	0	0	0	112.4	D32 D74 S103 N104	D32-S100 WeakPolarHBondContact CB-OG 3.4Å; D32-S100 WeakPolarHBondContact OD2-CB 3.45Å; D32-S100 PolarHBondContact OD2-N 3.24Å; D32-S100 PolarHBondContact OD2-OG 3.24Å; D74-S100 WeakPolarHBondContact OD1-CB 3.37Å; S100-S103 PolarHBondContact O-N 2.03Å; S100-N104 VanDerWaalsContact O-CG 3.3Å; S100-N104 PolarHBondContact O-N 2.63Å; S100-N104 PolarHBondContact O-ND2 2.96Å
101	P	85.2	Confident	88.8	Confident	69 Å²	69	18.2 Å²	18.2	45%	0.448	12%	0.12	S	C	.	.	H	α-helix	trans	-66.1	-36.2	-172.8	26.5	-36.3	0	0	0	114.4	D74 A99 S103 N104 S105 D125	D74-P101 VanDerWaalsContact OD2-CD 3.23Å; D74-P101 WeakPolarHBondContact OD2-CD 3.43Å; A99-P101 WeakPolarHBondContact O-CD 3.41Å; P101-S103 VanDerWaalsContact C-N 3.33Å; P101-S103 PolarHBondContact O-N 3.28Å; P101-N104 PolarHBondContact O-N 2.68Å; P101-S105 PolarHBondContact O-N 2.69Å; P101-D125 WeakPolarHBondContact CB-OD1 3.39Å
102	A	85.1	Confident	88.6	Confident	29 Å²	29	18.4 Å²	18.4	24%	0.24	12%	0.124	C	C	.	.	H	α-helix	trans	-68.5	-36.8	179.2	0	0	0	0	0	111	D74 E76 S105 I106	D74-A102 PolarHBondContact OD1-N 3.09Å; D74-A102 WeakPolarHBondContact OD2-CB 3.33Å; D74-A102 PolarHBondContact OD2-N 3.41Å; E76-A102 HydrophobicContact CG-CB 3.9Å; A102-S105 PolarHBondContact O-N 3.31Å; A102-S105 PolarHBondContact O-OG 3.27Å; A102-I106 PolarHBondContact O-N 3.12Å
103	S	88.6	Confident	88.5	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66.2	-40.4	173.2	-57.2	0	0	0	0	111.3	D74 S100 P101 S105 I106 I107	D74-S103 VanDerWaalsContact OD1-CB 3.28Å; D74-S103 WeakPolarHBondContact OD1-CB 3.22Å; D74-S103 PolarHBondContact OD1-N 2.96Å; D74-S103 PolarHBondContact OD1-OG 3.37Å; S100-S103 PolarHBondContact O-N 2.03Å; P101-S103 VanDerWaalsContact C-N 3.33Å; P101-S103 PolarHBondContact O-N 3.28Å; S103-S105 PolarHBondContact O-N 3.39Å; S103-I106 VanDerWaalsContact O-CG2 3.25Å; S103-I106 WeakPolarHBondContact O-CG2 3.47Å; S103-I106 PolarHBondContact O-N 3.04Å; S103-I107 VanDerWaalsContact O-CD1 3.24Å; S103-I107 WeakPolarHBondContact O-CD1 3.28Å; S103-I107 WeakPolarHBondContact O-CG1 3.46Å; S103-I107 PolarHBondContact O-N 3.45Å; S103-I107 VanDerWaalsContact O-N 3.09Å
104	N	87.6	Confident	88.3	Confident	2 Å²	2	23.3 Å²	23.3	1%	0.011	15%	0.147	C	C	.	.	H	α-helix	trans	-62	-38.7	175.8	-72.6	-33.3	0	0	0	113	P97 S100 P101 S108 Y118 A122	P97-N104 VanDerWaalsContact CD-OD1 3.29Å; P97-N104 WeakPolarHBondContact CD-OD1 3Å; P97-N104 WeakPolarHBondContact CG-OD1 3.23Å; S100-N104 VanDerWaalsContact O-CG 3.3Å; S100-N104 PolarHBondContact O-N 2.63Å; S100-N104 PolarHBondContact O-ND2 2.96Å; P101-N104 PolarHBondContact O-N 2.68Å; N104-S108 WeakPolarHBondContact O-CB 3.33Å; N104-S108 PolarHBondContact O-N 3.12Å; N104-Y118 PolarHBondContact OD1-OH 3.05Å; N104-A122 WeakPolarHBondContact ND2-CB 3.34Å
105	S	85.3	Confident	88.1	Confident	52 Å²	52	25.1 Å²	25.1	36%	0.364	16%	0.155	S	C	.	.	H	α-helix	trans	-60.7	-47.1	179.7	88.4	0	0	0	0	111.7	E76 P101 A102 S103 S108 N109	E76-S105 PolarHBondContact OE1-OG 2.92Å; P101-S105 PolarHBondContact O-N 2.69Å; A102-S105 PolarHBondContact O-N 3.31Å; A102-S105 PolarHBondContact O-OG 3.27Å; S103-S105 PolarHBondContact O-N 3.39Å; S105-S108 WeakPolarHBondContact O-CB 3.45Å; S105-N109 PolarHBondContact O-N 3Å; S105-N109 VanDerWaalsContact O-N 3.16Å
106	I	88.4	Confident	87.9	Confident	31 Å²	31	25.1 Å²	25.1	16%	0.159	16%	0.156	C	C	.	.	H	α-helix	trans	-75.8	-34.8	-177.5	-172.3	62.2	0	0	0	112.4	E76 M79 A102 S103 N109 I110	E76-I106 HydrophobicContact CB-CB 4.47Å; E76-I106 HydrophobicContact CB-CG2 4.5Å; M79-I106 HydrophobicContact CB-CG2 3.73Å; M79-I106 HydrophobicContact CG-CG2 3.65Å; A102-I106 PolarHBondContact O-N 3.12Å; S103-I106 VanDerWaalsContact O-CG2 3.25Å; S103-I106 WeakPolarHBondContact O-CG2 3.47Å; S103-I106 PolarHBondContact O-N 3.04Å; I106-N109 PolarHBondContact O-N 3.45Å; I106-I110 HydrophobicContact CD1-CD1 4.08Å; I106-I110 HydrophobicContact CD1-CG1 4.23Å; I106-I110 HydrophobicContact CG1-CD1 3.91Å; I106-I110 HydrophobicContact CG1-CG1 4.44Å; I106-I110 WeakPolarHBondContact O-CG1 3.45Å; I106-I110 PolarHBondContact O-N 3.15Å
107	I	89.5	Confident	87.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-47.7	173.2	-63.7	158.2	0	0	0	109.6	I30 M79 M83 V94 P97 S103 N109 I110 C111 Y118	I30-I107 HydrophobicContact CD1-CD1 3.64Å; I30-I107 HydrophobicContact CD1-CG1 4.03Å; M79-I107 HydrophobicContact CE-CD1 4.3Å; M79-I107 HydrophobicContact CE-CG1 3.96Å; M79-I107 HydrophobicContact CG-CD1 4.01Å; M79-I107 HydrophobicContact CG-CG1 3.66Å; M79-I107 HydrophobicContact SD-CD1 3.81Å; M79-I107 HydrophobicContact SD-CG1 3.9Å; M83-I107 HydrophobicContact CE-CG2 4.16Å; M83-I107 HydrophobicContact SD-CG1 4.34Å; M83-I107 HydrophobicContact SD-CG2 4.18Å; V94-I107 HydrophobicContact CG1-CG2 4.24Å; P97-I107 HydrophobicContact CG-CD1 4.27Å; S103-I107 VanDerWaalsContact O-CD1 3.24Å; S103-I107 WeakPolarHBondContact O-CD1 3.28Å; S103-I107 WeakPolarHBondContact O-CG1 3.46Å; S103-I107 PolarHBondContact O-N 3.45Å; S103-I107 VanDerWaalsContact O-N 3.09Å; I107-N109 VanDerWaalsContact C-N 3.33Å; I107-N109 PolarHBondContact O-N 2.88Å; I107-I110 PolarHBondContact O-N 3.42Å; I107-C111 WeakPolarHBondContact O-CB 3.42Å; I107-C111 PolarHBondContact O-N 3.26Å; I107-C111 PolarHBondContact O-SG 3.49Å; I107-Y118 HydrophobicContact CB-CE1 4.49Å; I107-Y118 HydrophobicContact CB-CE2 4.18Å; I107-Y118 HydrophobicContact CG2-CD1 4.2Å; I107-Y118 HydrophobicContact CG2-CD2 3.39Å; I107-Y118 HydrophobicContact CG2-CE1 4.19Å; I107-Y118 HydrophobicContact CG2-CE2 3.36Å; I107-Y118 HydrophobicContact CG2-CG 3.86Å
108	S	88	Confident	87.9	Confident	27 Å²	27	25.3 Å²	25.3	19%	0.189	16%	0.156	C	C	.	.	H	α-helix	trans	-54.6	-47.5	176.8	176.5	0	0	0	0	112	N104 S105 G112 T136	N104-S108 WeakPolarHBondContact O-CB 3.33Å; N104-S108 PolarHBondContact O-N 3.12Å; S105-S108 WeakPolarHBondContact O-CB 3.45Å; S108-G112 PolarHBondContact O-N 3.04Å; S108-T136 WeakPolarHBondContact OG-CG2 3.45Å
109	N	86.6	Confident	88.2	Confident	71 Å²	71	25 Å²	25	38%	0.38	15%	0.154	S	C	.	.	H	α-helix	trans	-60.7	-52.9	178.9	-172.2	15	0	0	0	112.6	S105 I106 I107 C111 G112 E113 F131	S105-N109 PolarHBondContact O-N 3Å; S105-N109 VanDerWaalsContact O-N 3.16Å; I106-N109 PolarHBondContact O-N 3.45Å; I107-N109 VanDerWaalsContact C-N 3.33Å; I107-N109 PolarHBondContact O-N 2.88Å; N109-C111 PolarHBondContact O-N 3.44Å; N109-G112 PolarHBondContact O-N 3.13Å; N109-E113 PolarHBondContact O-N 3.06Å; N109-F131 HydrophobicContact CB-CE2 4.49Å; N109-F131 VanDerWaalsContact OD1-CZ 3.29Å; N109-F131 WeakPolarHBondContact OD1-CZ 3.45Å
110	I	88.8	Confident	88.5	Confident	17 Å²	17	23 Å²	23	9%	0.087	14%	0.135	C	C	.	.	H	α-helix	trans	-66.8	-38.3	-178.2	-63.1	171.4	0	0	0	111.2	M83 M87 I106 I107 E113 K114	M83-I110 HydrophobicContact CB-CD1 3.76Å; M83-I110 HydrophobicContact CG-CB 3.97Å; M83-I110 HydrophobicContact CG-CD1 3.84Å; M83-I110 HydrophobicContact CG-CG2 3.66Å; M87-I110 HydrophobicContact CE-CG2 4.39Å; I106-I110 HydrophobicContact CD1-CD1 4.08Å; I106-I110 HydrophobicContact CD1-CG1 4.23Å; I106-I110 HydrophobicContact CG1-CD1 3.91Å; I106-I110 HydrophobicContact CG1-CG1 4.44Å; I106-I110 WeakPolarHBondContact O-CG1 3.45Å; I106-I110 PolarHBondContact O-N 3.15Å; I107-I110 PolarHBondContact O-N 3.42Å; I110-E113 PolarHBondContact O-N 3.02Å; I110-K114 HydrophobicContact CG2-CG 4.43Å; I110-K114 WeakPolarHBondContact O-CG 3.15Å; I110-K114 PolarHBondContact O-N 2.79Å
111	C	89.1	Confident	88.5	Confident	2 Å²	2	22.5 Å²	22.5	1%	0.014	13%	0.132	C	C	.	.	H	α-helix	trans	-64.2	-42.5	175.8	-72.1	0	0	0	0	112.3	M83 I107 N109 K114 E115 V116	M83-C111 WeakPolarHBondContact CE-SG 3.41Å; I107-C111 WeakPolarHBondContact O-CB 3.42Å; I107-C111 PolarHBondContact O-N 3.26Å; I107-C111 PolarHBondContact O-SG 3.49Å; N109-C111 PolarHBondContact O-N 3.44Å; C111-K114 PolarHBondContact O-N 2.9Å; C111-E115 WeakPolarHBondContact O-CA 3.34Å; C111-E115 PolarHBondContact O-N 3.17Å; C111-V116 VanDerWaalsContact CB-O 3.27Å; C111-V116 WeakPolarHBondContact CB-O 3.34Å; C111-V116 PolarHBondContact O-N 2.86Å
112	G	87.7	Confident	88.6	Confident	13 Å²	13	19.3 Å²	19.3	13%	0.134	11%	0.111	C	C	.	.	H	α-helix	trans	-62.7	-40.1	174.2	0	0	0	0	0	113	S108 N109	S108-G112 PolarHBondContact O-N 3.04Å; N109-G112 PolarHBondContact O-N 3.13Å
113	E	87.4	Confident	88.3	Confident	102 Å²	102	20.5 Å²	20.5	48%	0.477	12%	0.117	S	C	.	.	H	α-helix	trans	-69.4	-35.5	178.3	-158.6	-147.1	126.9	0	0	113	N109 I110	N109-E113 PolarHBondContact O-N 3.06Å; I110-E113 PolarHBondContact O-N 3.02Å
114	K	88.3	Confident	87.4	Confident	1 Å²	1	22.4 Å²	22.4	0%	0.004	13%	0.125	C	C	.	.	H	α-helix	trans	-95.1	-1.8	-177.3	-58.8	-45.3	-178.1	-161.9	0	114.6	M87 I110 C111 V116 L333 C335 S337 W341	M87-K114 HydrophobicContact CE-CB 4.35Å; M87-K114 HydrophobicContact SD-CB 4.06Å; M87-K114 HydrophobicContact SD-CG 4.08Å; I110-K114 HydrophobicContact CG2-CG 4.43Å; I110-K114 WeakPolarHBondContact O-CG 3.15Å; I110-K114 PolarHBondContact O-N 2.79Å; C111-K114 PolarHBondContact O-N 2.9Å; K114-V116 VanDerWaalsContact C-N 3.31Å; K114-V116 HydrophobicContact CB-CG2 4.19Å; K114-V116 PolarHBondContact O-N 3.28Å; K114-L333 HydrophobicContact CB-CD1 3.92Å; K114-C335 PolarHBondContact NZ-O 3.38Å; K114-S337 PolarHBondContact NZ-O 3.41Å; K114-W341 PolarHBondContact O-N 3.44Å
115	E	88.9	Confident	86.3	Confident	37 Å²	37	24.6 Å²	24.6	17%	0.173	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	40.6	-172.5	-57.1	-169.7	173.3	0	0	113.2	C111 F134 I340 G344 T345	C111-E115 WeakPolarHBondContact O-CA 3.34Å; C111-E115 PolarHBondContact O-N 3.17Å; E115-F134 HydrophobicContact CB-CD2 3.96Å; E115-F134 HydrophobicContact CB-CE2 3.87Å; E115-F134 HydrophobicContact CB-CZ 4.43Å; E115-F134 HydrophobicContact CG-CD2 4.15Å; E115-F134 WeakPolarHBondContact O-CZ 3.25Å; E115-I340 HydrophobicContact CB-CB 4.43Å; E115-I340 HydrophobicContact CG-CB 4.25Å; E115-I340 HydrophobicContact CG-CG2 4.17Å; E115-G344 WeakPolarHBondContact O-CA 3.48Å; E115-T345 WeakPolarHBondContact OE2-CG2 3.01Å
116	V	90.3	Very high	84.9	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.012	15%	0.147	C	C	.	.			trans	-104.1	122.1	176	175.6	0	0	0	0	109.2	M87 V91 V94 C111 K114 Y118 F134 L333 W341	M87-V116 HydrophobicContact CE-CB 3.83Å; M87-V116 HydrophobicContact CE-CG1 4.11Å; M87-V116 HydrophobicContact CE-CG2 3.8Å; M87-V116 HydrophobicContact SD-CG2 3.95Å; V91-V116 HydrophobicContact CG2-CG1 4.32Å; V94-V116 HydrophobicContact CG2-CG1 4.24Å; C111-V116 VanDerWaalsContact CB-O 3.27Å; C111-V116 WeakPolarHBondContact CB-O 3.34Å; C111-V116 PolarHBondContact O-N 2.86Å; K114-V116 VanDerWaalsContact C-N 3.31Å; K114-V116 HydrophobicContact CB-CG2 4.19Å; K114-V116 PolarHBondContact O-N 3.28Å; V116-Y118 PolarHBondContact O-N 3.4Å; V116-F134 VanDerWaalsContact C-CE1 3.44Å; V116-F134 VanDerWaalsContact O-CE1 3.31Å; V116-F134 WeakPolarHBondContact O-CE1 3.42Å; V116-L333 HydrophobicContact CG2-CD1 4.03Å; V116-W341 HydrophobicContact CG2-CB 4.44Å
117	P	91	Very high	83.2	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.			trans	-55	128.8	-177.8	-28.2	34.9	0	0	0	113.6	V92 A93 V94 F134 W341 L347 M348 L351	V92-P117 WeakPolarHBondContact O-CD 3.46Å; A93-P117 CarbonylContact C-O 3.59Å; A93-P117 VanDerWaalsContact CA-O 3.3Å; A93-P117 WeakPolarHBondContact CA-O 3.32Å; A93-P117 HydrophobicContact CB-CB 4.32Å; V94-P117 PolarHBondContact N-O 3.48Å; P117-F134 HydrophobicContact CB-CZ 4.5Å; P117-F134 HydrophobicContact CG-CZ 4.01Å; P117-W341 HydrophobicContact CG-CZ3 4.42Å; P117-L347 HydrophobicContact CG-CB 4.4Å; P117-L347 HydrophobicContact CG-CD2 4.08Å; P117-L347 HydrophobicContact CG-CG 4.21Å; P117-M348 HydrophobicContact CB-CE 3.97Å; P117-M348 HydrophobicContact CG-CE 4.34Å; P117-L351 HydrophobicContact CB-CD1 3.55Å; P117-L351 HydrophobicContact CG-CD1 3.81Å
118	Y	91.6	Very high	81.6	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.016	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.1	175.2	175.8	-132.2	0	0	0	110.2	V94 N104 I107 V116 K120 T136 L137	V94-Y118 HydrophobicContact CB-CD2 4.46Å; V94-Y118 HydrophobicContact CG1-CD2 4.5Å; V94-Y118 WeakPolarHBondContact O-CA 3.36Å; V94-Y118 WeakPolarHBondContact O-CD2 3.47Å; N104-Y118 PolarHBondContact OD1-OH 3.05Å; I107-Y118 HydrophobicContact CB-CE1 4.49Å; I107-Y118 HydrophobicContact CB-CE2 4.18Å; I107-Y118 HydrophobicContact CG2-CD1 4.2Å; I107-Y118 HydrophobicContact CG2-CD2 3.39Å; I107-Y118 HydrophobicContact CG2-CE1 4.19Å; I107-Y118 HydrophobicContact CG2-CE2 3.36Å; I107-Y118 HydrophobicContact CG2-CG 3.86Å; V116-Y118 PolarHBondContact O-N 3.4Å; Y118-K120 HydrophobicContact CE1-CB 4.15Å; Y118-T136 HydrophobicContact CD1-CG2 3.58Å; Y118-T136 HydrophobicContact CE1-CG2 4.23Å; Y118-L137 PolarHBondContact O-N 3.16Å
119	V	92.7	Very high	79.9	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.2	176.8	-172.8	0	0	0	0	109	V94 L95 G96 L137 L139 A311 V315	V94-V119 PolarHBondContact O-N 2.97Å; L95-V119 HydrophobicContact CD2-CB 3.83Å; L95-V119 HydrophobicContact CD2-CG1 4.49Å; L95-V119 HydrophobicContact CD2-CG2 4.18Å; G96-V119 PolarHBondContact N-O 3.44Å; V119-L137 CarbonylContact C-O 3.6Å; V119-L137 WeakPolarHBondContact CA-O 3.39Å; V119-L137 HydrophobicContact CG2-CB 4.4Å; V119-L137 HydrophobicContact CG2-CD1 4.33Å; V119-L139 HydrophobicContact CG1-CD1 3.46Å; V119-L139 VanDerWaalsContact CG1-CD1 3.46Å; V119-L139 HydrophobicContact CG1-CG 4.04Å; V119-A311 HydrophobicContact CG1-CB 3.93Å; V119-V315 HydrophobicContact CG2-CG2 3.9Å
120	K	89.9	Confident	78.3	Confident	11 Å²	11	46.4 Å²	46.4	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	142	-179.8	-175.3	178.1	174.4	-176.3	0	110.5	Y118 A122 P123 D125 L137 L139	Y118-K120 HydrophobicContact CE1-CB 4.15Å; K120-A122 WeakPolarHBondContact CE-O 3.31Å; K120-A122 HydrophobicContact CG-CB 4.4Å; K120-P123 WeakPolarHBondContact CE-O 3.12Å; K120-P123 PolarHBondContact NZ-O 3.39Å; K120-D125 IonicContact NZ-OD1 2.87Å; K120-D125 IonicContact NZ-OD2 2.72Å; K120-D125 PolarHBondContact NZ-OD2 3.43Å; K120-L137 PolarHBondContact N-O 2.71Å; K120-L139 PolarHBondContact O-N 2.84Å
121	V	89.6	Confident	76.7	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.006	25%	0.249	C	C	.	.			trans	-126.1	-11	175.9	-61	0	0	0	0	113.4	L139 L307 L308	V121-L139 HydrophobicContact CG1-CD1 4.41Å; V121-L307 HydrophobicContact CB-CB 3.95Å; V121-L307 HydrophobicContact CB-CD1 4.26Å; V121-L307 HydrophobicContact CG1-CB 3.74Å; V121-L308 HydrophobicContact CG1-CD2 3.99Å; V121-L308 HydrophobicContact CG1-CG 4.22Å; V121-L308 HydrophobicContact CG2-CD2 3.93Å; V121-L308 HydrophobicContact CG2-CG 4.05Å
122	A	85.4	Confident	74.9	Confident	2 Å²	2	54.8 Å²	54.8	2%	0.017	29%	0.288	C	S	.	.	S	Bend	trans	-72.6	163.9	176.4	0	0	0	0	0	112.7	P97 S98 N104 K120	P97-A122 WeakPolarHBondContact O-CB 3.44Å; S98-A122 VanDerWaalsContact O-CA 3.29Å; S98-A122 WeakPolarHBondContact O-CA 3.45Å; S98-A122 VanDerWaalsContact O-CB 3.23Å; S98-A122 WeakPolarHBondContact O-CB 3.3Å; N104-A122 WeakPolarHBondContact ND2-CB 3.34Å; K120-A122 WeakPolarHBondContact CE-O 3.31Å; K120-A122 HydrophobicContact CG-CB 4.4Å
123	P	78.8	Confident	73.3	Confident	54 Å²	54	64.4 Å²	64.4	35%	0.351	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-49.9	152.9	169.5	-26.1	35.4	0	0	0	113.7	S98 K120 D125	S98-P123 WeakPolarHBondContact O-CD 3.2Å; K120-P123 WeakPolarHBondContact CE-O 3.12Å; K120-P123 PolarHBondContact NZ-O 3.39Å; P123-D125 PolarHBondContact O-N 2.81Å
124	E	70.9	Confident	72.2	Confident	39 Å²	39	60 Å²	60	18%	0.182	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-63.7	129.1	179.1	-168.3	168.5	-164.8	0	0	111.1	K128 Q370	E124-K128 WeakPolarHBondContact OE1-CE 3.45Å; E124-K128 IonicContact OE1-NZ 3.54Å; E124-K128 PolarHBondContact OE1-NZ 3.26Å; E124-Q370 PolarHBondContact OE1-NE2 2.81Å
125	D	64.3	Low	71.4	Confident	48 Å²	48	61.5 Å²	61.5	26%	0.257	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-88.8	145.8	-177.6	-59.8	-49	0	0	0	111	P101 K120 P123 L127	P101-D125 WeakPolarHBondContact CB-OD1 3.39Å; K120-D125 IonicContact NZ-OD1 2.87Å; K120-D125 IonicContact NZ-OD2 2.72Å; K120-D125 PolarHBondContact NZ-OD2 3.43Å; P123-D125 PolarHBondContact O-N 2.81Å; D125-L127 VanDerWaalsContact C-N 3.31Å; D125-L127 PolarHBondContact O-N 2.96Å
126	I	55.8	Low	71.2	Confident	111 Å²	111	61.9 Å²	61.9	57%	0.569	31%	0.313	S	S	*	.	S	Bend	trans	-65	-33.1	-175.5	-58.1	160.4	0	0	0	112.1	K128 L173	I126-K128 PolarHBondContact O-N 3.38Å; I126-L173 HydrophobicContact CD1-CD1 3.58Å; I126-L173 HydrophobicContact CG1-CD1 3.95Å; I126-L173 HydrophobicContact CG2-CD1 4.24Å
127	L	53.8	Low	71.2	Confident	154 Å²	154	61.8 Å²	61.8	81%	0.806	31%	0.313	S	S	*	.			trans	-93	84.9	-175.1	-74.3	170.4	0	0	0	112.7	D125 V129	D125-L127 VanDerWaalsContact C-N 3.31Å; D125-L127 PolarHBondContact O-N 2.96Å; L127-V129 PolarHBondContact O-N 3.15Å
128	K	54.5	Low	71.1	Confident	124 Å²	124	62.6 Å²	62.6	54%	0.539	32%	0.317	S	S	.	.			trans	-74.4	78.7	175	-69.2	-179.2	178.5	175.1	0	112.9	E124 I126 Q130	E124-K128 WeakPolarHBondContact OE1-CE 3.45Å; E124-K128 IonicContact OE1-NZ 3.54Å; E124-K128 PolarHBondContact OE1-NZ 3.26Å; I126-K128 PolarHBondContact O-N 3.38Å; K128-Q130 VanDerWaalsContact C-N 3.26Å; K128-Q130 HydrophobicContact CB-CG 4.29Å; K128-Q130 PolarHBondContact O-N 3.26Å
129	V	52.3	Low	71	Confident	103 Å²	103	62.4 Å²	62.4	62%	0.624	32%	0.317	S	S	*	.			trans	-73.6	83.4	162.5	-174.4	0	0	0	0	108.8	L127 F131	L127-V129 PolarHBondContact O-N 3.15Å; V129-F131 HydrophobicContact CG1-CE2 3.86Å; V129-F131 HydrophobicContact CG1-CZ 3.99Å; V129-F131 PolarHBondContact O-N 3.29Å
130	Q	52.9	Low	70.9	Confident	148 Å²	148	64.2 Å²	64.2	69%	0.692	32%	0.323	S	S	*	.			trans	-75.3	111	179.5	-69.5	-176.2	-10.8	0	0	110.9	K128 P132	K128-Q130 VanDerWaalsContact C-N 3.26Å; K128-Q130 HydrophobicContact CB-CG 4.29Å; K128-Q130 PolarHBondContact O-N 3.26Å; Q130-P132 VanDerWaalsContact O-CD 3.32Å; Q130-P132 WeakPolarHBondContact O-CD 3.28Å
131	F	55.9	Low	70.9	Confident	66 Å²	66	63.9 Å²	63.9	29%	0.289	32%	0.322	S	S	.	.			trans	-79	111.9	165.5	-68.7	-81.5	0	0	0	109.4	N109 V129 R133 F134	N109-F131 HydrophobicContact CB-CE2 4.49Å; N109-F131 VanDerWaalsContact OD1-CZ 3.29Å; N109-F131 WeakPolarHBondContact OD1-CZ 3.45Å; V129-F131 HydrophobicContact CG1-CE2 3.86Å; V129-F131 HydrophobicContact CG1-CZ 3.99Å; V129-F131 PolarHBondContact O-N 3.29Å; F131-R133 PolarHBondContact O-N 3.09Å; F131-F134 PolarHBondContact O-N 3.48Å
132	P	50.8	Low	70.8	Confident	129 Å²	129	64.3 Å²	64.3	84%	0.838	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-3.3	-166.7	26.3	-34.9	0	0	0	115.3	Q130	Q130-P132 VanDerWaalsContact O-CD 3.32Å; Q130-P132 WeakPolarHBondContact O-CD 3.28Å
133	R	53.5	Low	70.9	Confident	214 Å²	214	65.3 Å²	65.3	81%	0.808	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-22.6	177.9	-69	-174	179.3	171.6	1	114.5	F131	F131-R133 PolarHBondContact O-N 3.09Å
134	F	66	Low	71.3	Confident	10 Å²	10	66.1 Å²	66.1	4%	0.044	33%	0.334	C	S	.	.	S	Bend	trans	-145	95.3	-171.3	-153.5	-88.3	0	0	0	109	E115 V116 P117 F131 T345 M348	E115-F134 HydrophobicContact CB-CD2 3.96Å; E115-F134 HydrophobicContact CB-CE2 3.87Å; E115-F134 HydrophobicContact CB-CZ 4.43Å; E115-F134 HydrophobicContact CG-CD2 4.15Å; E115-F134 WeakPolarHBondContact O-CZ 3.25Å; V116-F134 VanDerWaalsContact C-CE1 3.44Å; V116-F134 VanDerWaalsContact O-CE1 3.31Å; V116-F134 WeakPolarHBondContact O-CE1 3.42Å; P117-F134 HydrophobicContact CB-CZ 4.5Å; P117-F134 HydrophobicContact CG-CZ 4.01Å; F131-F134 PolarHBondContact O-N 3.48Å; F134-T345 HydrophobicContact CD2-CG2 4.31Å; F134-M348 HydrophobicContact CD1-CE 4.12Å; F134-M348 HydrophobicContact CD2-CB 4.5Å; F134-M348 HydrophobicContact CE1-CE 3.51Å; F134-M348 HydrophobicContact CE2-CB 3.83Å; F134-M348 HydrophobicContact CE2-CE 4.23Å; F134-M348 HydrophobicContact CE2-CG 4.27Å; F134-M348 HydrophobicContact CZ-CB 4.16Å; F134-M348 HydrophobicContact CZ-CE 3.57Å
135	T	71.3	Confident	72.2	Confident	32 Å²	32	65.7 Å²	65.7	20%	0.196	33%	0.333	C	S	.	.			trans	-88.1	152.5	-177.3	62.7	0	0	0	0	110.7	M348 R352 K368	T135-M348 WeakPolarHBondContact O-CE 3.18Å; T135-R352 PolarHBondContact OG1-NH2 2.84Å; T135-K368 WeakPolarHBondContact CB-O 3.45Å; T135-K368 PolarHBondContact OG1-O 3.01Å
136	T	85.3	Confident	73.4	Confident	45 Å²	45	64 Å²	64	28%	0.276	32%	0.324	S	S	.	.			trans	-67.6	153.4	164.2	60.3	0	0	0	0	110	S108 Y118	S108-T136 WeakPolarHBondContact OG-CG2 3.45Å; Y118-T136 HydrophobicContact CD1-CG2 3.58Å; Y118-T136 HydrophobicContact CE1-CG2 4.23Å
137	L	89.1	Confident	75	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122	172.7	-66.6	163.6	0	0	0	108.6	Y118 V119 K120 M348 L351 R352 F365 G369	Y118-L137 PolarHBondContact O-N 3.16Å; V119-L137 CarbonylContact C-O 3.6Å; V119-L137 WeakPolarHBondContact CA-O 3.39Å; V119-L137 HydrophobicContact CG2-CB 4.4Å; V119-L137 HydrophobicContact CG2-CD1 4.33Å; K120-L137 PolarHBondContact N-O 2.71Å; L137-M348 HydrophobicContact CD1-CE 4.18Å; L137-M348 HydrophobicContact CD1-SD 3.92Å; L137-M348 HydrophobicContact CD2-SD 4.1Å; L137-M348 HydrophobicContact CG-CE 4.33Å; L137-M348 HydrophobicContact CG-SD 3.97Å; L137-L351 HydrophobicContact CD1-CB 3.65Å; L137-L351 HydrophobicContact CD1-CD1 3.67Å; L137-L351 HydrophobicContact CD1-CD2 4.1Å; L137-L351 HydrophobicContact CD1-CG 4.01Å; L137-R352 HydrophobicContact CD2-CG 4.3Å; L137-F365 HydrophobicContact CB-CE1 4.17Å; L137-F365 HydrophobicContact CB-CZ 4.48Å; L137-F365 HydrophobicContact CD2-CB 4.44Å; L137-F365 HydrophobicContact CD2-CD1 4.07Å; L137-F365 HydrophobicContact CD2-CD2 4.44Å; L137-F365 HydrophobicContact CD2-CE1 4.39Å; L137-F365 HydrophobicContact CD2-CG 4.08Å; L137-G369 CarbonylContact C-O 3.28Å; L137-G369 VanDerWaalsContact CA-O 3.32Å; L137-G369 WeakPolarHBondContact CA-O 3.47Å
138	D	89.3	Confident	76.8	Confident	18 Å²	18	54.6 Å²	54.6	10%	0.096	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	117.1	-179.9	-159.3	-25.9	0	0	0	110.1	R140 G369 R371	D138-R140 WeakPolarHBondContact OD1-CB 3.4Å; D138-R140 PolarHBondContact OD1-N 3.41Å; D138-G369 PolarHBondContact N-O 3.11Å; D138-R371 PolarHBondContact O-N 3.4Å; D138-R371 VanDerWaalsContact O-N 3.08Å
139	L	90.3	Very high	78.5	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.249	C	C	.	.			trans	-86	-12.7	179.2	-81.5	165.5	0	0	0	113.4	V119 K120 V121 L307 A311 I363 F365 R371	V119-L139 HydrophobicContact CG1-CD1 3.46Å; V119-L139 VanDerWaalsContact CG1-CD1 3.46Å; V119-L139 HydrophobicContact CG1-CG 4.04Å; K120-L139 PolarHBondContact O-N 2.84Å; V121-L139 HydrophobicContact CG1-CD1 4.41Å; L139-L307 HydrophobicContact CB-CD2 4.11Å; L139-L307 WeakPolarHBondContact O-CD2 3.37Å; L139-A311 HydrophobicContact CD1-CB 3.41Å; L139-A311 VanDerWaalsContact CD1-CB 3.41Å; L139-I363 HydrophobicContact CD2-CD1 4.18Å; L139-I363 HydrophobicContact CD2-CG1 4.38Å; L139-I363 HydrophobicContact CD2-CG2 3.77Å; L139-F365 HydrophobicContact CD2-CE1 4.01Å; L139-F365 HydrophobicContact CD2-CZ 3.54Å; L139-F365 HydrophobicContact CG-CE1 4.22Å; L139-F365 HydrophobicContact CG-CZ 4Å; L139-R371 WeakPolarHBondContact O-CD 3.32Å; L139-R371 PolarHBondContact O-NH1 2.81Å; L139-R371 VanDerWaalsContact O-NH1 3.09Å
140	R	89.7	Confident	80.4	Confident	39 Å²	39	43.8 Å²	43.8	15%	0.147	22%	0.22	C	C	.	.	S	Bend	trans	-80.2	141.6	-179.8	-163	176.5	-179.5	115.4	-1.2	109.6	D138 L248 L307	D138-R140 WeakPolarHBondContact OD1-CB 3.4Å; D138-R140 PolarHBondContact OD1-N 3.41Å; R140-L248 HydrophobicContact CG-CD1 4.4Å; R140-L307 HydrophobicContact CB-CD1 4.39Å; R140-L307 HydrophobicContact CG-CD1 4.45Å
141	P	89.8	Confident	82.1	Confident	4 Å²	4	37 Å²	37	3%	0.026	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-48.7	142.6	165.8	-33.6	40.2	0	0	0	112.6	L248 V270 Y374 L376	P141-L248 HydrophobicContact CB-CD1 3.99Å; P141-L248 HydrophobicContact CG-CD1 3.78Å; P141-V270 HydrophobicContact CG-CG1 4.18Å; P141-V270 HydrophobicContact CG-CG2 3.88Å; P141-Y374 WeakPolarHBondContact CA-OH 3.32Å; P141-Y374 HydrophobicContact CB-CD2 4.42Å; P141-Y374 HydrophobicContact CB-CE2 3.49Å; P141-Y374 VanDerWaalsContact CB-CE2 3.49Å; P141-Y374 WeakPolarHBondContact CB-OH 3.16Å; P141-Y374 HydrophobicContact CG-CD2 4.14Å; P141-Y374 HydrophobicContact CG-CE2 3.68Å; P141-L376 HydrophobicContact CB-CD2 4.22Å; P141-L376 HydrophobicContact CG-CD2 3.99Å
142	T	88.1	Confident	83.6	Confident	11 Å²	11	34.5 Å²	34.5	7%	0.067	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-73.2	146.6	-178.8	79.6	0	0	0	0	111.1	T144 D145 I146 Q370 Y374	T142-T144 PolarHBondContact O-N 3.23Å; T142-T144 PolarHBondContact OG1-OG1 2.79Å; T142-D145 PolarHBondContact O-N 2.84Å; T142-D145 VanDerWaalsContact O-N 3.11Å; T142-D145 WeakPolarHBondContact OG1-CB 3.03Å; T142-D145 PolarHBondContact OG1-N 2.97Å; T142-D145 VanDerWaalsContact OG1-N 3.16Å; T142-D145 PolarHBondContact OG1-OD2 2.91Å; T142-I146 PolarHBondContact O-N 3.48Å; T142-Q370 HydrophobicContact CG2-CB 4.23Å; T142-Y374 PolarHBondContact N-OH 2.99Å; T142-Y374 VanDerWaalsContact N-OH 3.14Å
143	N	87	Confident	85.4	Confident	22 Å²	22	28.3 Å²	28.3	12%	0.118	14%	0.142	C	C	.	.	H	α-helix	trans	-63.4	-30.9	177.6	-72.4	-12.9	0	0	0	111.7	D145 I146 S147 N174	N143-D145 PolarHBondContact O-N 2.69Å; N143-I146 PolarHBondContact O-N 3.3Å; N143-S147 PolarHBondContact O-N 3.36Å; N143-N174 HydrophobicContact CB-CB 4.48Å; N143-N174 WeakPolarHBondContact CB-O 3.3Å; N143-N174 PolarHBondContact ND2-OD1 3.47Å
144	T	87	Confident	87.1	Confident	72 Å²	72	18.2 Å²	18.2	44%	0.442	10%	0.104	S	C	.	.	H	α-helix	trans	-60.7	-41.9	172.4	38.2	0	0	0	0	112.8	T142 S147 L148	T142-T144 PolarHBondContact O-N 3.23Å; T142-T144 PolarHBondContact OG1-OG1 2.79Å; T144-S147 PolarHBondContact O-N 3.02Å; T144-S147 PolarHBondContact O-OG 3.27Å; T144-L148 WeakPolarHBondContact O-CG 3.36Å; T144-L148 PolarHBondContact O-N 3.24Å; T144-L148 VanDerWaalsContact O-N 3.12Å
145	D	89.3	Confident	88	Confident	29 Å²	29	21.7 Å²	21.7	16%	0.155	13%	0.126	C	C	.	.	H	α-helix	trans	-69.9	-40.3	179.9	-65.4	-32	0	0	0	111.5	T142 N143 S147 L148 A149 Y374 W392	T142-D145 PolarHBondContact O-N 2.84Å; T142-D145 VanDerWaalsContact O-N 3.11Å; T142-D145 WeakPolarHBondContact OG1-CB 3.03Å; T142-D145 PolarHBondContact OG1-N 2.97Å; T142-D145 VanDerWaalsContact OG1-N 3.16Å; T142-D145 PolarHBondContact OG1-OD2 2.91Å; N143-D145 PolarHBondContact O-N 2.69Å; D145-S147 VanDerWaalsContact C-N 3.29Å; D145-S147 PolarHBondContact O-N 2.87Å; D145-L148 PolarHBondContact O-N 2.96Å; D145-A149 WeakPolarHBondContact O-CB 3.48Å; D145-A149 PolarHBondContact O-N 2.85Å; D145-Y374 WeakPolarHBondContact CB-OH 3.48Å; D145-Y374 VanDerWaalsContact CG-OH 3.22Å; D145-Y374 PolarHBondContact OD2-OH 3.31Å; D145-W392 HydrophobicContact CB-CH2 3.53Å; D145-W392 HydrophobicContact CB-CZ3 3.78Å
146	I	89.6	Confident	88.6	Confident	13 Å²	13	24.7 Å²	24.7	7%	0.067	14%	0.136	C	C	.	.	H	α-helix	trans	-58.5	-43.7	173	-61.9	170.6	0	0	0	110.3	T142 N143 L148 A149 V150 L248 L376	T142-I146 PolarHBondContact O-N 3.48Å; N143-I146 PolarHBondContact O-N 3.3Å; I146-L148 VanDerWaalsContact C-N 3.33Å; I146-L148 PolarHBondContact O-N 3.38Å; I146-A149 PolarHBondContact O-N 2.79Å; I146-V150 WeakPolarHBondContact O-CG2 3.45Å; I146-V150 PolarHBondContact O-N 2.96Å; I146-L248 HydrophobicContact CD1-CD1 4.09Å; I146-L248 HydrophobicContact CD1-CD2 4.1Å; I146-L248 HydrophobicContact CD1-CG 4.05Å; I146-L248 HydrophobicContact CG1-CD2 4.29Å; I146-L376 HydrophobicContact CG1-CD1 4.45Å
147	S	90.4	Very high	88.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-37.7	178.7	84.5	0	0	0	0	112.8	N143 T144 D145 A151 Q177	N143-S147 PolarHBondContact O-N 3.36Å; T144-S147 PolarHBondContact O-N 3.02Å; T144-S147 PolarHBondContact O-OG 3.27Å; D145-S147 VanDerWaalsContact C-N 3.29Å; D145-S147 PolarHBondContact O-N 2.87Å; S147-A151 WeakPolarHBondContact O-CB 3.48Å; S147-A151 PolarHBondContact O-N 3.14Å; S147-Q177 WeakPolarHBondContact OG-CB 3.31Å
148	L	90.1	Very high	88	Confident	67 Å²	67	31.3 Å²	31.3	35%	0.351	17%	0.168	S	C	.	.	H	α-helix	trans	-73.2	-34.5	175.9	-68.5	173.1	0	0	0	112.1	T144 D145 I146 A151 G152 Q177 W392	T144-L148 WeakPolarHBondContact O-CG 3.36Å; T144-L148 PolarHBondContact O-N 3.24Å; T144-L148 VanDerWaalsContact O-N 3.12Å; D145-L148 PolarHBondContact O-N 2.96Å; I146-L148 VanDerWaalsContact C-N 3.33Å; I146-L148 PolarHBondContact O-N 3.38Å; L148-A151 PolarHBondContact O-N 3.4Å; L148-G152 PolarHBondContact O-N 3.26Å; L148-Q177 HydrophobicContact CD2-CG 4.24Å; L148-W392 HydrophobicContact CB-CZ2 3.91Å
149	A	91.1	Very high	87.5	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.6	-41.2	173.6	0	0	0	0	0	111.9	D145 I146 G152 L153 F268 L376 W392	D145-A149 WeakPolarHBondContact O-CB 3.48Å; D145-A149 PolarHBondContact O-N 2.85Å; I146-A149 PolarHBondContact O-N 2.79Å; A149-G152 PolarHBondContact O-N 3.27Å; A149-L153 PolarHBondContact O-N 3.41Å; A149-F268 HydrophobicContact CB-CD1 4.47Å; A149-F268 HydrophobicContact CB-CE1 3.71Å; A149-F268 HydrophobicContact CB-CZ 4.01Å; A149-L376 HydrophobicContact CB-CD1 4.11Å; A149-W392 HydrophobicContact CB-CB 4.28Å; A149-W392 HydrophobicContact CB-CD2 3.73Å; A149-W392 HydrophobicContact CB-CE3 4.29Å; A149-W392 HydrophobicContact CB-CG 3.71Å
150	V	91.6	Very high	86.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-47.3	172	174	0	0	0	0	110.8	I146 G152 L153 L154 L178 I216 T246 F268	I146-V150 WeakPolarHBondContact O-CG2 3.45Å; I146-V150 PolarHBondContact O-N 2.96Å; V150-G152 VanDerWaalsContact C-N 3.29Å; V150-G152 PolarHBondContact O-N 3.14Å; V150-L153 WeakPolarHBondContact O-CB 3.27Å; V150-L153 PolarHBondContact O-N 2.85Å; V150-L153 VanDerWaalsContact O-N 3.08Å; V150-L154 HydrophobicContact CG1-CD1 4.11Å; V150-L154 HydrophobicContact CG1-CG 4.46Å; V150-L154 WeakPolarHBondContact O-CG 3.46Å; V150-L154 PolarHBondContact O-N 2.96Å; V150-L178 HydrophobicContact CB-CD1 4.44Å; V150-L178 HydrophobicContact CB-CD2 4.41Å; V150-L178 HydrophobicContact CG1-CD1 4.08Å; V150-L178 HydrophobicContact CG1-CD2 3.76Å; V150-I216 HydrophobicContact CG1-CD1 4.09Å; V150-I216 HydrophobicContact CG1-CG2 4.27Å; V150-T246 HydrophobicContact CG2-CG2 4.1Å; V150-F268 HydrophobicContact CG2-CE2 3.59Å; V150-F268 HydrophobicContact CG2-CZ 3.8Å
151	A	89.2	Confident	86.6	Confident	5 Å²	5	35.6 Å²	35.6	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-40.6	176.3	0	0	0	0	0	112.4	S147 L148 L153 L154 T155 L178	S147-A151 WeakPolarHBondContact O-CB 3.48Å; S147-A151 PolarHBondContact O-N 3.14Å; L148-A151 PolarHBondContact O-N 3.4Å; A151-L153 PolarHBondContact O-N 3.02Å; A151-L154 PolarHBondContact O-N 3.22Å; A151-T155 PolarHBondContact O-N 3Å; A151-T155 PolarHBondContact O-OG1 2.77Å; A151-L178 HydrophobicContact CB-CD1 3.76Å
152	G	87.6	Confident	86.6	Confident	14 Å²	14	35.5 Å²	35.5	14%	0.144	20%	0.202	C	C	.	.	H	α-helix	trans	-58.2	-44.7	172.4	0	0	0	0	0	112.5	L148 A149 V150 T155 F156 L398	L148-G152 PolarHBondContact O-N 3.26Å; A149-G152 PolarHBondContact O-N 3.27Å; V150-G152 VanDerWaalsContact C-N 3.29Å; V150-G152 PolarHBondContact O-N 3.14Å; G152-T155 PolarHBondContact O-N 3.11Å; G152-T155 PolarHBondContact O-OG1 3.47Å; G152-F156 WeakPolarHBondContact O-CB 3.39Å; G152-F156 PolarHBondContact O-N 2.91Å; G152-L398 VanDerWaalsContact C-CD2 3.46Å; G152-L398 WeakPolarHBondContact O-CD2 3.01Å
153	L	88.8	Confident	86.8	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-40.3	176.1	-79	179.7	0	0	0	113	A149 V150 A151 F156 F157 I244 V266 F268 I378 L398 M400	A149-L153 PolarHBondContact O-N 3.41Å; V150-L153 WeakPolarHBondContact O-CB 3.27Å; V150-L153 PolarHBondContact O-N 2.85Å; V150-L153 VanDerWaalsContact O-N 3.08Å; A151-L153 PolarHBondContact O-N 3.02Å; L153-F156 PolarHBondContact O-N 3.46Å; L153-F157 HydrophobicContact CB-CD2 4.48Å; L153-F157 HydrophobicContact CB-CE2 4.44Å; L153-F157 HydrophobicContact CD2-CE2 4.07Å; L153-F157 WeakPolarHBondContact O-CD2 3.41Å; L153-F157 PolarHBondContact O-N 2.81Å; L153-I244 HydrophobicContact CB-CD1 4.27Å; L153-I244 HydrophobicContact CD1-CG2 4.15Å; L153-V266 HydrophobicContact CD1-CG1 3.92Å; L153-F268 HydrophobicContact CD1-CE1 3.96Å; L153-F268 HydrophobicContact CD1-CZ 3.67Å; L153-I378 HydrophobicContact CD1-CG2 4.34Å; L153-I378 HydrophobicContact CD2-CD1 4.02Å; L153-I378 HydrophobicContact CD2-CG2 4.27Å; L153-I378 HydrophobicContact CG-CD1 4.35Å; L153-L398 HydrophobicContact CD2-CD2 4.35Å; L153-M400 HydrophobicContact CD2-CE 3.71Å; L153-M400 HydrophobicContact CD2-SD 4.45Å
154	L	88.3	Confident	87.1	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-40.4	179	-63.9	171.7	0	0	0	111.8	V150 A151 F157 N158 S159 L178 F182 T214 I216 I244	V150-L154 HydrophobicContact CG1-CD1 4.11Å; V150-L154 HydrophobicContact CG1-CG 4.46Å; V150-L154 WeakPolarHBondContact O-CG 3.46Å; V150-L154 PolarHBondContact O-N 2.96Å; A151-L154 PolarHBondContact O-N 3.22Å; L154-F157 PolarHBondContact O-N 3.35Å; L154-N158 PolarHBondContact O-N 2.84Å; L154-S159 PolarHBondContact O-N 3.38Å; L154-S159 VanDerWaalsContact O-N 3.13Å; L154-L178 HydrophobicContact CD1-CD1 4.14Å; L154-F182 HydrophobicContact CD1-CE2 3.75Å; L154-F182 HydrophobicContact CD1-CZ 3.61Å; L154-T214 HydrophobicContact CD2-CG2 3.6Å; L154-I216 HydrophobicContact CD1-CD1 3.73Å; L154-I216 HydrophobicContact CD2-CD1 4.18Å; L154-I216 HydrophobicContact CD2-CG1 4.43Å; L154-I216 HydrophobicContact CG-CD1 4.49Å; L154-I244 HydrophobicContact CD2-CD1 3.79Å
155	T	85.5	Confident	87.4	Confident	82 Å²	82	30.6 Å²	30.6	50%	0.503	17%	0.173	S	C	.	.	H	α-helix	trans	-68.2	-35.7	173.3	57.7	0	0	0	0	112.5	A151 G152 N158	A151-T155 PolarHBondContact O-N 3Å; A151-T155 PolarHBondContact O-OG1 2.77Å; G152-T155 PolarHBondContact O-N 3.11Å; G152-T155 PolarHBondContact O-OG1 3.47Å; T155-N158 PolarHBondContact O-N 3.14Å
156	F	84	Confident	87.5	Confident	95 Å²	95	29.2 Å²	29.2	42%	0.417	17%	0.165	S	C	.	.	H	α-helix	trans	-65.2	-41	174.1	178.2	-97.3	0	0	0	113	G152 L153 N158 L398 M400 L404	G152-F156 WeakPolarHBondContact O-CB 3.39Å; G152-F156 PolarHBondContact O-N 2.91Å; L153-F156 PolarHBondContact O-N 3.46Å; F156-N158 VanDerWaalsContact C-N 3.27Å; F156-N158 PolarHBondContact O-N 3.04Å; F156-L398 HydrophobicContact CB-CD2 3.93Å; F156-L398 HydrophobicContact CG-CD2 4.49Å; F156-M400 HydrophobicContact CD1-CE 3.72Å; F156-M400 HydrophobicContact CD1-CG 4.44Å; F156-M400 HydrophobicContact CD2-CB 4.36Å; F156-M400 HydrophobicContact CD2-CG 3.81Å; F156-M400 HydrophobicContact CE1-CE 3.62Å; F156-M400 HydrophobicContact CE1-CG 4.39Å; F156-M400 HydrophobicContact CE2-CB 3.86Å; F156-M400 HydrophobicContact CE2-CG 3.75Å; F156-M400 HydrophobicContact CG-CE 4.28Å; F156-M400 HydrophobicContact CG-CG 4.17Å; F156-M400 HydrophobicContact CZ-CB 4.17Å; F156-M400 HydrophobicContact CZ-CE 4.12Å; F156-M400 HydrophobicContact CZ-CG 4.05Å; F156-L404 HydrophobicContact CE1-CD1 4.34Å; F156-L404 HydrophobicContact CZ-CD1 4.02Å
157	F	80.6	Confident	87.4	Confident	54 Å²	54	29.9 Å²	29.9	24%	0.237	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-3.3	175.6	-67.8	-57.6	0	0	0	113.9	L153 L154 S159 T242 I244 N264 V266	L153-F157 HydrophobicContact CB-CD2 4.48Å; L153-F157 HydrophobicContact CB-CE2 4.44Å; L153-F157 HydrophobicContact CD2-CE2 4.07Å; L153-F157 WeakPolarHBondContact O-CD2 3.41Å; L153-F157 PolarHBondContact O-N 2.81Å; L154-F157 PolarHBondContact O-N 3.35Å; F157-S159 VanDerWaalsContact C-N 3.26Å; F157-S159 PolarHBondContact O-N 3.4Å; F157-T242 HydrophobicContact CD2-CG2 4.39Å; F157-T242 HydrophobicContact CE2-CG2 4.32Å; F157-I244 HydrophobicContact CD2-CD1 4.45Å; F157-N264 WeakPolarHBondContact CE1-ND2 3.44Å; F157-N264 WeakPolarHBondContact CZ-ND2 3.09Å; F157-V266 HydrophobicContact CE2-CG2 4.48Å; F157-V266 HydrophobicContact CZ-CG2 4.27Å
158	N	80.9	Confident	87.1	Confident	131 Å²	131	36.3 Å²	36.3	70%	0.701	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	40.6	-178.3	-164.2	26.1	0	0	0	112.7	L154 T155 F156 T160	L154-N158 PolarHBondContact O-N 2.84Å; T155-N158 PolarHBondContact O-N 3.14Å; F156-N158 VanDerWaalsContact C-N 3.27Å; F156-N158 PolarHBondContact O-N 3.04Å; N158-T160 PolarHBondContact O-N 3.12Å
159	S	78.6	Confident	86.7	Confident	13 Å²	13	35.8 Å²	35.8	9%	0.091	21%	0.209	C	C	.	.			trans	-80	102.3	-173.5	-67.2	0	0	0	0	112.1	L154 F157 T214	L154-S159 PolarHBondContact O-N 3.38Å; L154-S159 VanDerWaalsContact O-N 3.13Å; F157-S159 VanDerWaalsContact C-N 3.26Å; F157-S159 PolarHBondContact O-N 3.4Å; S159-T214 WeakPolarHBondContact CB-OG1 3.17Å; S159-T214 PolarHBondContact OG-OG1 3.13Å
160	T	77.4	Confident	86.2	Confident	101 Å²	101	39.4 Å²	39.4	62%	0.62	23%	0.228	S	C	*	.	S	Bend	trans	-74.6	-25.2	-178.7	54.4	0	0	0	0	115	N158 E187 T188	N158-T160 PolarHBondContact O-N 3.12Å; T160-E187 WeakPolarHBondContact O-CA 3.35Å; T160-T188 PolarHBondContact O-N 3.2Å
161	A	84.4	Confident	85.9	Confident	33 Å²	33	39.4 Å²	39.4	27%	0.273	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	123.2	178.8	0	0	0	0	0	109.9	T188	A161-T188 WeakPolarHBondContact CA-O 3.42Å; A161-T188 WeakPolarHBondContact CB-OG1 3.44Å
162	S	89.7	Confident	85.6	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.007	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.9	-176.8	-60.7	0	0	0	0	111.5	T188 L189 S190 T214	S162-T188 PolarHBondContact N-O 2.73Å; S162-L189 WeakPolarHBondContact O-CA 3.3Å; S162-S190 PolarHBondContact O-N 3.26Å; S162-S190 PolarHBondContact O-OG 2.97Å; S162-T214 CarbonylContact C-O 3.54Å; S162-T214 WeakPolarHBondContact CA-O 3.38Å
163	C	92.3	Very high	85.3	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128	173.6	-169.6	0	0	0	0	110.6	S190 T214 I215 I216	C163-S190 CarbonylContact C-O 3.58Å; C163-S190 WeakPolarHBondContact CA-O 3.42Å; C163-S190 WeakPolarHBondContact CA-OG 3.35Å; C163-S190 WeakPolarHBondContact CB-OG 3.4Å; C163-S190 PolarHBondContact SG-OG 3.37Å; C163-T214 PolarHBondContact N-O 2.91Å; C163-I215 CarbonylContact O-C 3.54Å; C163-I215 WeakPolarHBondContact O-CA 3.38Å; C163-I216 PolarHBondContact O-N 2.8Å
164	L	92.8	Very high	85	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.2	172.1	174.1	62.4	0	0	0	109.9	L175 L179 L189 S190 V191 R192 I216 D218	L164-L175 HydrophobicContact CD1-CD1 3.69Å; L164-L175 HydrophobicContact CD2-CD1 3.97Å; L164-L175 HydrophobicContact CG-CD1 4.49Å; L164-L179 HydrophobicContact CD2-CD2 4.21Å; L164-L189 HydrophobicContact CB-CD1 4.15Å; L164-S190 PolarHBondContact N-O 3.42Å; L164-V191 HydrophobicContact CB-CG1 4.35Å; L164-V191 HydrophobicContact CB-CG2 4.37Å; L164-V191 HydrophobicContact CD2-CG1 4.04Å; L164-V191 HydrophobicContact CD2-CG2 4.4Å; L164-V191 HydrophobicContact CG-CG1 4.28Å; L164-R192 PolarHBondContact O-N 2.83Å; L164-I216 HydrophobicContact CD1-CB 3.95Å; L164-I216 HydrophobicContact CD1-CG2 3.73Å; L164-D218 HydrophobicContact CD1-CB 4.48Å
165	I	93.3	Very high	84.9	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	113.7	170.8	-56.3	178.8	0	0	0	108.4	R192 L194 L203 L204 I207 I215 I216 V217 D218 I227	I165-R192 WeakPolarHBondContact CA-O 3.28Å; I165-L194 HydrophobicContact CG2-CG 4.49Å; I165-L203 HydrophobicContact CG2-CD2 4.07Å; I165-L204 HydrophobicContact CD1-CD2 4.33Å; I165-I207 HydrophobicContact CD1-CD1 3.54Å; I165-I207 HydrophobicContact CG1-CD1 3.75Å; I165-I215 HydrophobicContact CD1-CG2 3.6Å; I165-I215 HydrophobicContact CG1-CG2 4.03Å; I165-I216 PolarHBondContact N-O 2.81Å; I165-V217 HydrophobicContact CD1-CG2 4.44Å; I165-D218 PolarHBondContact O-N 3.09Å; I165-I227 HydrophobicContact CG2-CD1 4.31Å
166	C	91.3	Very high	84.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.1	173.5	-68.5	0	0	0	0	110.3	C171 R192 M193 L194	C166-C171 VanDerWaalsContact CA-SG 3.5Å; C166-C171 HydrophobicContact CB-CB 3.37Å; C166-C171 WeakPolarHBondContact CB-SG 3.37Å; C166-C171 WeakPolarHBondContact SG-CB 3.1Å; C166-C171 CovalentContact SG-SG 2.04Å; C166-C171 PolarHBondContact SG-SG 2.67Å; C166-R192 PolarHBondContact N-O 3.24Å; C166-M193 WeakPolarHBondContact O-CA 3.13Å; C166-L194 PolarHBondContact O-N 3.09Å
167	A	87.6	Confident	85	Confident	28 Å²	28	47.6 Å²	47.6	23%	0.231	26%	0.263	C	S	.	.	S	Bend	trans	-78.2	-21.7	174.7	0	0	0	0	0	113.8	L194 D218 A219 M223	A167-L194 HydrophobicContact CB-CD1 4.08Å; A167-D218 WeakPolarHBondContact CB-O 3.5Å; A167-D218 PolarHBondContact N-O 2.93Å; A167-A219 HydrophobicContact CB-CB 3.72Å; A167-M223 HydrophobicContact CB-CG 4.12Å
168	Q	84.3	Confident	85.3	Confident	135 Å²	135	45 Å²	45	63%	0.631	25%	0.252	S	S	*	.	S	Bend	trans	-139.5	158.6	175.9	-69.8	-179.3	-28.4	0	0	109.4	D170 C171	Q168-D170 PolarHBondContact O-N 3.13Å; Q168-C171 WeakPolarHBondContact O-CB 3.38Å; Q168-C171 PolarHBondContact O-N 2.84Å
169	A	81.6	Confident	85.6	Confident	56 Å²	56	40.7 Å²	40.7	46%	0.463	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.7	-179	0	0	0	0	0	113.5	C171 L172 M193	A169-C171 PolarHBondContact O-N 3.37Å; A169-C171 VanDerWaalsContact O-N 3.16Å; A169-L172 PolarHBondContact O-N 3.26Å; A169-L172 VanDerWaalsContact O-N 3.17Å; A169-M193 HydrophobicContact CB-CE 4.17Å; A169-M193 HydrophobicContact CB-SD 4.38Å
170	D	80.4	Confident	85.9	Confident	75 Å²	75	46.2 Å²	46.2	40%	0.401	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.1	-177.4	-57.6	-27.9	0	0	0	113.4	Q168 L172 L173 N174	Q168-D170 PolarHBondContact O-N 3.13Å; D170-L172 PolarHBondContact O-N 2.87Å; D170-L173 PolarHBondContact O-N 2.88Å; D170-N174 VanDerWaalsContact O-CG 3.29Å; D170-N174 PolarHBondContact O-N 3.45Å; D170-N174 PolarHBondContact O-ND2 3.42Å
171	C	84.9	Confident	86.1	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-45.6	-43.2	170.4	167.4	0	0	0	0	113.3	C166 Q168 A169 L173 N174 L175 D218	C166-C171 VanDerWaalsContact CA-SG 3.5Å; C166-C171 HydrophobicContact CB-CB 3.37Å; C166-C171 WeakPolarHBondContact CB-SG 3.37Å; C166-C171 WeakPolarHBondContact SG-CB 3.1Å; C166-C171 CovalentContact SG-SG 2.04Å; C166-C171 PolarHBondContact SG-SG 2.67Å; Q168-C171 WeakPolarHBondContact O-CB 3.38Å; Q168-C171 PolarHBondContact O-N 2.84Å; A169-C171 PolarHBondContact O-N 3.37Å; A169-C171 VanDerWaalsContact O-N 3.16Å; C171-L173 VanDerWaalsContact C-N 3.27Å; C171-L173 PolarHBondContact O-N 3.46Å; C171-N174 PolarHBondContact O-N 2.93Å; C171-L175 WeakPolarHBondContact O-CB 3.15Å; C171-L175 PolarHBondContact O-N 3.28Å; C171-D218 WeakPolarHBondContact CA-OD2 3.17Å; C171-D218 HydrophobicContact CB-CB 4.17Å; C171-D218 VanDerWaalsContact CB-OD2 3.22Å; C171-D218 WeakPolarHBondContact CB-OD2 3.41Å; C171-D218 VanDerWaalsContact SG-CB 3.51Å
172	L	83.5	Confident	85.9	Confident	64 Å²	64	44.1 Å²	44.1	34%	0.335	22%	0.224	S	C	.	.	H	α-helix	trans	-64.1	-32.5	-179.3	-69.3	169.5	0	0	0	112.6	A169 D170 E176 L179 V191 M193	A169-L172 PolarHBondContact O-N 3.26Å; A169-L172 VanDerWaalsContact O-N 3.17Å; D170-L172 PolarHBondContact O-N 2.87Å; L172-E176 PolarHBondContact O-N 3.22Å; L172-L179 HydrophobicContact CD2-CD1 4.04Å; L172-L179 WeakPolarHBondContact O-CD1 3.32Å; L172-V191 HydrophobicContact CD2-CG1 3.65Å; L172-M193 HydrophobicContact CD1-CE 3.99Å
173	L	81.1	Confident	85.2	Confident	94 Å²	94	51.2 Å²	51.2	49%	0.492	26%	0.261	S	S	.	.	H	α-helix	trans	-84.1	-40.8	179.4	-59.9	174.5	0	0	0	110.6	I126 D170 C171 L175 E176	I126-L173 HydrophobicContact CD1-CD1 3.58Å; I126-L173 HydrophobicContact CG1-CD1 3.95Å; I126-L173 HydrophobicContact CG2-CD1 4.24Å; D170-L173 PolarHBondContact O-N 2.88Å; C171-L173 VanDerWaalsContact C-N 3.27Å; C171-L173 PolarHBondContact O-N 3.46Å; L173-L175 PolarHBondContact O-N 2.88Å; L173-E176 WeakPolarHBondContact O-CB 3.39Å; L173-E176 PolarHBondContact O-N 2.83Å
174	N	82	Confident	84.3	Confident	42 Å²	42	58.4 Å²	58.4	23%	0.225	30%	0.298	C	S	.	.	H	α-helix	trans	-59.8	-36.5	175.5	-65	-22.7	0	0	0	111.9	N143 D170 C171	N143-N174 HydrophobicContact CB-CB 4.48Å; N143-N174 WeakPolarHBondContact CB-O 3.3Å; N143-N174 PolarHBondContact ND2-OD1 3.47Å; D170-N174 VanDerWaalsContact O-CG 3.29Å; D170-N174 PolarHBondContact O-N 3.45Å; D170-N174 PolarHBondContact O-ND2 3.42Å; C171-N174 PolarHBondContact O-N 2.93Å
175	L	85.9	Confident	83.3	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.016	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	20.2	-178	-60	171.9	0	0	0	113.3	L164 C171 L173 Q177 L178 L179 D218 T246	L164-L175 HydrophobicContact CD1-CD1 3.69Å; L164-L175 HydrophobicContact CD2-CD1 3.97Å; L164-L175 HydrophobicContact CG-CD1 4.49Å; C171-L175 WeakPolarHBondContact O-CB 3.15Å; C171-L175 PolarHBondContact O-N 3.28Å; L173-L175 PolarHBondContact O-N 2.88Å; L175-Q177 PolarHBondContact O-N 3Å; L175-Q177 VanDerWaalsContact O-N 3.13Å; L175-L178 HydrophobicContact CB-CB 4.38Å; L175-L178 WeakPolarHBondContact O-CB 3.44Å; L175-L178 PolarHBondContact O-N 2.96Å; L175-L179 PolarHBondContact O-N 2.86Å; L175-L179 VanDerWaalsContact O-N 3.07Å; L175-D218 HydrophobicContact CD1-CB 4.21Å; L175-T246 HydrophobicContact CD1-CG2 4.12Å; L175-T246 HydrophobicContact CD2-CG2 4.28Å
176	E	86.4	Confident	82.3	Confident	90 Å²	90	70.5 Å²	70.5	42%	0.421	36%	0.356	S	S	.	.	H	α-helix	trans	-50.5	-43.9	-176.3	-170	-163	173.4	0	0	112.7	L172 L173 L178 L179 R180	L172-E176 PolarHBondContact O-N 3.22Å; L173-E176 WeakPolarHBondContact O-CB 3.39Å; L173-E176 PolarHBondContact O-N 2.83Å; E176-L178 PolarHBondContact O-N 3.44Å; E176-L179 WeakPolarHBondContact O-CB 3.47Å; E176-L179 PolarHBondContact O-N 2.93Å; E176-R180 WeakPolarHBondContact O-CG 3.29Å; E176-R180 PolarHBondContact O-N 3.25Å; E176-R180 IonicContact OE1-CZ 2.74Å; E176-R180 IonicContact OE1-NE 2.66Å; E176-R180 PolarHBondContact OE1-NE 3.14Å; E176-R180 IonicContact OE1-NH2 3.35Å; E176-R180 PolarHBondContact OE1-NH2 3.36Å
177	Q	85.8	Confident	81.8	Confident	77 Å²	77	73.8 Å²	73.8	36%	0.36	37%	0.371	S	S	.	.	H	α-helix	trans	-71.3	-28.7	-177	178.1	67.3	13.8	0	0	112.7	S147 L148 L175 Q181	S147-Q177 WeakPolarHBondContact OG-CB 3.31Å; L148-Q177 HydrophobicContact CD2-CG 4.24Å; L175-Q177 PolarHBondContact O-N 3Å; L175-Q177 VanDerWaalsContact O-N 3.13Å; Q177-Q181 PolarHBondContact O-N 3.27Å
178	L	87.2	Confident	81.5	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-66.8	-48.3	168.7	-179.5	71.1	0	0	0	110.2	V150 A151 L154 L175 E176 R180 Q181 F182 I216	V150-L178 HydrophobicContact CB-CD1 4.44Å; V150-L178 HydrophobicContact CB-CD2 4.41Å; V150-L178 HydrophobicContact CG1-CD1 4.08Å; V150-L178 HydrophobicContact CG1-CD2 3.76Å; A151-L178 HydrophobicContact CB-CD1 3.76Å; L154-L178 HydrophobicContact CD1-CD1 4.14Å; L175-L178 HydrophobicContact CB-CB 4.38Å; L175-L178 WeakPolarHBondContact O-CB 3.44Å; L175-L178 PolarHBondContact O-N 2.96Å; E176-L178 PolarHBondContact O-N 3.44Å; L178-R180 VanDerWaalsContact C-N 3.3Å; L178-R180 PolarHBondContact O-N 3.41Å; L178-Q181 WeakPolarHBondContact O-CB 3.48Å; L178-Q181 PolarHBondContact O-N 3.15Å; L178-Q181 VanDerWaalsContact O-N 3.11Å; L178-F182 HydrophobicContact CD1-CD2 4.33Å; L178-F182 HydrophobicContact CD1-CE2 3.78Å; L178-F182 HydrophobicContact CG-CD2 4.3Å; L178-F182 HydrophobicContact CG-CE2 4.12Å; L178-F182 WeakPolarHBondContact O-CD2 3.27Å; L178-F182 PolarHBondContact O-N 2.83Å; L178-I216 HydrophobicContact CD2-CD1 4.31Å
179	L	86.6	Confident	81.7	Confident	39 Å²	39	72 Å²	72	20%	0.204	37%	0.365	C	S	.	.	H	α-helix	trans	-57.8	-43.2	178.1	-60.9	177.9	0	0	0	111.5	L164 L172 L175 E176 Q181 F182 L183 L189 V191	L164-L179 HydrophobicContact CD2-CD2 4.21Å; L172-L179 HydrophobicContact CD2-CD1 4.04Å; L172-L179 WeakPolarHBondContact O-CD1 3.32Å; L175-L179 PolarHBondContact O-N 2.86Å; L175-L179 VanDerWaalsContact O-N 3.07Å; E176-L179 WeakPolarHBondContact O-CB 3.47Å; E176-L179 PolarHBondContact O-N 2.93Å; L179-Q181 VanDerWaalsContact C-N 3.32Å; L179-Q181 PolarHBondContact O-N 3.33Å; L179-F182 PolarHBondContact O-N 3.32Å; L179-L183 WeakPolarHBondContact O-CG 3.35Å; L179-L183 PolarHBondContact O-N 2.9Å; L179-L189 HydrophobicContact CD2-CD2 3.6Å; L179-V191 HydrophobicContact CD2-CG2 3.92Å
180	R	84.8	Confident	82	Confident	130 Å²	130	70.8 Å²	70.8	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-60.3	-36.3	176.3	-75.2	173.6	174.8	-149.8	0.1	113.3	E176 L178	E176-R180 WeakPolarHBondContact O-CG 3.29Å; E176-R180 PolarHBondContact O-N 3.25Å; E176-R180 IonicContact OE1-CZ 2.74Å; E176-R180 IonicContact OE1-NE 2.66Å; E176-R180 PolarHBondContact OE1-NE 3.14Å; E176-R180 IonicContact OE1-NH2 3.35Å; E176-R180 PolarHBondContact OE1-NH2 3.36Å; L178-R180 VanDerWaalsContact C-N 3.3Å; L178-R180 PolarHBondContact O-N 3.41Å
181	Q	81.9	Confident	82.5	Confident	72 Å²	72	70.3 Å²	70.3	34%	0.336	35%	0.353	S	S	.	.	H	α-helix	trans	-66.1	-42.4	176.6	-177.9	170.5	-26.1	0	0	111.3	Q177 L178 L179 L183 I184 S185	Q177-Q181 PolarHBondContact O-N 3.27Å; L178-Q181 WeakPolarHBondContact O-CB 3.48Å; L178-Q181 PolarHBondContact O-N 3.15Å; L178-Q181 VanDerWaalsContact O-N 3.11Å; L179-Q181 VanDerWaalsContact C-N 3.32Å; L179-Q181 PolarHBondContact O-N 3.33Å; Q181-L183 PolarHBondContact O-N 3.05Å; Q181-I184 PolarHBondContact O-N 2.99Å; Q181-S185 PolarHBondContact O-N 2.92Å
182	F	80.3	Confident	82.7	Confident	17 Å²	17	71.3 Å²	71.3	8%	0.075	36%	0.357	C	S	.	.	H	α-helix	trans	-65	-35.7	177.9	-80.9	-75.7	0	0	0	113.3	L154 L178 L179 I184 S185 E187 L189	L154-F182 HydrophobicContact CD1-CE2 3.75Å; L154-F182 HydrophobicContact CD1-CZ 3.61Å; L178-F182 HydrophobicContact CD1-CD2 4.33Å; L178-F182 HydrophobicContact CD1-CE2 3.78Å; L178-F182 HydrophobicContact CG-CD2 4.3Å; L178-F182 HydrophobicContact CG-CE2 4.12Å; L178-F182 WeakPolarHBondContact O-CD2 3.27Å; L178-F182 PolarHBondContact O-N 2.83Å; L179-F182 PolarHBondContact O-N 3.32Å; F182-I184 PolarHBondContact O-N 3.48Å; F182-I184 VanDerWaalsContact O-N 3.13Å; F182-S185 WeakPolarHBondContact CA-OG 3.36Å; F182-S185 PolarHBondContact O-N 3.05Å; F182-S185 VanDerWaalsContact O-N 3.16Å; F182-S185 PolarHBondContact O-OG 2.58Å; F182-E187 HydrophobicContact CD1-CB 3.87Å; F182-E187 HydrophobicContact CE1-CB 3.65Å; F182-E187 WeakPolarHBondContact CE1-OE2 3.24Å; F182-L189 HydrophobicContact CB-CB 4.08Å; F182-L189 HydrophobicContact CB-CD2 4.41Å; F182-L189 HydrophobicContact CD1-CB 3.93Å; F182-L189 HydrophobicContact CD2-CB 4.09Å; F182-L189 HydrophobicContact CD2-CD2 3.66Å; F182-L189 HydrophobicContact CD2-CG 4.38Å; F182-L189 HydrophobicContact CE1-CB 4.47Å; F182-L189 HydrophobicContact CE2-CD2 4.22Å; F182-L189 HydrophobicContact CG-CB 3.73Å; F182-L189 HydrophobicContact CG-CD2 4.08Å; F182-L189 HydrophobicContact CG-CG 4.5Å
183	L	74.9	Confident	83	Confident	150 Å²	150	72.3 Å²	72.3	79%	0.785	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.8	174.6	-69.1	175.5	0	0	0	114.6	L179 Q181	L179-L183 WeakPolarHBondContact O-CG 3.35Å; L179-L183 PolarHBondContact O-N 2.9Å; Q181-L183 PolarHBondContact O-N 3.05Å
184	I	73	Confident	83.3	Confident	152 Å²	152	68.8 Å²	68.8	78%	0.779	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-23.7	-179.8	-58.8	168.6	0	0	0	111	Q181 F182	Q181-I184 PolarHBondContact O-N 2.99Å; F182-I184 PolarHBondContact O-N 3.48Å; F182-I184 VanDerWaalsContact O-N 3.13Å
185	S	72.6	Confident	83.3	Confident	41 Å²	41	71.7 Å²	71.7	29%	0.287	36%	0.358	S	S	.	.	S	Bend	trans	-76.8	172.5	-179.1	82.1	0	0	0	0	113.2	Q181 F182 E187	Q181-S185 PolarHBondContact O-N 2.92Å; F182-S185 WeakPolarHBondContact CA-OG 3.36Å; F182-S185 PolarHBondContact O-N 3.05Å; F182-S185 VanDerWaalsContact O-N 3.16Å; F182-S185 PolarHBondContact O-OG 2.58Å; S185-E187 PolarHBondContact OG-N 3.24Å; S185-E187 PolarHBondContact OG-O 2.8Å
186	K	72.2	Confident	82.8	Confident	215 Å²	215	79.9 Å²	79.9	94%	0.935	40%	0.402	S	S	*	.	S	Bend	trans	-93	1.2	164.9	-68.8	-174.2	177.8	-179.1	0	113.1
187	E	80.3	Confident	82.3	Confident	69 Å²	69	79.7 Å²	79.7	32%	0.322	41%	0.41	S	S	.	.	S	Bend	trans	-85	150.6	-175.7	-64.1	161.7	-161.2	0	0	109.8	T160 F182 S185	T160-E187 WeakPolarHBondContact O-CA 3.35Å; F182-E187 HydrophobicContact CD1-CB 3.87Å; F182-E187 HydrophobicContact CE1-CB 3.65Å; F182-E187 WeakPolarHBondContact CE1-OE2 3.24Å; S185-E187 PolarHBondContact OG-N 3.24Å; S185-E187 PolarHBondContact OG-O 2.8Å
188	T	82.9	Confident	81.8	Confident	90 Å²	90	82 Å²	82	55%	0.552	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	123.6	-178.3	54	0	0	0	0	111.3	T160 A161 S162	T160-T188 PolarHBondContact O-N 3.2Å; A161-T188 WeakPolarHBondContact CA-O 3.42Å; A161-T188 WeakPolarHBondContact CB-OG1 3.44Å; S162-T188 PolarHBondContact N-O 2.73Å
189	L	87.6	Confident	81.8	Confident	34 Å²	34	85 Å²	85	18%	0.178	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	111.7	169.9	-177.6	66.5	0	0	0	109.1	S162 L164 L179 F182 V191 I216	S162-L189 WeakPolarHBondContact O-CA 3.3Å; L164-L189 HydrophobicContact CB-CD1 4.15Å; L179-L189 HydrophobicContact CD2-CD2 3.6Å; F182-L189 HydrophobicContact CB-CB 4.08Å; F182-L189 HydrophobicContact CB-CD2 4.41Å; F182-L189 HydrophobicContact CD1-CB 3.93Å; F182-L189 HydrophobicContact CD2-CB 4.09Å; F182-L189 HydrophobicContact CD2-CD2 3.66Å; F182-L189 HydrophobicContact CD2-CG 4.38Å; F182-L189 HydrophobicContact CE1-CB 4.47Å; F182-L189 HydrophobicContact CE2-CD2 4.22Å; F182-L189 HydrophobicContact CG-CB 3.73Å; F182-L189 HydrophobicContact CG-CD2 4.08Å; F182-L189 HydrophobicContact CG-CG 4.5Å; L189-V191 HydrophobicContact CD2-CG2 4.21Å; L189-V191 HydrophobicContact CG-CG2 4.12Å; L189-I216 HydrophobicContact CD1-CD1 4.28Å
190	S	88.7	Confident	81.9	Confident	32 Å²	32	83.2 Å²	83.2	22%	0.224	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	137.2	165.6	62	0	0	0	0	109	S162 C163 L164	S162-S190 PolarHBondContact O-N 3.26Å; S162-S190 PolarHBondContact O-OG 2.97Å; C163-S190 CarbonylContact C-O 3.58Å; C163-S190 WeakPolarHBondContact CA-O 3.42Å; C163-S190 WeakPolarHBondContact CA-OG 3.35Å; C163-S190 WeakPolarHBondContact CB-OG 3.4Å; C163-S190 PolarHBondContact SG-OG 3.37Å; L164-S190 PolarHBondContact N-O 3.42Å
191	V	89.9	Confident	82	Confident	65 Å²	65	78 Å²	78	39%	0.394	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	131	178.6	-171.9	0	0	0	0	108.9	L164 L172 L179 L189	L164-V191 HydrophobicContact CB-CG1 4.35Å; L164-V191 HydrophobicContact CB-CG2 4.37Å; L164-V191 HydrophobicContact CD2-CG1 4.04Å; L164-V191 HydrophobicContact CD2-CG2 4.4Å; L164-V191 HydrophobicContact CG-CG1 4.28Å; L172-V191 HydrophobicContact CD2-CG1 3.65Å; L179-V191 HydrophobicContact CD2-CG2 3.92Å; L189-V191 HydrophobicContact CD2-CG2 4.21Å; L189-V191 HydrophobicContact CG-CG2 4.12Å
192	R	89.6	Confident	82.4	Confident	21 Å²	21	77.6 Å²	77.6	8%	0.079	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135.9	-167.7	-66.8	-168.4	-178.7	-150.4	13.1	109.8	L164 I165 C166 L203 E206 I207 D210	L164-R192 PolarHBondContact O-N 2.83Å; I165-R192 WeakPolarHBondContact CA-O 3.28Å; C166-R192 PolarHBondContact N-O 3.24Å; R192-L203 HydrophobicContact CB-CD1 4.02Å; R192-L203 HydrophobicContact CB-CD2 4.04Å; R192-L203 HydrophobicContact CB-CG 4.21Å; R192-L203 PolarHBondContact NH1-O 3.49Å; R192-E206 IonicContact CZ-OE2 2.85Å; R192-E206 IonicContact NH1-OE1 3.03Å; R192-E206 IonicContact NH1-OE2 3.58Å; R192-E206 PolarHBondContact NH1-OE2 3.13Å; R192-E206 PolarHBondContact NH2-O 3.16Å; R192-I207 VanDerWaalsContact NH1-N 3.13Å; R192-D210 IonicContact CZ-OD2 4Å; R192-D210 IonicContact NH2-OD1 3.33Å; R192-D210 IonicContact NH2-OD2 2.92Å; R192-D210 PolarHBondContact NH2-OD2 3.41Å
193	M	89.1	Confident	82.8	Confident	86 Å²	86	78 Å²	78	42%	0.424	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	148.2	-177.9	-161.9	172.4	-63.4	0	0	109.7	C166 A169 L172	C166-M193 WeakPolarHBondContact O-CA 3.13Å; A169-M193 HydrophobicContact CB-CE 4.17Å; A169-M193 HydrophobicContact CB-SD 4.38Å; L172-M193 HydrophobicContact CD1-CE 3.99Å
194	L	87.4	Confident	83.5	Confident	19 Å²	19	70.8 Å²	70.8	10%	0.099	38%	0.379	C	S	.	.			trans	-75.4	139.6	168.6	-73.2	174.6	0	0	0	110.8	I165 C166 A167 P200 L203 M223 I227	I165-L194 HydrophobicContact CG2-CG 4.49Å; C166-L194 PolarHBondContact O-N 3.09Å; A167-L194 HydrophobicContact CB-CD1 4.08Å; L194-P200 HydrophobicContact CD2-CB 3.77Å; L194-L203 HydrophobicContact CD2-CD2 4.03Å; L194-M223 HydrophobicContact CD1-CG 3.84Å; L194-M223 HydrophobicContact CD1-SD 3.75Å; L194-I227 HydrophobicContact CD1-CD1 4.31Å
195	D	81.3	Confident	84.1	Confident	104 Å²	104	67.9 Å²	67.9	56%	0.556	36%	0.361	S	S	*	.			trans	-68.1	162.3	172.5	-69.1	-30.8	0	0	0	111.6	S197 Q198	D195-S197 PolarHBondContact O-N 2.92Å; D195-Q198 PolarHBondContact O-N 2.8Å
196	D	76.7	Confident	84.7	Confident	175 Å²	175	71 Å²	71	94%	0.936	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-21.9	173.8	-66.1	-35.5	0	0	0	113.9	Q198	D196-Q198 PolarHBondContact O-N 2.89Å
197	S	75.4	Confident	85.4	Confident	86 Å²	86	60.7 Å²	60.7	60%	0.601	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-16.4	175.5	69.4	0	0	0	0	113.9	D195 D199	D195-S197 PolarHBondContact O-N 2.92Å; S197-D199 PolarHBondContact O-N 2.68Å; S197-D199 VanDerWaalsContact O-N 3.1Å
198	Q	76.4	Confident	85.6	Confident	125 Å²	125	60.7 Å²	60.7	58%	0.584	32%	0.323	S	S	*	.			trans	56.3	15.3	-176.4	-60.2	-170.9	3.1	0	0	115.7	D195 D196 P200 M223	D195-Q198 PolarHBondContact O-N 2.8Å; D196-Q198 PolarHBondContact O-N 2.89Å; Q198-P200 WeakPolarHBondContact O-CD 3.24Å; Q198-M223 HydrophobicContact CB-CE 3.78Å; Q198-M223 HydrophobicContact CG-CE 4.24Å
199	D	85.7	Confident	85.4	Confident	63 Å²	63	61.5 Å²	61.5	34%	0.337	32%	0.324	S	S	.	.			trans	-85.9	114.6	172	-178.9	15.6	0	0	0	110.5	S197 T201 P202	S197-D199 PolarHBondContact O-N 2.68Å; S197-D199 VanDerWaalsContact O-N 3.1Å; D199-T201 VanDerWaalsContact C-N 3.25Å; D199-T201 PolarHBondContact O-N 3.47Å; D199-T201 WeakPolarHBondContact OD1-CB 3.25Å; D199-T201 PolarHBondContact OD1-N 2.94Å; D199-T201 PolarHBondContact OD1-OG1 2.81Å; D199-T201 WeakPolarHBondContact OD2-CB 3.37Å; D199-P202 WeakPolarHBondContact O-CD 3.49Å
200	P	88.8	Confident	85	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.006	34%	0.339	C	S	.	.			trans	-76.5	-9.4	177.2	33	-37	0	0	0	113.3	L194 Q198 L203 L204 I226 I227 R230	L194-P200 HydrophobicContact CD2-CB 3.77Å; Q198-P200 WeakPolarHBondContact O-CD 3.24Å; P200-L203 WeakPolarHBondContact O-CB 3.44Å; P200-L203 PolarHBondContact O-N 3.33Å; P200-L204 HydrophobicContact CB-CD1 3.97Å; P200-L204 HydrophobicContact CB-CG 4.29Å; P200-L204 HydrophobicContact CG-CD1 4.26Å; P200-L204 WeakPolarHBondContact O-CB 3.15Å; P200-L204 VanDerWaalsContact O-CG 3.32Å; P200-L204 WeakPolarHBondContact O-CG 3.25Å; P200-L204 PolarHBondContact O-N 3.37Å; P200-I226 HydrophobicContact CG-CG2 4.2Å; P200-I227 HydrophobicContact CB-CG1 4Å; P200-I227 HydrophobicContact CG-CG1 4.19Å; P200-R230 HydrophobicContact CG-CB 3.92Å; P200-R230 HydrophobicContact CG-CG 3.76Å
201	T	87.9	Confident	84.3	Confident	21 Å²	21	67.6 Å²	67.6	13%	0.129	35%	0.349	C	S	.	.	H	α-helix	trans	-55	-46.4	-174.1	-55.2	0	0	0	0	115.6	D199 K205 L234	D199-T201 VanDerWaalsContact C-N 3.25Å; D199-T201 PolarHBondContact O-N 3.47Å; D199-T201 WeakPolarHBondContact OD1-CB 3.25Å; D199-T201 PolarHBondContact OD1-N 2.94Å; D199-T201 PolarHBondContact OD1-OG1 2.81Å; D199-T201 WeakPolarHBondContact OD2-CB 3.37Å; T201-K205 HydrophobicContact CG2-CD 4.49Å; T201-K205 WeakPolarHBondContact O-CG 3.26Å; T201-K205 PolarHBondContact O-N 2.03Å; T201-L234 HydrophobicContact CG2-CD1 4.41Å
202	P	88.6	Confident	83.9	Confident	63 Å²	63	65.1 Å²	65.1	41%	0.409	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-43.1	176.2	24.8	-33.4	0	0	0	111.8	D199 K205 E206	D199-P202 WeakPolarHBondContact O-CD 3.49Å; P202-K205 PolarHBondContact O-N 3.24Å; P202-E206 PolarHBondContact O-N 3.14Å
203	L	89.5	Confident	83.6	Confident	25 Å²	25	66 Å²	66	13%	0.131	35%	0.346	C	S	.	.	H	α-helix	trans	-60.5	-49.3	180	-154.5	71.4	0	0	0	111	I165 R192 L194 P200 K205 E206 I207	I165-L203 HydrophobicContact CG2-CD2 4.07Å; R192-L203 HydrophobicContact CB-CD1 4.02Å; R192-L203 HydrophobicContact CB-CD2 4.04Å; R192-L203 HydrophobicContact CB-CG 4.21Å; R192-L203 PolarHBondContact NH1-O 3.49Å; L194-L203 HydrophobicContact CD2-CD2 4.03Å; P200-L203 WeakPolarHBondContact O-CB 3.44Å; P200-L203 PolarHBondContact O-N 3.33Å; L203-K205 VanDerWaalsContact C-N 3.31Å; L203-K205 PolarHBondContact O-N 3.34Å; L203-E206 PolarHBondContact O-N 3.33Å; L203-E206 VanDerWaalsContact O-N 3.16Å; L203-I207 HydrophobicContact CG-CD1 4.33Å; L203-I207 VanDerWaalsContact O-CG1 3.27Å; L203-I207 WeakPolarHBondContact O-CG1 2.97Å; L203-I207 PolarHBondContact O-N 2.94Å
204	L	89.1	Confident	83.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-36.3	178.9	-73.3	170.9	0	0	0	112.8	I165 P200 I207 R208 R230 A231 L234 M236	I165-L204 HydrophobicContact CD1-CD2 4.33Å; P200-L204 HydrophobicContact CB-CD1 3.97Å; P200-L204 HydrophobicContact CB-CG 4.29Å; P200-L204 HydrophobicContact CG-CD1 4.26Å; P200-L204 WeakPolarHBondContact O-CB 3.15Å; P200-L204 VanDerWaalsContact O-CG 3.32Å; P200-L204 WeakPolarHBondContact O-CG 3.25Å; P200-L204 PolarHBondContact O-N 3.37Å; L204-I207 PolarHBondContact O-N 3.05Å; L204-R208 WeakPolarHBondContact O-CB 3.4Å; L204-R208 PolarHBondContact O-N 3.07Å; L204-R230 HydrophobicContact CD1-CB 3.77Å; L204-A231 HydrophobicContact CD1-CB 4.29Å; L204-L234 HydrophobicContact CB-CD1 3.45Å; L204-L234 VanDerWaalsContact CB-CD1 3.45Å; L204-L234 HydrophobicContact CD1-CD1 4.14Å; L204-L234 HydrophobicContact CG-CD1 4.46Å; L204-M236 HydrophobicContact CB-SD 3.88Å; L204-M236 HydrophobicContact CD2-CE 4.03Å; L204-M236 HydrophobicContact CD2-SD 4.16Å; L204-M236 WeakPolarHBondContact O-CE 3.23Å
205	K	85.4	Confident	83.9	Confident	91 Å²	91	61.5 Å²	61.5	40%	0.396	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-48.5	173.8	-72.4	165.9	-175.8	167.5	0	111.1	T201 P202 L203 I207 R208 D209 L234	T201-K205 HydrophobicContact CG2-CD 4.49Å; T201-K205 WeakPolarHBondContact O-CG 3.26Å; T201-K205 PolarHBondContact O-N 2.03Å; P202-K205 PolarHBondContact O-N 3.24Å; L203-K205 VanDerWaalsContact C-N 3.31Å; L203-K205 PolarHBondContact O-N 3.34Å; K205-I207 VanDerWaalsContact C-N 3.34Å; K205-I207 PolarHBondContact O-N 3.46Å; K205-R208 WeakPolarHBondContact O-CB 3.4Å; K205-R208 PolarHBondContact O-N 3.48Å; K205-D209 WeakPolarHBondContact O-CB 3.32Å; K205-D209 PolarHBondContact O-N 3.01Å; K205-L234 HydrophobicContact CG-CD1 4.21Å; K205-L234 HydrophobicContact CG-CD2 3.97Å
206	E	86.4	Confident	84.5	Confident	105 Å²	105	56.6 Å²	56.6	49%	0.491	30%	0.298	S	S	.	.	H	α-helix	trans	-67	-32.7	179	-173.9	-155.1	-176	0	0	111.7	R192 P202 L203 D209 D210	R192-E206 IonicContact CZ-OE2 2.85Å; R192-E206 IonicContact NH1-OE1 3.03Å; R192-E206 IonicContact NH1-OE2 3.58Å; R192-E206 PolarHBondContact NH1-OE2 3.13Å; R192-E206 PolarHBondContact NH2-O 3.16Å; P202-E206 PolarHBondContact O-N 3.14Å; L203-E206 PolarHBondContact O-N 3.33Å; L203-E206 VanDerWaalsContact O-N 3.16Å; E206-D209 PolarHBondContact O-N 3.2Å; E206-D210 WeakPolarHBondContact O-CB 3.47Å; E206-D210 PolarHBondContact O-N 3.35Å
207	I	87.4	Confident	85.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-41.6	173.1	-71.3	174.2	0	0	0	111.1	I165 R192 L203 L204 K205 K211 T212 I215 M236	I165-I207 HydrophobicContact CD1-CD1 3.54Å; I165-I207 HydrophobicContact CG1-CD1 3.75Å; R192-I207 VanDerWaalsContact NH1-N 3.13Å; L203-I207 HydrophobicContact CG-CD1 4.33Å; L203-I207 VanDerWaalsContact O-CG1 3.27Å; L203-I207 WeakPolarHBondContact O-CG1 2.97Å; L203-I207 PolarHBondContact O-N 2.94Å; L204-I207 PolarHBondContact O-N 3.05Å; K205-I207 VanDerWaalsContact C-N 3.34Å; K205-I207 PolarHBondContact O-N 3.46Å; I207-K211 PolarHBondContact O-N 3.44Å; I207-T212 VanDerWaalsContact CG2-OG1 3.27Å; I207-T212 WeakPolarHBondContact CG2-OG1 3.49Å; I207-T212 PolarHBondContact O-N 3.42Å; I207-T212 PolarHBondContact O-OG1 3.18Å; I207-T212 VanDerWaalsContact O-OG1 3.1Å; I207-I215 HydrophobicContact CG2-CD1 3.8Å; I207-I215 HydrophobicContact CG2-CG1 4.17Å; I207-M236 HydrophobicContact CB-CE 4.28Å; I207-M236 HydrophobicContact CG2-CE 3.84Å
208	R	82.6	Confident	86	Confident	68 Å²	68	45.7 Å²	45.7	26%	0.257	23%	0.233	S	C	.	.	H	α-helix	trans	-67.8	-40.5	177	-176.4	-172.9	66.4	-162.1	-5.7	111.7	L204 K205 D210 K211 L234 M236	L204-R208 WeakPolarHBondContact O-CB 3.4Å; L204-R208 PolarHBondContact O-N 3.07Å; K205-R208 WeakPolarHBondContact O-CB 3.4Å; K205-R208 PolarHBondContact O-N 3.48Å; R208-D210 VanDerWaalsContact C-N 3.35Å; R208-K211 WeakPolarHBondContact O-CA 3.25Å; R208-K211 PolarHBondContact O-N 3.26Å; R208-L234 PolarHBondContact NH1-O 2.98Å; R208-M236 HydrophobicContact CB-CE 4.05Å; R208-M236 HydrophobicContact CB-CG 4.41Å; R208-M236 HydrophobicContact CB-SD 3.93Å; R208-M236 HydrophobicContact CG-CG 4.43Å
209	D	79.4	Confident	86.6	Confident	108 Å²	108	40.2 Å²	40.2	58%	0.578	21%	0.21	S	C	*	.	H	α-helix	trans	-70.7	-32.7	-179.2	-63.1	-11.5	0	0	0	111.1	K205 E206 K211	K205-D209 WeakPolarHBondContact O-CB 3.32Å; K205-D209 PolarHBondContact O-N 3.01Å; E206-D209 PolarHBondContact O-N 3.2Å; D209-K211 PolarHBondContact O-N 2.73Å
210	D	79.7	Confident	86.7	Confident	93 Å²	93	41.4 Å²	41.4	50%	0.497	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-8.6	166.2	-87.7	11.8	0	0	0	114.1	R192 E206 R208 T212	R192-D210 IonicContact CZ-OD2 4Å; R192-D210 IonicContact NH2-OD1 3.33Å; R192-D210 IonicContact NH2-OD2 2.92Å; R192-D210 PolarHBondContact NH2-OD2 3.41Å; E206-D210 WeakPolarHBondContact O-CB 3.47Å; E206-D210 PolarHBondContact O-N 3.35Å; R208-D210 VanDerWaalsContact C-N 3.35Å; D210-T212 HydrophobicContact CB-CG2 4.25Å; D210-T212 PolarHBondContact O-N 3.22Å
211	K	74.5	Confident	86.4	Confident	100 Å²	100	42.6 Å²	42.6	44%	0.435	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	22.3	-178.5	-48.7	-177.3	-174.8	-178.5	0	114.9	I207 R208 D209 A213 L755	I207-K211 PolarHBondContact O-N 3.44Å; R208-K211 WeakPolarHBondContact O-CA 3.25Å; R208-K211 PolarHBondContact O-N 3.26Å; D209-K211 PolarHBondContact O-N 2.73Å; K211-A213 PolarHBondContact O-N 3.21Å; K211-L755 HydrophobicContact CD-CD2 4.09Å
212	T	81.3	Confident	86.2	Confident	13 Å²	13	46.3 Å²	46.3	8%	0.08	25%	0.248	C	C	.	.			trans	-69.5	128.5	176.7	54	0	0	0	0	111.2	I207 D210 Y241	I207-T212 VanDerWaalsContact CG2-OG1 3.27Å; I207-T212 WeakPolarHBondContact CG2-OG1 3.49Å; I207-T212 PolarHBondContact O-N 3.42Å; I207-T212 PolarHBondContact O-OG1 3.18Å; I207-T212 VanDerWaalsContact O-OG1 3.1Å; D210-T212 HydrophobicContact CB-CG2 4.25Å; D210-T212 PolarHBondContact O-N 3.22Å; T212-Y241 VanDerWaalsContact O-CE1 3.27Å; T212-Y241 WeakPolarHBondContact O-CE1 3.28Å
213	A	82.2	Confident	86.1	Confident	40 Å²	40	43.9 Å²	43.9	33%	0.331	23%	0.232	S	C	.	.			trans	-99.3	-32.9	-173.7	0	0	0	0	0	113.4	K211 Y240 Y241 T242	K211-A213 PolarHBondContact O-N 3.21Å; A213-Y240 WeakPolarHBondContact CB-O 3.46Å; A213-Y241 WeakPolarHBondContact O-CA 3.35Å; A213-T242 PolarHBondContact O-N 3.05Å
214	T	89.4	Confident	86.2	Confident	11 Å²	11	42.8 Å²	42.8	7%	0.067	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	118.3	178.6	-53.6	0	0	0	0	109.2	L154 S159 S162 C163 I244	L154-T214 HydrophobicContact CD2-CG2 3.6Å; S159-T214 WeakPolarHBondContact CB-OG1 3.17Å; S159-T214 PolarHBondContact OG-OG1 3.13Å; S162-T214 CarbonylContact C-O 3.54Å; S162-T214 WeakPolarHBondContact CA-O 3.38Å; C163-T214 PolarHBondContact N-O 2.91Å; T214-I244 HydrophobicContact CG2-CD1 4.15Å
215	I	93.2	Very high	86.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118.4	-175.9	-57.9	172.3	0	0	0	108.5	C163 I165 I207 V217 M236 Y241 T242 Y243 I244	C163-I215 CarbonylContact O-C 3.54Å; C163-I215 WeakPolarHBondContact O-CA 3.38Å; I165-I215 HydrophobicContact CD1-CG2 3.6Å; I165-I215 HydrophobicContact CG1-CG2 4.03Å; I207-I215 HydrophobicContact CG2-CD1 3.8Å; I207-I215 HydrophobicContact CG2-CG1 4.17Å; I215-V217 HydrophobicContact CG2-CG2 4.02Å; I215-M236 HydrophobicContact CD1-CE 3.92Å; I215-Y241 HydrophobicContact CD1-CD1 3.87Å; I215-Y241 HydrophobicContact CD1-CE1 4.31Å; I215-T242 PolarHBondContact N-O 3.27Å; I215-Y243 HydrophobicContact CB-CD1 4.03Å; I215-Y243 HydrophobicContact CB-CE1 4.04Å; I215-Y243 HydrophobicContact CD1-CE1 3.82Å; I215-Y243 HydrophobicContact CG2-CD1 4.12Å; I215-Y243 HydrophobicContact CG2-CE1 4.02Å; I215-Y243 CarbonylContact O-C 3.58Å; I215-Y243 VanDerWaalsContact O-CA 3.3Å; I215-Y243 WeakPolarHBondContact O-CA 3.25Å; I215-I244 PolarHBondContact O-N 2.61Å
216	I	93.9	Very high	86.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130.4	175.3	-50.5	167.4	0	0	0	106.9	V150 L154 C163 L164 I165 L178 L189 I244 T246	V150-I216 HydrophobicContact CG1-CD1 4.09Å; V150-I216 HydrophobicContact CG1-CG2 4.27Å; L154-I216 HydrophobicContact CD1-CD1 3.73Å; L154-I216 HydrophobicContact CD2-CD1 4.18Å; L154-I216 HydrophobicContact CD2-CG1 4.43Å; L154-I216 HydrophobicContact CG-CD1 4.49Å; C163-I216 PolarHBondContact O-N 2.8Å; L164-I216 HydrophobicContact CD1-CB 3.95Å; L164-I216 HydrophobicContact CD1-CG2 3.73Å; I165-I216 PolarHBondContact N-O 2.81Å; L178-I216 HydrophobicContact CD2-CD1 4.31Å; L189-I216 HydrophobicContact CD1-CD1 4.28Å; I216-I244 CarbonylContact C-O 3.59Å; I216-I244 WeakPolarHBondContact CA-O 3.43Å; I216-T246 HydrophobicContact CG2-CG2 3.78Å
217	V	93.6	Very high	86.4	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	115.3	-177.3	-176.1	0	0	0	0	109.7	I165 I215 A219 I227 Y243 I244 F245 T246	I165-V217 HydrophobicContact CD1-CG2 4.44Å; I215-V217 HydrophobicContact CG2-CG2 4.02Å; V217-A219 HydrophobicContact CG1-CB 3.89Å; V217-I227 HydrophobicContact CG1-CD1 3.68Å; V217-Y243 HydrophobicContact CG2-CD1 4.3Å; V217-I244 PolarHBondContact N-O 3.42Å; V217-F245 HydrophobicContact CB-CD1 3.8Å; V217-F245 HydrophobicContact CB-CE1 3.63Å; V217-F245 HydrophobicContact CB-CZ 4.3Å; V217-F245 HydrophobicContact CG1-CD1 4.02Å; V217-F245 HydrophobicContact CG1-CE1 3.63Å; V217-F245 HydrophobicContact CG2-CE1 4.11Å; V217-F245 HydrophobicContact CG2-CZ 4.31Å; V217-T246 PolarHBondContact O-N 3.49Å; V217-T246 PolarHBondContact O-OG1 2.79Å
218	D	91.8	Very high	86.5	Confident	31 Å²	31	39.2 Å²	39.2	17%	0.166	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	96.4	170.6	-166.5	71.5	0	0	0	109.3	L164 I165 A167 C171 L175 T246	L164-D218 HydrophobicContact CD1-CB 4.48Å; I165-D218 PolarHBondContact O-N 3.09Å; A167-D218 WeakPolarHBondContact CB-O 3.5Å; A167-D218 PolarHBondContact N-O 2.93Å; C171-D218 WeakPolarHBondContact CA-OD2 3.17Å; C171-D218 HydrophobicContact CB-CB 4.17Å; C171-D218 VanDerWaalsContact CB-OD2 3.22Å; C171-D218 WeakPolarHBondContact CB-OD2 3.41Å; C171-D218 VanDerWaalsContact SG-CB 3.51Å; L175-D218 HydrophobicContact CD1-CB 4.21Å; D218-T246 WeakPolarHBondContact CA-OG1 3.42Å; D218-T246 HydrophobicContact CB-CG2 4.43Å; D218-T246 WeakPolarHBondContact OD1-CB 3.39Å; D218-T246 PolarHBondContact OD1-OG1 2.73Å
219	A	89.1	Confident	86.7	Confident	11 Å²	11	40 Å²	40	9%	0.091	22%	0.219	C	C	.	.			trans	-154.6	159.6	-174.6	0	0	0	0	0	110.9	A167 V217 M223 I227	A167-A219 HydrophobicContact CB-CB 3.72Å; V217-A219 HydrophobicContact CG1-CB 3.89Å; A219-M223 HydrophobicContact CB-CB 4.12Å; A219-M223 HydrophobicContact CB-CG 4.17Å; A219-I227 HydrophobicContact CB-CD1 4.28Å
220	N	85.8	Confident	87.1	Confident	88 Å²	88	38.9 Å²	38.9	47%	0.471	21%	0.207	S	C	.	.			trans	-68.6	166.9	168.4	66.5	13.9	0	0	0	111	T222 M223 S224	N220-T222 VanDerWaalsContact C-N 3.28Å; N220-T222 PolarHBondContact O-N 3.11Å; N220-T222 PolarHBondContact OD1-OG1 3.19Å; N220-T222 VanDerWaalsContact OD1-OG1 3.06Å; N220-M223 PolarHBondContact O-N 3.09Å; N220-M223 WeakPolarHBondContact OD1-CB 3.29Å; N220-M223 PolarHBondContact OD1-N 2.85Å; N220-S224 VanDerWaalsContact O-CB 3.29Å; N220-S224 WeakPolarHBondContact O-CB 3.47Å; N220-S224 PolarHBondContact O-N 2.92Å; N220-S224 PolarHBondContact O-OG 3.24Å
221	A	82.9	Confident	87.6	Confident	25 Å²	25	34.5 Å²	34.5	21%	0.207	18%	0.183	C	C	.	.	H	α-helix	trans	-60.9	-34.4	-175.3	0	0	0	0	0	113.4	H225 L252	A221-H225 PolarHBondContact O-N 2.98Å; A221-L252 HydrophobicContact CB-CB 4.3Å
222	T	83.8	Confident	88	Confident	99 Å²	99	32.3 Å²	32.3	61%	0.607	18%	0.181	S	C	*	.	H	α-helix	trans	-71.2	-46	179.3	48.1	0	0	0	0	112.4	N220 S224 H225 I226	N220-T222 VanDerWaalsContact C-N 3.28Å; N220-T222 PolarHBondContact O-N 3.11Å; N220-T222 PolarHBondContact OD1-OG1 3.19Å; N220-T222 VanDerWaalsContact OD1-OG1 3.06Å; T222-S224 VanDerWaalsContact C-N 3.34Å; T222-H225 WeakPolarHBondContact O-CB 3.49Å; T222-H225 PolarHBondContact O-N 3.32Å; T222-I226 WeakPolarHBondContact O-CG1 3.32Å; T222-I226 PolarHBondContact O-N 3.25Å
223	M	88	Confident	88.1	Confident	12 Å²	12	37.6 Å²	37.6	6%	0.059	21%	0.205	C	C	.	.	H	α-helix	trans	-68.3	-35.3	175.8	-174	53.3	60.4	0	0	111.7	A167 L194 Q198 A219 N220 H225 I226 I227	A167-M223 HydrophobicContact CB-CG 4.12Å; L194-M223 HydrophobicContact CD1-CG 3.84Å; L194-M223 HydrophobicContact CD1-SD 3.75Å; Q198-M223 HydrophobicContact CB-CE 3.78Å; Q198-M223 HydrophobicContact CG-CE 4.24Å; A219-M223 HydrophobicContact CB-CB 4.12Å; A219-M223 HydrophobicContact CB-CG 4.17Å; N220-M223 PolarHBondContact O-N 3.09Å; N220-M223 WeakPolarHBondContact OD1-CB 3.29Å; N220-M223 PolarHBondContact OD1-N 2.85Å; M223-H225 VanDerWaalsContact C-N 3.27Å; M223-H225 PolarHBondContact O-N 3.35Å; M223-I226 HydrophobicContact CE-CD1 4.18Å; M223-I226 PolarHBondContact O-N 2.87Å; M223-I226 HydrophobicContact SD-CB 4.26Å; M223-I226 HydrophobicContact SD-CD1 4.43Å; M223-I226 HydrophobicContact SD-CG2 4.45Å; M223-I227 HydrophobicContact CG-CD1 4.01Å; M223-I227 HydrophobicContact CG-CG1 4.41Å; M223-I227 VanDerWaalsContact O-CG1 3.3Å; M223-I227 WeakPolarHBondContact O-CG1 3.42Å; M223-I227 PolarHBondContact O-N 2.78Å; M223-I227 HydrophobicContact SD-CG1 4.41Å
224	S	89.7	Confident	88.1	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-56.1	-40.9	172.1	-63.6	0	0	0	0	112.3	N220 T222 L228 F245	N220-S224 VanDerWaalsContact O-CB 3.29Å; N220-S224 WeakPolarHBondContact O-CB 3.47Å; N220-S224 PolarHBondContact O-N 2.92Å; N220-S224 PolarHBondContact O-OG 3.24Å; T222-S224 VanDerWaalsContact C-N 3.34Å; S224-L228 WeakPolarHBondContact O-CG 3.19Å; S224-L228 PolarHBondContact O-N 3.04Å; S224-F245 VanDerWaalsContact CB-CE1 3.46Å
225	H	87.1	Confident	87.5	Confident	58 Å²	58	38.7 Å²	38.7	27%	0.269	21%	0.214	S	C	.	.	H	α-helix	trans	-64.6	-47.5	174.6	-174.9	-78.5	0	0	0	112	A221 T222 M223 I227 L228 E229 L253	A221-H225 PolarHBondContact O-N 2.98Å; T222-H225 WeakPolarHBondContact O-CB 3.49Å; T222-H225 PolarHBondContact O-N 3.32Å; M223-H225 VanDerWaalsContact C-N 3.27Å; M223-H225 PolarHBondContact O-N 3.35Å; H225-I227 VanDerWaalsContact C-N 3.31Å; H225-I227 PolarHBondContact O-N 3.1Å; H225-L228 PolarHBondContact O-N 3.18Å; H225-E229 WeakPolarHBondContact O-CB 3.31Å; H225-E229 PolarHBondContact O-N 3.11Å; H225-L253 HydrophobicContact CB-CD1 3.9Å
226	I	88.9	Confident	87	Confident	60 Å²	60	38.7 Å²	38.7	31%	0.308	21%	0.214	S	C	.	.	H	α-helix	trans	-60.5	-40.9	179.4	-63.2	167.2	0	0	0	111.1	P200 T222 M223 E229 R230	P200-I226 HydrophobicContact CG-CG2 4.2Å; T222-I226 WeakPolarHBondContact O-CG1 3.32Å; T222-I226 PolarHBondContact O-N 3.25Å; M223-I226 HydrophobicContact CE-CD1 4.18Å; M223-I226 PolarHBondContact O-N 2.87Å; M223-I226 HydrophobicContact SD-CB 4.26Å; M223-I226 HydrophobicContact SD-CD1 4.43Å; M223-I226 HydrophobicContact SD-CG2 4.45Å; I226-E229 PolarHBondContact O-N 3.31Å; I226-R230 WeakPolarHBondContact O-CG 3.42Å; I226-R230 PolarHBondContact O-N 2.99Å
227	I	90.5	Very high	86.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-45.1	175.9	-68.8	165.3	0	0	0	111	I165 L194 P200 V217 A219 M223 H225 A231	I165-I227 HydrophobicContact CG2-CD1 4.31Å; L194-I227 HydrophobicContact CD1-CD1 4.31Å; P200-I227 HydrophobicContact CB-CG1 4Å; P200-I227 HydrophobicContact CG-CG1 4.19Å; V217-I227 HydrophobicContact CG1-CD1 3.68Å; A219-I227 HydrophobicContact CB-CD1 4.28Å; M223-I227 HydrophobicContact CG-CD1 4.01Å; M223-I227 HydrophobicContact CG-CG1 4.41Å; M223-I227 VanDerWaalsContact O-CG1 3.3Å; M223-I227 WeakPolarHBondContact O-CG1 3.42Å; M223-I227 PolarHBondContact O-N 2.78Å; M223-I227 HydrophobicContact SD-CG1 4.41Å; H225-I227 VanDerWaalsContact C-N 3.31Å; H225-I227 PolarHBondContact O-N 3.1Å; I227-A231 VanDerWaalsContact O-CB 3.22Å; I227-A231 WeakPolarHBondContact O-CB 3.29Å; I227-A231 PolarHBondContact O-N 3.02Å
228	L	88.9	Confident	85.3	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-68.4	-40.1	178	-69.3	176.2	0	0	0	112.4	S224 H225 A231 S232 L237 Y243 F245 L253 L255 V258 I265	S224-L228 WeakPolarHBondContact O-CG 3.19Å; S224-L228 PolarHBondContact O-N 3.04Å; H225-L228 PolarHBondContact O-N 3.18Å; L228-A231 WeakPolarHBondContact O-CB 3.38Å; L228-A231 PolarHBondContact O-N 3.29Å; L228-S232 PolarHBondContact O-N 3.18Å; L228-L237 HydrophobicContact CD2-CD2 3.95Å; L228-L237 WeakPolarHBondContact O-CD1 3.22Å; L228-Y243 HydrophobicContact CD2-CD1 4.13Å; L228-Y243 HydrophobicContact CD2-CE1 4.35Å; L228-Y243 HydrophobicContact CD2-CG 4.25Å; L228-F245 HydrophobicContact CD1-CE2 4.11Å; L228-F245 HydrophobicContact CD1-CZ 3.84Å; L228-F245 HydrophobicContact CD2-CE2 4.23Å; L228-F245 HydrophobicContact CD2-CZ 3.96Å; L228-F245 HydrophobicContact CG-CE2 4.42Å; L228-F245 HydrophobicContact CG-CZ 3.85Å; L228-L253 HydrophobicContact CD1-CD2 3.84Å; L228-L253 HydrophobicContact CD1-CG 4.47Å; L228-L255 HydrophobicContact CD1-CD2 3.47Å; L228-L255 VanDerWaalsContact CD1-CD2 3.47Å; L228-V258 HydrophobicContact CB-CG1 3.78Å; L228-I265 HydrophobicContact CD1-CD1 4.39Å; L228-I265 HydrophobicContact CD2-CD1 4.22Å
229	E	87.3	Confident	84.4	Confident	86 Å²	86	40.8 Å²	40.8	40%	0.402	23%	0.228	S	C	.	.	H	α-helix	trans	-59.1	-50.7	176.7	-175.8	177	-160.3	0	0	111.1	H225 I226 A231 S232 E233	H225-E229 WeakPolarHBondContact O-CB 3.31Å; H225-E229 PolarHBondContact O-N 3.11Å; I226-E229 PolarHBondContact O-N 3.31Å; E229-A231 VanDerWaalsContact C-N 3.34Å; E229-A231 PolarHBondContact O-N 2.93Å; E229-S232 WeakPolarHBondContact O-CB 3.19Å; E229-S232 PolarHBondContact O-N 3.04Å; E229-S232 VanDerWaalsContact O-N 3.1Å; E229-E233 PolarHBondContact O-N 3.05Å; E229-E233 VanDerWaalsContact O-N 3.11Å
230	R	88.6	Confident	83.6	Confident	84 Å²	84	41.3 Å²	41.3	32%	0.317	23%	0.228	S	C	.	.	H	α-helix	trans	-66.1	-33.6	175.4	-63.7	-55.5	-173.9	-161.5	-9.9	112.9	P200 L204 I226 S232 E233 L234	P200-R230 HydrophobicContact CG-CB 3.92Å; P200-R230 HydrophobicContact CG-CG 3.76Å; L204-R230 HydrophobicContact CD1-CB 3.77Å; I226-R230 WeakPolarHBondContact O-CG 3.42Å; I226-R230 PolarHBondContact O-N 2.99Å; R230-S232 VanDerWaalsContact C-N 3.28Å; R230-S232 PolarHBondContact O-N 3.45Å; R230-E233 WeakPolarHBondContact CD-OE2 3.45Å; R230-E233 IonicContact CZ-OE2 3.78Å; R230-E233 IonicContact NE-OE2 3.83Å; R230-E233 IonicContact NH1-OE1 3.72Å; R230-E233 PolarHBondContact NH1-OE1 3.4Å; R230-E233 IonicContact NH1-OE2 2.69Å; R230-E233 PolarHBondContact NH1-OE2 3.46Å; R230-E233 PolarHBondContact O-N 3.39Å; R230-L234 WeakPolarHBondContact O-CB 3.37Å; R230-L234 VanDerWaalsContact O-CG 3.31Å; R230-L234 WeakPolarHBondContact O-CG 3.49Å; R230-L234 PolarHBondContact O-N 3.03Å; R230-L234 VanDerWaalsContact O-N 3.08Å
231	A	88.2	Confident	83.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-34.3	172	0	0	0	0	0	112	L204 I227 L228 E229 L234 G235 M236 L237 Y243	L204-A231 HydrophobicContact CD1-CB 4.29Å; I227-A231 VanDerWaalsContact O-CB 3.22Å; I227-A231 WeakPolarHBondContact O-CB 3.29Å; I227-A231 PolarHBondContact O-N 3.02Å; L228-A231 WeakPolarHBondContact O-CB 3.38Å; L228-A231 PolarHBondContact O-N 3.29Å; E229-A231 VanDerWaalsContact C-N 3.34Å; E229-A231 PolarHBondContact O-N 2.93Å; A231-L234 PolarHBondContact O-N 3.2Å; A231-G235 PolarHBondContact O-N 2.74Å; A231-M236 HydrophobicContact CB-CB 4.13Å; A231-M236 PolarHBondContact O-N 2.77Å; A231-L237 HydrophobicContact CB-CD2 4.1Å; A231-L237 HydrophobicContact CB-CG 4.17Å; A231-Y243 WeakPolarHBondContact CB-OH 3.48Å
232	S	84.4	Confident	83.8	Confident	55 Å²	55	37.3 Å²	37.3	39%	0.385	20%	0.204	S	C	.	.	H	α-helix	trans	-64.3	-50.9	174.1	-155.4	0	0	0	0	111	L228 E229 R230 L234 G235	L228-S232 PolarHBondContact O-N 3.18Å; E229-S232 WeakPolarHBondContact O-CB 3.19Å; E229-S232 PolarHBondContact O-N 3.04Å; E229-S232 VanDerWaalsContact O-N 3.1Å; R230-S232 VanDerWaalsContact C-N 3.28Å; R230-S232 PolarHBondContact O-N 3.45Å; S232-L234 PolarHBondContact O-N 2.9Å; S232-G235 PolarHBondContact O-N 3.4Å
233	E	83.4	Confident	84.1	Confident	124 Å²	124	32.6 Å²	32.6	58%	0.579	18%	0.175	S	C	*	.	H	α-helix	trans	-56.7	-33	175.8	-66.8	-178.1	151.1	0	0	113.1	E229 R230	E229-E233 PolarHBondContact O-N 3.05Å; E229-E233 VanDerWaalsContact O-N 3.11Å; R230-E233 WeakPolarHBondContact CD-OE2 3.45Å; R230-E233 IonicContact CZ-OE2 3.78Å; R230-E233 IonicContact NE-OE2 3.83Å; R230-E233 IonicContact NH1-OE1 3.72Å; R230-E233 PolarHBondContact NH1-OE1 3.4Å; R230-E233 IonicContact NH1-OE2 2.69Å; R230-E233 PolarHBondContact NH1-OE2 3.46Å; R230-E233 PolarHBondContact O-N 3.39Å
234	L	82.1	Confident	84.4	Confident	31 Å²	31	32 Å²	32	16%	0.162	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-1.4	179.9	-68.9	173.2	0	0	0	114.7	T201 L204 K205 R208 R230 A231 S232 M236	T201-L234 HydrophobicContact CG2-CD1 4.41Å; L204-L234 HydrophobicContact CB-CD1 3.45Å; L204-L234 VanDerWaalsContact CB-CD1 3.45Å; L204-L234 HydrophobicContact CD1-CD1 4.14Å; L204-L234 HydrophobicContact CG-CD1 4.46Å; K205-L234 HydrophobicContact CG-CD1 4.21Å; K205-L234 HydrophobicContact CG-CD2 3.97Å; R208-L234 PolarHBondContact NH1-O 2.98Å; R230-L234 WeakPolarHBondContact O-CB 3.37Å; R230-L234 VanDerWaalsContact O-CG 3.31Å; R230-L234 WeakPolarHBondContact O-CG 3.49Å; R230-L234 PolarHBondContact O-N 3.03Å; R230-L234 VanDerWaalsContact O-N 3.08Å; A231-L234 PolarHBondContact O-N 3.2Å; S232-L234 PolarHBondContact O-N 2.9Å; L234-M236 VanDerWaalsContact C-N 3.32Å; L234-M236 HydrophobicContact CB-CG 4.23Å; L234-M236 HydrophobicContact CB-SD 4.21Å; L234-M236 HydrophobicContact CD1-SD 4.43Å
235	G	76.6	Confident	84.6	Confident	43 Å²	43	32 Å²	32	44%	0.443	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	16.8	-178.5	0	0	0	0	0	114.7	A231 S232	A231-G235 PolarHBondContact O-N 2.74Å; S232-G235 PolarHBondContact O-N 3.4Å
236	M	81.9	Confident	84.7	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.16	C	C	.	.			trans	-86.4	-9.1	-179.9	-62.3	174.1	70.2	0	0	112.7	L204 I207 R208 I215 A231 L234 S238 Y241	L204-M236 HydrophobicContact CB-SD 3.88Å; L204-M236 HydrophobicContact CD2-CE 4.03Å; L204-M236 HydrophobicContact CD2-SD 4.16Å; L204-M236 WeakPolarHBondContact O-CE 3.23Å; I207-M236 HydrophobicContact CB-CE 4.28Å; I207-M236 HydrophobicContact CG2-CE 3.84Å; R208-M236 HydrophobicContact CB-CE 4.05Å; R208-M236 HydrophobicContact CB-CG 4.41Å; R208-M236 HydrophobicContact CB-SD 3.93Å; R208-M236 HydrophobicContact CG-CG 4.43Å; I215-M236 HydrophobicContact CD1-CE 3.92Å; A231-M236 HydrophobicContact CB-CB 4.13Å; A231-M236 PolarHBondContact O-N 2.77Å; L234-M236 VanDerWaalsContact C-N 3.32Å; L234-M236 HydrophobicContact CB-CG 4.23Å; L234-M236 HydrophobicContact CB-SD 4.21Å; L234-M236 HydrophobicContact CD1-SD 4.43Å; M236-S238 VanDerWaalsContact C-N 3.26Å; M236-S238 PolarHBondContact O-N 3.37Å; M236-S238 VanDerWaalsContact O-N 3.09Å; M236-Y241 HydrophobicContact CB-CD2 4.44Å; M236-Y241 HydrophobicContact CB-CE2 4.27Å; M236-Y241 HydrophobicContact CE-CE1 4.04Å; M236-Y241 HydrophobicContact CG-CE2 4.48Å; M236-Y241 WeakPolarHBondContact O-CB 3.39Å; M236-Y241 WeakPolarHBondContact O-CD2 3.14Å
237	L	80.8	Confident	84.8	Confident	12 Å²	12	27.7 Å²	27.7	6%	0.063	15%	0.153	C	C	.	.	S	Bend	trans	-84.1	68.6	166.6	-63.7	-168.8	0	0	0	111.1	L228 A231 Y243 V258 V263	L228-L237 HydrophobicContact CD2-CD2 3.95Å; L228-L237 WeakPolarHBondContact O-CD1 3.22Å; A231-L237 HydrophobicContact CB-CD2 4.1Å; A231-L237 HydrophobicContact CB-CG 4.17Å; L237-Y243 HydrophobicContact CD2-CD2 4.26Å; L237-Y243 HydrophobicContact CD2-CE2 3.66Å; L237-V258 HydrophobicContact CD1-CG1 3.61Å; L237-V258 WeakPolarHBondContact CD1-O 3.24Å; L237-V263 HydrophobicContact CB-CG2 3.83Å; L237-V263 HydrophobicContact CD2-CG1 4.31Å; L237-V263 HydrophobicContact CD2-CG2 4.47Å; L237-V263 WeakPolarHBondContact O-CG2 3.46Å
238	S	72.2	Confident	84.6	Confident	21 Å²	21	27.8 Å²	27.8	15%	0.147	15%	0.154	C	C	.	.	S	Bend	trans	-129.3	170.7	174.2	62.1	0	0	0	0	112.2	M236 Y240 Y241	M236-S238 VanDerWaalsContact C-N 3.26Å; M236-S238 PolarHBondContact O-N 3.37Å; M236-S238 VanDerWaalsContact O-N 3.09Å; S238-Y240 PolarHBondContact O-N 3.16Å; S238-Y241 PolarHBondContact O-N 3.06Å; S238-Y241 WeakPolarHBondContact OG-CD2 3.29Å
239	V	71.5	Confident	84.5	Confident	42 Å²	42	30 Å²	30	26%	0.255	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-22	-177.5	-146.2	0	0	0	0	114	Y241 R262	V239-Y241 VanDerWaalsContact C-N 3.34Å; V239-R262 WeakPolarHBondContact CA-O 3.42Å; V239-R262 HydrophobicContact CB-CB 4.47Å; V239-R262 HydrophobicContact CG1-CB 4.42Å; V239-R262 HydrophobicContact CG2-CB 3.85Å
240	Y	73.7	Confident	84.5	Confident	23 Å²	23	26.1 Å²	26.1	9%	0.09	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-9.9	-176.4	-54.4	-74.3	0	0	0	113.8	A213 S238 S757	A213-Y240 WeakPolarHBondContact CB-O 3.46Å; S238-Y240 PolarHBondContact O-N 3.16Å; Y240-S757 PolarHBondContact OH-OG 2.89Å
241	Y	83.4	Confident	84.3	Confident	4 Å²	4	23.6 Å²	23.6	2%	0.016	14%	0.14	C	C	.	.			trans	-110.7	135.8	-178.7	-67.1	-88.4	0	0	0	111.5	T212 A213 I215 M236 S238 V239	T212-Y241 VanDerWaalsContact O-CE1 3.27Å; T212-Y241 WeakPolarHBondContact O-CE1 3.28Å; A213-Y241 WeakPolarHBondContact O-CA 3.35Å; I215-Y241 HydrophobicContact CD1-CD1 3.87Å; I215-Y241 HydrophobicContact CD1-CE1 4.31Å; M236-Y241 HydrophobicContact CB-CD2 4.44Å; M236-Y241 HydrophobicContact CB-CE2 4.27Å; M236-Y241 HydrophobicContact CE-CE1 4.04Å; M236-Y241 HydrophobicContact CG-CE2 4.48Å; M236-Y241 WeakPolarHBondContact O-CB 3.39Å; M236-Y241 WeakPolarHBondContact O-CD2 3.14Å; S238-Y241 PolarHBondContact O-N 3.06Å; S238-Y241 WeakPolarHBondContact OG-CD2 3.29Å; V239-Y241 VanDerWaalsContact C-N 3.34Å
242	T	87.9	Confident	84	Confident	24 Å²	24	25 Å²	25	15%	0.147	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.1	170.2	-66.8	0	0	0	0	108.7	F157 A213 I215 I244 N264	F157-T242 HydrophobicContact CD2-CG2 4.39Å; F157-T242 HydrophobicContact CE2-CG2 4.32Å; A213-T242 PolarHBondContact O-N 3.05Å; I215-T242 PolarHBondContact N-O 3.27Å; T242-I244 HydrophobicContact CG2-CG1 4.16Å; T242-N264 CarbonylContact C-O 3.3Å; T242-N264 WeakPolarHBondContact CA-O 3.37Å; T242-N264 HydrophobicContact CG2-CB 4.28Å; T242-N264 WeakPolarHBondContact CG2-ND2 3.41Å; T242-N264 PolarHBondContact OG1-ND2 2.72Å
243	Y	91.6	Very high	83.9	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.8	178	-73.3	-92.8	0	0	0	109.7	I215 V217 L228 A231 L237 V263 N264 V266	I215-Y243 HydrophobicContact CB-CD1 4.03Å; I215-Y243 HydrophobicContact CB-CE1 4.04Å; I215-Y243 HydrophobicContact CD1-CE1 3.82Å; I215-Y243 HydrophobicContact CG2-CD1 4.12Å; I215-Y243 HydrophobicContact CG2-CE1 4.02Å; I215-Y243 CarbonylContact O-C 3.58Å; I215-Y243 VanDerWaalsContact O-CA 3.3Å; I215-Y243 WeakPolarHBondContact O-CA 3.25Å; V217-Y243 HydrophobicContact CG2-CD1 4.3Å; L228-Y243 HydrophobicContact CD2-CD1 4.13Å; L228-Y243 HydrophobicContact CD2-CE1 4.35Å; L228-Y243 HydrophobicContact CD2-CG 4.25Å; A231-Y243 WeakPolarHBondContact CB-OH 3.48Å; L237-Y243 HydrophobicContact CD2-CD2 4.26Å; L237-Y243 HydrophobicContact CD2-CE2 3.66Å; Y243-V263 HydrophobicContact CD2-CG1 3.83Å; Y243-V263 HydrophobicContact CE2-CG1 4.17Å; Y243-N264 PolarHBondContact N-O 3.43Å; Y243-V266 PolarHBondContact O-N 2.86Å
244	I	93.4	Very high	83.4	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	110.6	178.5	-56.4	178	0	0	0	108.8	L153 L154 F157 T214 I215 I216 V217 T242 V266 F268	L153-I244 HydrophobicContact CB-CD1 4.27Å; L153-I244 HydrophobicContact CD1-CG2 4.15Å; L154-I244 HydrophobicContact CD2-CD1 3.79Å; F157-I244 HydrophobicContact CD2-CD1 4.45Å; T214-I244 HydrophobicContact CG2-CD1 4.15Å; I215-I244 PolarHBondContact O-N 2.61Å; I216-I244 CarbonylContact C-O 3.59Å; I216-I244 WeakPolarHBondContact CA-O 3.43Å; V217-I244 PolarHBondContact N-O 3.42Å; T242-I244 HydrophobicContact CG2-CG1 4.16Å; I244-V266 CarbonylContact C-O 3.55Å; I244-V266 WeakPolarHBondContact CA-O 3.31Å; I244-F268 HydrophobicContact CG2-CE2 4.43Å
245	F	93.2	Very high	83	Confident	3 Å²	3	20.7 Å²	20.7	1%	0.013	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.3	176.5	-72.5	-86.1	0	0	0	110.8	V217 S224 L228 F250 L253 I265 V266 G267 F268	V217-F245 HydrophobicContact CB-CD1 3.8Å; V217-F245 HydrophobicContact CB-CE1 3.63Å; V217-F245 HydrophobicContact CB-CZ 4.3Å; V217-F245 HydrophobicContact CG1-CD1 4.02Å; V217-F245 HydrophobicContact CG1-CE1 3.63Å; V217-F245 HydrophobicContact CG2-CE1 4.11Å; V217-F245 HydrophobicContact CG2-CZ 4.31Å; S224-F245 VanDerWaalsContact CB-CE1 3.46Å; L228-F245 HydrophobicContact CD1-CE2 4.11Å; L228-F245 HydrophobicContact CD1-CZ 3.84Å; L228-F245 HydrophobicContact CD2-CE2 4.23Å; L228-F245 HydrophobicContact CD2-CZ 3.96Å; L228-F245 HydrophobicContact CG-CE2 4.42Å; L228-F245 HydrophobicContact CG-CZ 3.85Å; F245-F250 HydrophobicContact CB-CD2 3.73Å; F245-F250 HydrophobicContact CB-CE2 4.23Å; F245-F250 AromaticContact CD2-CD2 3.97Å; F245-F250 HydrophobicContact CD2-CD2 3.97Å; F245-F250 AromaticContact CD2-CE2 3.65Å; F245-F250 HydrophobicContact CD2-CE2 3.65Å; F245-F250 HydrophobicContact CE2-CE2 4.39Å; F245-F250 AromaticContact CG-CD2 3.95Å; F245-F250 HydrophobicContact CG-CD2 3.95Å; F245-F250 HydrophobicContact CG-CE2 4.13Å; F245-L253 HydrophobicContact CD2-CD2 4.43Å; F245-L253 HydrophobicContact CE1-CD2 4.29Å; F245-L253 HydrophobicContact CE2-CD2 4.18Å; F245-L253 HydrophobicContact CZ-CD2 4.11Å; F245-I265 HydrophobicContact CD2-CG2 3.96Å; F245-I265 HydrophobicContact CE2-CG2 3.72Å; F245-V266 PolarHBondContact N-O 2.87Å; F245-G267 WeakPolarHBondContact O-CA 3.37Å; F245-F268 VanDerWaalsContact O-CD2 3.26Å; F245-F268 WeakPolarHBondContact O-CD2 3.28Å
246	T	91.2	Very high	82.5	Confident	4 Å²	4	24.9 Å²	24.9	3%	0.025	13%	0.129	C	C	.	.			trans	-76.8	-27.9	179.4	57.3	0	0	0	0	112.7	V150 L175 I216 V217 D218 L248	V150-T246 HydrophobicContact CG2-CG2 4.1Å; L175-T246 HydrophobicContact CD1-CG2 4.12Å; L175-T246 HydrophobicContact CD2-CG2 4.28Å; I216-T246 HydrophobicContact CG2-CG2 3.78Å; V217-T246 PolarHBondContact O-N 3.49Å; V217-T246 PolarHBondContact O-OG1 2.79Å; D218-T246 WeakPolarHBondContact CA-OG1 3.42Å; D218-T246 HydrophobicContact CB-CG2 4.43Å; D218-T246 WeakPolarHBondContact OD1-CB 3.39Å; D218-T246 PolarHBondContact OD1-OG1 2.73Å; T246-L248 PolarHBondContact O-N 2.96Å
247	S	89.1	Confident	81.5	Confident	24 Å²	24	32.1 Å²	32.1	17%	0.168	17%	0.167	C	C	.	.			trans	-64	126.5	-177.2	-178	0	0	0	0	112	E249 F250	S247-E249 PolarHBondContact O-N 3.43Å; S247-E249 VanDerWaalsContact O-N 3.11Å; S247-E249 PolarHBondContact OG-N 3.49Å; S247-F250 WeakPolarHBondContact O-CB 3.09Å; S247-F250 PolarHBondContact O-N 3.09Å
248	L	88.3	Confident	80.5	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.01	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-11	173.8	-58	176.5	0	0	0	113.5	R140 P141 I146 T246 F250 F268 V270 L303 L376	R140-L248 HydrophobicContact CG-CD1 4.4Å; P141-L248 HydrophobicContact CB-CD1 3.99Å; P141-L248 HydrophobicContact CG-CD1 3.78Å; I146-L248 HydrophobicContact CD1-CD1 4.09Å; I146-L248 HydrophobicContact CD1-CD2 4.1Å; I146-L248 HydrophobicContact CD1-CG 4.05Å; I146-L248 HydrophobicContact CG1-CD2 4.29Å; T246-L248 PolarHBondContact O-N 2.96Å; L248-F250 VanDerWaalsContact C-N 3.32Å; L248-F268 HydrophobicContact CD2-CB 3.99Å; L248-V270 HydrophobicContact CB-CG2 4.23Å; L248-V270 HydrophobicContact CD1-CG2 3.97Å; L248-V270 HydrophobicContact CD2-CG2 3.98Å; L248-V270 HydrophobicContact CG-CG2 4.29Å; L248-L303 HydrophobicContact CB-CD2 3.6Å; L248-L303 HydrophobicContact CD1-CD2 3.86Å; L248-L303 HydrophobicContact CG-CD2 4.41Å; L248-L376 HydrophobicContact CD2-CD2 3.92Å
249	E	86	Confident	79.6	Confident	47 Å²	47	32.4 Å²	32.4	22%	0.22	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	16	176.8	-58.5	-164.8	130.5	0	0	112.8	S247 T251 L252 L303	S247-E249 PolarHBondContact O-N 3.43Å; S247-E249 VanDerWaalsContact O-N 3.11Å; S247-E249 PolarHBondContact OG-N 3.49Å; E249-T251 PolarHBondContact O-N 3.45Å; E249-L252 HydrophobicContact CB-CD1 4.13Å; E249-L252 HydrophobicContact CB-CG 4.43Å; E249-L252 WeakPolarHBondContact O-CB 3.37Å; E249-L252 PolarHBondContact O-N 3.2Å; E249-L303 HydrophobicContact CG-CB 3.9Å; E249-L303 PolarHBondContact OE1-N 3.03Å
250	F	86.9	Confident	78.9	Confident	5 Å²	5	33.3 Å²	33.3	2%	0.022	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-50.5	-28	177.6	178.1	-113.1	0	0	0	113.9	F245 S247 L248 L252 L253 L255 I265 M379 L386	F245-F250 HydrophobicContact CB-CD2 3.73Å; F245-F250 HydrophobicContact CB-CE2 4.23Å; F245-F250 AromaticContact CD2-CD2 3.97Å; F245-F250 HydrophobicContact CD2-CD2 3.97Å; F245-F250 AromaticContact CD2-CE2 3.65Å; F245-F250 HydrophobicContact CD2-CE2 3.65Å; F245-F250 HydrophobicContact CE2-CE2 4.39Å; F245-F250 AromaticContact CG-CD2 3.95Å; F245-F250 HydrophobicContact CG-CD2 3.95Å; F245-F250 HydrophobicContact CG-CE2 4.13Å; S247-F250 WeakPolarHBondContact O-CB 3.09Å; S247-F250 PolarHBondContact O-N 3.09Å; L248-F250 VanDerWaalsContact C-N 3.32Å; F250-L252 PolarHBondContact O-N 3.48Å; F250-L253 HydrophobicContact CD2-CD2 4.05Å; F250-L253 HydrophobicContact CE2-CD2 4Å; F250-L253 VanDerWaalsContact O-CB 3.29Å; F250-L253 WeakPolarHBondContact O-CB 3.35Å; F250-L253 PolarHBondContact O-N 3.46Å; F250-L253 VanDerWaalsContact O-N 3.1Å; F250-L255 HydrophobicContact CZ-CD1 4.29Å; F250-I265 HydrophobicContact CE2-CG2 3.9Å; F250-I265 HydrophobicContact CZ-CG2 3.96Å; F250-M379 HydrophobicContact CD1-CB 3.93Å; F250-M379 HydrophobicContact CE1-CB 3.86Å; F250-M379 WeakPolarHBondContact CE1-O 3.43Å; F250-L386 HydrophobicContact CD1-CD1 4.22Å; F250-L386 HydrophobicContact CE1-CD1 4.12Å; F250-L386 HydrophobicContact CE1-CD2 3.63Å; F250-L386 HydrophobicContact CE1-CG 4.5Å; F250-L386 HydrophobicContact CZ-CD2 3.9Å
251	T	84.3	Confident	78.2	Confident	32 Å²	32	38.8 Å²	38.8	20%	0.196	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-69.7	-9.3	175.2	51.4	0	0	0	0	115.4	E249 F271 L386	E249-T251 PolarHBondContact O-N 3.45Å; T251-F271 WeakPolarHBondContact OG1-CE2 3.45Å; T251-L386 HydrophobicContact CG2-CD1 4.19Å
252	L	83.1	Confident	77.2	Confident	30 Å²	30	42.8 Å²	42.8	16%	0.157	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-86.8	-13.9	170.4	-61.3	-176.8	0	0	0	112.8	A221 E249 F250 R254	A221-L252 HydrophobicContact CB-CB 4.3Å; E249-L252 HydrophobicContact CB-CD1 4.13Å; E249-L252 HydrophobicContact CB-CG 4.43Å; E249-L252 WeakPolarHBondContact O-CB 3.37Å; E249-L252 PolarHBondContact O-N 3.2Å; F250-L252 PolarHBondContact O-N 3.48Å; L252-R254 PolarHBondContact O-N 3.38Å
253	L	80.6	Confident	76.6	Confident	13 Å²	13	42.1 Å²	42.1	7%	0.068	21%	0.212	C	C	.	.			trans	-77.6	114.7	-177.5	-173.3	61	0	0	0	109.7	H225 L228 F245 F250 L255	H225-L253 HydrophobicContact CB-CD1 3.9Å; L228-L253 HydrophobicContact CD1-CD2 3.84Å; L228-L253 HydrophobicContact CD1-CG 4.47Å; F245-L253 HydrophobicContact CD2-CD2 4.43Å; F245-L253 HydrophobicContact CE1-CD2 4.29Å; F245-L253 HydrophobicContact CE2-CD2 4.18Å; F245-L253 HydrophobicContact CZ-CD2 4.11Å; F250-L253 HydrophobicContact CD2-CD2 4.05Å; F250-L253 HydrophobicContact CE2-CD2 4Å; F250-L253 VanDerWaalsContact O-CB 3.29Å; F250-L253 WeakPolarHBondContact O-CB 3.35Å; F250-L253 PolarHBondContact O-N 3.46Å; F250-L253 VanDerWaalsContact O-N 3.1Å; L253-L255 HydrophobicContact CD2-CD2 3.93Å; L253-L255 HydrophobicContact CG-CD2 3.9Å; L253-L255 HydrophobicContact CG-CG 4.46Å
254	R	73.8	Confident	76.2	Confident	99 Å²	99	43.1 Å²	43.1	37%	0.374	22%	0.217	S	C	.	.			trans	-78.3	127.8	171.7	-67.2	-168	-178.6	164.7	7	110	L252 P297 F298	L252-R254 PolarHBondContact O-N 3.38Å; R254-P297 VanDerWaalsContact NH1-CG 3.31Å; R254-P297 VanDerWaalsContact NH2-C 3.33Å; R254-P297 PolarHBondContact NH2-O 2.79Å; R254-F298 PolarHBondContact NH2-O 2.97Å
255	L	73.4	Confident	75.9	Confident	7 Å²	7	43.2 Å²	43.2	4%	0.037	22%	0.217	C	C	.	.			trans	-113.6	-7.9	-178.7	-61.9	177.4	0	0	0	112.6	L228 F250 L253 D257 V258 A259 I265 N381 L386	L228-L255 HydrophobicContact CD1-CD2 3.47Å; L228-L255 VanDerWaalsContact CD1-CD2 3.47Å; F250-L255 HydrophobicContact CZ-CD1 4.29Å; L253-L255 HydrophobicContact CD2-CD2 3.93Å; L253-L255 HydrophobicContact CG-CD2 3.9Å; L253-L255 HydrophobicContact CG-CG 4.46Å; L255-D257 VanDerWaalsContact C-N 3.33Å; L255-D257 PolarHBondContact O-N 2.76Å; L255-V258 PolarHBondContact O-N 2.87Å; L255-A259 HydrophobicContact CB-CB 4.33Å; L255-A259 WeakPolarHBondContact O-CB 3.47Å; L255-A259 PolarHBondContact O-N 2.89Å; L255-I265 HydrophobicContact CD1-CG2 4.23Å; L255-I265 HydrophobicContact CD2-CD1 4.16Å; L255-N381 HydrophobicContact CD1-CB 3.71Å; L255-L386 HydrophobicContact CD1-CD2 3.84Å
256	D	65.6	Low	75.8	Confident	130 Å²	130	43 Å²	43	70%	0.695	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-35.4	-169.2	-54.6	-48.1	0	0	0	113.6
257	D	61.6	Low	75.9	Confident	152 Å²	152	42.9 Å²	42.9	81%	0.813	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-17.4	-178.5	-63.4	-48.3	0	0	0	113.7	L255	L255-D257 VanDerWaalsContact C-N 3.33Å; L255-D257 PolarHBondContact O-N 2.76Å
258	V	58.9	Low	76	Confident	18 Å²	18	41.7 Å²	41.7	11%	0.109	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-35.5	-161.7	178.7	0	0	0	0	112.9	L228 L237 L255	L228-V258 HydrophobicContact CB-CG1 3.78Å; L237-V258 HydrophobicContact CD1-CG1 3.61Å; L237-V258 WeakPolarHBondContact CD1-O 3.24Å; L255-V258 PolarHBondContact O-N 2.87Å
259	A	54.8	Low	76.2	Confident	21 Å²	21	41.7 Å²	41.7	17%	0.174	21%	0.208	C	C	.	.			trans	-89.4	113.5	-171.3	0	0	0	0	0	113.3	L255 Q261 I265 N381	L255-A259 HydrophobicContact CB-CB 4.33Å; L255-A259 WeakPolarHBondContact O-CB 3.47Å; L255-A259 PolarHBondContact O-N 2.89Å; A259-Q261 PolarHBondContact O-N 2.98Å; A259-I265 HydrophobicContact CB-CD1 4Å; A259-N381 VanDerWaalsContact CB-ND2 3.28Å; A259-N381 WeakPolarHBondContact CB-ND2 3.48Å
260	D	56.8	Low	76.4	Confident	61 Å²	61	39.6 Å²	39.6	33%	0.326	20%	0.198	S	C	.	.			trans	-55.4	138.9	157.9	-169.6	-26.6	0	0	0	108.7	R262 V263	D260-R262 PolarHBondContact O-N 2.82Å; D260-R262 IonicContact OD1-CZ 2.76Å; D260-R262 IonicContact OD1-NE 2.96Å; D260-R262 PolarHBondContact OD1-NE 2.82Å; D260-R262 IonicContact OD1-NH2 3.55Å; D260-R262 IonicContact OD2-CZ 3.53Å; D260-R262 IonicContact OD2-NE 2.63Å; D260-R262 PolarHBondContact OD2-NE 3.39Å; D260-R262 IonicContact OD2-NH2 3.99Å; D260-R262 PolarHBondContact OD2-NH2 3.49Å; D260-V263 PolarHBondContact O-N 3.28Å
261	Q	58.3	Low	76.6	Confident	139 Å²	139	39.6 Å²	39.6	65%	0.65	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	4.1	-168.4	-60.2	-177.1	3.8	0	0	114.9	A259	A259-Q261 PolarHBondContact O-N 2.98Å
262	R	62.6	Low	76.9	Confident	88 Å²	88	38.7 Å²	38.7	33%	0.332	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-7.8	-165.6	-53.7	177.9	-82.2	177.7	-0.2	113.1	V239 D260	V239-R262 WeakPolarHBondContact CA-O 3.42Å; V239-R262 HydrophobicContact CB-CB 4.47Å; V239-R262 HydrophobicContact CG1-CB 4.42Å; V239-R262 HydrophobicContact CG2-CB 3.85Å; D260-R262 PolarHBondContact O-N 2.82Å; D260-R262 IonicContact OD1-CZ 2.76Å; D260-R262 IonicContact OD1-NE 2.96Å; D260-R262 PolarHBondContact OD1-NE 2.82Å; D260-R262 IonicContact OD1-NH2 3.55Å; D260-R262 IonicContact OD2-CZ 3.53Å; D260-R262 IonicContact OD2-NE 2.63Å; D260-R262 PolarHBondContact OD2-NE 3.39Å; D260-R262 IonicContact OD2-NH2 3.99Å; D260-R262 PolarHBondContact OD2-NH2 3.49Å
263	V	76.1	Confident	77	Confident	10 Å²	10	42.4 Å²	42.4	6%	0.061	21%	0.207	C	C	.	.			trans	-84	132.8	179.6	-167.9	0	0	0	0	110.6	L237 Y243 D260 I265	L237-V263 HydrophobicContact CB-CG2 3.83Å; L237-V263 HydrophobicContact CD2-CG1 4.31Å; L237-V263 HydrophobicContact CD2-CG2 4.47Å; L237-V263 WeakPolarHBondContact O-CG2 3.46Å; Y243-V263 HydrophobicContact CD2-CG1 3.83Å; Y243-V263 HydrophobicContact CE2-CG1 4.17Å; D260-V263 PolarHBondContact O-N 3.28Å; V263-I265 HydrophobicContact CB-CD1 4.47Å; V263-I265 HydrophobicContact CB-CG1 4.1Å; V263-I265 HydrophobicContact CG1-CD1 4.35Å; V263-I265 HydrophobicContact CG1-CG1 3.75Å; V263-I265 PolarHBondContact O-N 3.35Å; V263-I265 VanDerWaalsContact O-N 3.1Å
264	N	81.3	Confident	77.4	Confident	21 Å²	21	47.1 Å²	47.1	11%	0.112	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	88.5	174.3	-172.5	27.2	0	0	0	110	F157 T242 Y243 V266 Q380	F157-N264 WeakPolarHBondContact CE1-ND2 3.44Å; F157-N264 WeakPolarHBondContact CZ-ND2 3.09Å; T242-N264 CarbonylContact C-O 3.3Å; T242-N264 WeakPolarHBondContact CA-O 3.37Å; T242-N264 HydrophobicContact CG2-CB 4.28Å; T242-N264 WeakPolarHBondContact CG2-ND2 3.41Å; T242-N264 PolarHBondContact OG1-ND2 2.72Å; Y243-N264 PolarHBondContact N-O 3.43Å; N264-V266 WeakPolarHBondContact OD1-CG2 3.38Å; N264-Q380 PolarHBondContact OD1-NE2 3.4Å
265	I	89.1	Confident	78.1	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	119.6	174.8	-53	179.3	0	0	0	108.8	L228 F245 F250 L255 A259 V263 Q380 N381	L228-I265 HydrophobicContact CD1-CD1 4.39Å; L228-I265 HydrophobicContact CD2-CD1 4.22Å; F245-I265 HydrophobicContact CD2-CG2 3.96Å; F245-I265 HydrophobicContact CE2-CG2 3.72Å; F250-I265 HydrophobicContact CE2-CG2 3.9Å; F250-I265 HydrophobicContact CZ-CG2 3.96Å; L255-I265 HydrophobicContact CD1-CG2 4.23Å; L255-I265 HydrophobicContact CD2-CD1 4.16Å; A259-I265 HydrophobicContact CB-CD1 4Å; V263-I265 HydrophobicContact CB-CD1 4.47Å; V263-I265 HydrophobicContact CB-CG1 4.1Å; V263-I265 HydrophobicContact CG1-CD1 4.35Å; V263-I265 HydrophobicContact CG1-CG1 3.75Å; V263-I265 PolarHBondContact O-N 3.35Å; V263-I265 VanDerWaalsContact O-N 3.1Å; I265-Q380 WeakPolarHBondContact O-CA 3.36Å; I265-N381 HydrophobicContact CB-CB 4.09Å; I265-N381 PolarHBondContact O-N 2.92Å
266	V	90.7	Very high	78.8	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145	-174.9	-175.5	0	0	0	0	109.9	L153 F157 Y243 I244 F245 N264 I378 M379 Q380	L153-V266 HydrophobicContact CD1-CG1 3.92Å; F157-V266 HydrophobicContact CE2-CG2 4.48Å; F157-V266 HydrophobicContact CZ-CG2 4.27Å; Y243-V266 PolarHBondContact O-N 2.86Å; I244-V266 CarbonylContact C-O 3.55Å; I244-V266 WeakPolarHBondContact CA-O 3.31Å; F245-V266 PolarHBondContact N-O 2.87Å; N264-V266 WeakPolarHBondContact OD1-CG2 3.38Å; V266-I378 HydrophobicContact CG1-CG2 3.48Å; V266-I378 VanDerWaalsContact CG1-CG2 3.48Å; V266-M379 CarbonylContact C-O 3.46Å; V266-M379 VanDerWaalsContact CA-O 3.31Å; V266-M379 WeakPolarHBondContact CA-O 3.35Å; V266-Q380 HydrophobicContact CG2-CG 4.38Å
267	G	92.1	Very high	79.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	178.8	170.6	0	0	0	0	0	112.6	F245 M379	F245-G267 WeakPolarHBondContact O-CA 3.37Å; G267-M379 PolarHBondContact N-O 2.04Å; G267-M379 PolarHBondContact O-N 2.84Å
268	F	91.9	Very high	81.3	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	151	-173.4	-57.1	-78.8	0	0	0	112.8	A149 V150 L153 I244 F245 L248 L376 R377 I378	A149-F268 HydrophobicContact CB-CD1 4.47Å; A149-F268 HydrophobicContact CB-CE1 3.71Å; A149-F268 HydrophobicContact CB-CZ 4.01Å; V150-F268 HydrophobicContact CG2-CE2 3.59Å; V150-F268 HydrophobicContact CG2-CZ 3.8Å; L153-F268 HydrophobicContact CD1-CE1 3.96Å; L153-F268 HydrophobicContact CD1-CZ 3.67Å; I244-F268 HydrophobicContact CG2-CE2 4.43Å; F245-F268 VanDerWaalsContact O-CD2 3.26Å; F245-F268 WeakPolarHBondContact O-CD2 3.28Å; L248-F268 HydrophobicContact CD2-CB 3.99Å; F268-L376 HydrophobicContact CD1-CB 4.48Å; F268-R377 CarbonylContact C-O 3.6Å; F268-I378 HydrophobicContact CD1-CG1 4.16Å; F268-I378 HydrophobicContact CE1-CG1 4.13Å
269	S	91.4	Very high	82.8	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	141.1	172.1	-169.2	0	0	0	0	111.1	F271 R377	S269-F271 WeakPolarHBondContact OG-CD2 3.31Å; S269-R377 PolarHBondContact N-O 2.97Å; S269-R377 WeakPolarHBondContact O-CA 3.47Å; S269-R377 WeakPolarHBondContact O-CB 3.39Å; S269-R377 PolarHBondContact O-N 2.59Å
270	V	91.6	Very high	84.4	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.018	25%	0.245	C	C	.	.			trans	-99.2	-6.9	178.3	-153.7	0	0	0	0	111.7	P141 L248 N272 L303 T360 L376	P141-V270 HydrophobicContact CG-CG1 4.18Å; P141-V270 HydrophobicContact CG-CG2 3.88Å; L248-V270 HydrophobicContact CB-CG2 4.23Å; L248-V270 HydrophobicContact CD1-CG2 3.97Å; L248-V270 HydrophobicContact CD2-CG2 3.98Å; L248-V270 HydrophobicContact CG-CG2 4.29Å; V270-N272 PolarHBondContact O-N 3.14Å; V270-L303 HydrophobicContact CB-CD1 4.45Å; V270-L303 HydrophobicContact CG2-CD1 4.36Å; V270-T360 CarbonylContact O-C 3.58Å; V270-T360 WeakPolarHBondContact O-CA 3.33Å; V270-L376 HydrophobicContact CG2-CD2 4.04Å
271	F	91.1	Very high	86.1	Confident	4 Å²	4	46 Å²	46	2%	0.018	23%	0.229	C	C	.	.			trans	-69.9	126.2	-169.6	-66.8	-59.5	0	0	0	113.5	T251 S269 K273 F278 T301 L303 A306 R377	T251-F271 WeakPolarHBondContact OG1-CE2 3.45Å; S269-F271 WeakPolarHBondContact OG-CD2 3.31Å; F271-K273 PolarHBondContact O-N 2.85Å; F271-K273 VanDerWaalsContact O-N 3.14Å; F271-F278 HydrophobicContact CB-CE2 3.8Å; F271-F278 HydrophobicContact CB-CZ 3.9Å; F271-F278 AromaticContact CD1-CE2 3.87Å; F271-F278 HydrophobicContact CD1-CE2 3.87Å; F271-F278 HydrophobicContact CD1-CZ 4.38Å; F271-F278 HydrophobicContact CG-CE2 4.05Å; F271-F278 HydrophobicContact CG-CZ 4.18Å; F271-T301 VanDerWaalsContact CZ-O 3.3Å; F271-T301 WeakPolarHBondContact CZ-O 3.49Å; F271-L303 HydrophobicContact CE1-CD1 4.17Å; F271-L303 HydrophobicContact CZ-CB 4.36Å; F271-L303 HydrophobicContact CZ-CD1 4.21Å; F271-A306 HydrophobicContact CD1-CB 4.26Å; F271-A306 HydrophobicContact CE1-CB 3.65Å; F271-R377 PolarHBondContact O-NE 3.04Å
272	N	89.9	Confident	87.6	Confident	13 Å²	13	41.4 Å²	41.4	7%	0.07	21%	0.211	C	C	.	.			trans	-85.3	83.6	172.8	-168.5	4.5	0	0	0	111.9	V270 T274 H275 E357 L359 R377	V270-N272 PolarHBondContact O-N 3.14Å; N272-T274 PolarHBondContact O-N 3.08Å; N272-T274 PolarHBondContact OD1-N 2.89Å; N272-T274 PolarHBondContact OD1-OG1 3.2Å; N272-H275 HydrophobicContact CB-CB 4.46Å; N272-H275 WeakPolarHBondContact O-CB 3.35Å; N272-H275 PolarHBondContact O-N 2.89Å; N272-E357 PolarHBondContact ND2-OE2 3.08Å; N272-L359 PolarHBondContact N-O 3.35Å; N272-R377 PolarHBondContact OD1-NH2 3.39Å
273	K	85.9	Confident	88.8	Confident	109 Å²	109	42.7 Å²	42.7	47%	0.474	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-13.6	176.4	-63.4	-173.4	-179.6	-178.5	0	114.8	F271 F278	F271-K273 PolarHBondContact O-N 2.85Å; F271-K273 VanDerWaalsContact O-N 3.14Å; K273-F278 HydrophobicContact CB-CE1 4.48Å; K273-F278 HydrophobicContact CG-CD1 4.49Å; K273-F278 HydrophobicContact CG-CE1 3.98Å; K273-F278 HydrophobicContact CG-CZ 4.37Å
274	T	87.6	Confident	89.4	Confident	111 Å²	111	43.8 Å²	43.8	68%	0.681	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-9.4	177.6	69.5	0	0	0	0	113.4	N272	N272-T274 PolarHBondContact O-N 3.08Å; N272-T274 PolarHBondContact OD1-N 2.89Å; N272-T274 PolarHBondContact OD1-OG1 3.2Å
275	H	89.1	Confident	89.7	Confident	44 Å²	44	43 Å²	43	20%	0.204	23%	0.228	C	C	.	.	S	Bend	trans	-65.7	130.6	179.1	-179	-93.1	0	0	0	110.8	N272 F277 F278	N272-H275 HydrophobicContact CB-CB 4.46Å; N272-H275 WeakPolarHBondContact O-CB 3.35Å; N272-H275 PolarHBondContact O-N 2.89Å; H275-F277 VanDerWaalsContact C-N 3.28Å; H275-F277 PolarHBondContact ND1-N 2.73Å; H275-F277 PolarHBondContact O-N 2.8Å; H275-F277 VanDerWaalsContact O-N 3.12Å; H275-F278 HydrophobicContact CB-CB 4.28Å; H275-F278 WeakPolarHBondContact O-CB 3.41Å; H275-F278 PolarHBondContact O-N 3.03Å
276	P	88	Confident	89.6	Confident	122 Å²	122	45.2 Å²	45.2	79%	0.792	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-36.2	-170.7	-28.6	35.4	0	0	0	115.1	F278	P276-F278 VanDerWaalsContact C-N 3.35Å
277	F	89.5	Confident	89.4	Confident	24 Å²	24	53 Å²	53	11%	0.105	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-7.8	179.8	-165.3	-109.2	0	0	0	113.6	H275 Q279 E280 F281 F309	H275-F277 VanDerWaalsContact C-N 3.28Å; H275-F277 PolarHBondContact ND1-N 2.73Å; H275-F277 PolarHBondContact O-N 2.8Å; H275-F277 VanDerWaalsContact O-N 3.12Å; F277-Q279 PolarHBondContact O-N 3.42Å; F277-E280 HydrophobicContact CD2-CB 4.12Å; F277-E280 HydrophobicContact CD2-CG 4.43Å; F277-E280 WeakPolarHBondContact CD2-OE2 3.22Å; F277-E280 HydrophobicContact CE2-CB 4.13Å; F277-E280 VanDerWaalsContact CE2-CD 3.42Å; F277-E280 HydrophobicContact CE2-CG 3.97Å; F277-E280 WeakPolarHBondContact CE2-OE2 3.44Å; F277-E280 PolarHBondContact O-N 2.93Å; F277-F281 HydrophobicContact CD1-CB 4.09Å; F277-F281 HydrophobicContact CE1-CB 4.11Å; F277-F281 HydrophobicContact CE1-CD2 4.33Å; F277-F281 WeakPolarHBondContact O-CB 3.44Å; F277-F281 PolarHBondContact O-N 3.49Å; F277-F309 HydrophobicContact CD1-CE1 4.37Å; F277-F309 AromaticContact CD1-CE2 3.93Å; F277-F309 HydrophobicContact CD1-CE2 3.93Å; F277-F309 AromaticContact CD1-CZ 3.53Å; F277-F309 HydrophobicContact CD1-CZ 3.53Å; F277-F309 AromaticContact CE1-CE2 3.52Å; F277-F309 HydrophobicContact CE1-CE2 3.52Å; F277-F309 AromaticContact CE1-CZ 3.62Å; F277-F309 HydrophobicContact CE1-CZ 3.62Å
278	F	90.8	Very high	89	Confident	19 Å²	19	54.2 Å²	54.2	8%	0.083	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-41.9	-173.1	-173.2	-92.3	0	0	0	112.5	F271 K273 H275 P276 F281 V282 L359	F271-F278 HydrophobicContact CB-CE2 3.8Å; F271-F278 HydrophobicContact CB-CZ 3.9Å; F271-F278 AromaticContact CD1-CE2 3.87Å; F271-F278 HydrophobicContact CD1-CE2 3.87Å; F271-F278 HydrophobicContact CD1-CZ 4.38Å; F271-F278 HydrophobicContact CG-CE2 4.05Å; F271-F278 HydrophobicContact CG-CZ 4.18Å; K273-F278 HydrophobicContact CB-CE1 4.48Å; K273-F278 HydrophobicContact CG-CD1 4.49Å; K273-F278 HydrophobicContact CG-CE1 3.98Å; K273-F278 HydrophobicContact CG-CZ 4.37Å; H275-F278 HydrophobicContact CB-CB 4.28Å; H275-F278 WeakPolarHBondContact O-CB 3.41Å; H275-F278 PolarHBondContact O-N 3.03Å; P276-F278 VanDerWaalsContact C-N 3.35Å; F278-F281 PolarHBondContact O-N 2.95Å; F278-V282 HydrophobicContact CD1-CG2 4.01Å; F278-V282 HydrophobicContact CE1-CG2 3.64Å; F278-V282 HydrophobicContact CZ-CG2 3.99Å; F278-V282 WeakPolarHBondContact O-CG2 3.15Å; F278-V282 PolarHBondContact O-N 2.93Å; F278-L359 HydrophobicContact CB-CD2 4.26Å; F278-L359 HydrophobicContact CD2-CD2 4.16Å
279	Q	89.8	Confident	88.5	Confident	144 Å²	144	56.5 Å²	56.5	67%	0.673	29%	0.286	S	S	*	.	H	α-helix	trans	-66.1	-42.8	177.6	-66.2	-174.5	-4	0	0	112.2	F277 F281 V282 L283	F277-Q279 PolarHBondContact O-N 3.42Å; Q279-F281 VanDerWaalsContact C-N 3.33Å; Q279-F281 PolarHBondContact O-N 3.31Å; Q279-V282 PolarHBondContact O-N 2.98Å; Q279-L283 WeakPolarHBondContact O-CB 3.15Å; Q279-L283 VanDerWaalsContact O-CG 3.27Å; Q279-L283 WeakPolarHBondContact O-CG 3.16Å; Q279-L283 PolarHBondContact O-N 3.36Å
280	E	89.9	Confident	88	Confident	112 Å²	112	61.6 Å²	61.6	52%	0.523	31%	0.309	S	S	.	.	H	α-helix	trans	-64.8	-38	177	-170.6	179.3	168.6	0	0	111.7	F277 L283 S284	F277-E280 HydrophobicContact CD2-CB 4.12Å; F277-E280 HydrophobicContact CD2-CG 4.43Å; F277-E280 WeakPolarHBondContact CD2-OE2 3.22Å; F277-E280 HydrophobicContact CE2-CB 4.13Å; F277-E280 VanDerWaalsContact CE2-CD 3.42Å; F277-E280 HydrophobicContact CE2-CG 3.97Å; F277-E280 WeakPolarHBondContact CE2-OE2 3.44Å; F277-E280 PolarHBondContact O-N 2.93Å; E280-L283 PolarHBondContact O-N 3.18Å; E280-S284 VanDerWaalsContact O-CB 3.3Å; E280-S284 WeakPolarHBondContact O-CB 3.46Å; E280-S284 PolarHBondContact O-N 3.4Å; E280-S284 PolarHBondContact O-OG 3.44Å
281	F	90.7	Very high	87.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.2	-49.2	174.7	-179.3	-103.2	0	0	0	112.2	A44 L47 F277 F278 Q279 L283 S284 L285 A306 F309 L359	A44-F281 HydrophobicContact CB-CE2 3.75Å; A44-F281 HydrophobicContact CB-CZ 4.02Å; L47-F281 HydrophobicContact CD1-CD2 4.12Å; F277-F281 HydrophobicContact CD1-CB 4.09Å; F277-F281 HydrophobicContact CE1-CB 4.11Å; F277-F281 HydrophobicContact CE1-CD2 4.33Å; F277-F281 WeakPolarHBondContact O-CB 3.44Å; F277-F281 PolarHBondContact O-N 3.49Å; F278-F281 PolarHBondContact O-N 2.95Å; Q279-F281 VanDerWaalsContact C-N 3.33Å; Q279-F281 PolarHBondContact O-N 3.31Å; F281-L283 PolarHBondContact O-N 2.91Å; F281-S284 PolarHBondContact O-N 3.28Å; F281-L285 HydrophobicContact CD1-CD1 3.81Å; F281-L285 HydrophobicContact CE1-CD1 3.38Å; F281-L285 HydrophobicContact CE2-CD1 4.27Å; F281-L285 HydrophobicContact CG-CD1 4.43Å; F281-L285 HydrophobicContact CZ-CD1 3.65Å; F281-L285 PolarHBondContact O-N 3.04Å; F281-A306 HydrophobicContact CE1-CB 4.33Å; F281-F309 HydrophobicContact CD2-CD2 4.23Å; F281-F309 HydrophobicContact CE2-CB 4.29Å; F281-F309 HydrophobicContact CE2-CD2 4.04Å; F281-F309 HydrophobicContact CE2-CG 4.34Å; F281-L359 HydrophobicContact CB-CD1 4.32Å; F281-L359 HydrophobicContact CD1-CD1 3.72Å; F281-L359 HydrophobicContact CD2-CD1 3.72Å; F281-L359 HydrophobicContact CE1-CD1 3.8Å; F281-L359 HydrophobicContact CE2-CD1 3.81Å; F281-L359 HydrophobicContact CG-CD1 3.66Å; F281-L359 HydrophobicContact CZ-CD1 3.84Å
282	V	89.6	Confident	86.8	Confident	43 Å²	43	71.3 Å²	71.3	26%	0.261	36%	0.357	S	S	.	.	H	α-helix	trans	-59.5	-45.3	176	175.3	0	0	0	0	111.1	F278 Q279 L285 N286 T301	F278-V282 HydrophobicContact CD1-CG2 4.01Å; F278-V282 HydrophobicContact CE1-CG2 3.64Å; F278-V282 HydrophobicContact CZ-CG2 3.99Å; F278-V282 WeakPolarHBondContact O-CG2 3.15Å; F278-V282 PolarHBondContact O-N 2.93Å; Q279-V282 PolarHBondContact O-N 2.98Å; V282-L285 PolarHBondContact O-N 3.34Å; V282-N286 WeakPolarHBondContact O-CB 3.29Å; V282-N286 PolarHBondContact O-N 3.28Å; V282-T301 HydrophobicContact CB-CG2 4.21Å; V282-T301 HydrophobicContact CG1-CG2 4.29Å; V282-T301 HydrophobicContact CG2-CG2 3.65Å
283	L	89.6	Confident	86.1	Confident	115 Å²	115	71 Å²	71	60%	0.602	36%	0.356	S	S	*	.	H	α-helix	trans	-64.7	-39.7	178.8	-72.3	170.1	0	0	0	112.2	Q279 E280 F281 N286 R287	Q279-L283 WeakPolarHBondContact O-CB 3.15Å; Q279-L283 VanDerWaalsContact O-CG 3.27Å; Q279-L283 WeakPolarHBondContact O-CG 3.16Å; Q279-L283 PolarHBondContact O-N 3.36Å; E280-L283 PolarHBondContact O-N 3.18Å; F281-L283 PolarHBondContact O-N 2.91Å; L283-N286 PolarHBondContact O-N 2.75Å; L283-R287 WeakPolarHBondContact O-CB 3.49Å; L283-R287 PolarHBondContact O-N 2.88Å
284	S	88.8	Confident	85.2	Confident	32 Å²	32	72.7 Å²	72.7	22%	0.224	37%	0.37	C	S	.	.	H	α-helix	trans	-65.3	-42	177.1	-60.5	0	0	0	0	111.8	E280 F281 S288	E280-S284 VanDerWaalsContact O-CB 3.3Å; E280-S284 WeakPolarHBondContact O-CB 3.46Å; E280-S284 PolarHBondContact O-N 3.4Å; E280-S284 PolarHBondContact O-OG 3.44Å; F281-S284 PolarHBondContact O-N 3.28Å; S284-S288 WeakPolarHBondContact O-CB 3.49Å; S284-S288 PolarHBondContact O-N 2.87Å
285	L	86.9	Confident	84.4	Confident	6 Å²	6	76.4 Å²	76.4	3%	0.031	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-48.7	174.2	-78.1	168.1	0	0	0	111.9	L43 F281 V282 R287 S288 W289 F298 T301	L43-L285 HydrophobicContact CD2-CD2 3.97Å; L43-L285 HydrophobicContact CD2-CG 4.39Å; F281-L285 HydrophobicContact CD1-CD1 3.81Å; F281-L285 HydrophobicContact CE1-CD1 3.38Å; F281-L285 HydrophobicContact CE2-CD1 4.27Å; F281-L285 HydrophobicContact CG-CD1 4.43Å; F281-L285 HydrophobicContact CZ-CD1 3.65Å; F281-L285 PolarHBondContact O-N 3.04Å; V282-L285 PolarHBondContact O-N 3.34Å; L285-R287 VanDerWaalsContact C-N 3.31Å; L285-R287 PolarHBondContact O-N 3.02Å; L285-S288 PolarHBondContact O-N 3.36Å; L285-W289 WeakPolarHBondContact O-CB 3.29Å; L285-W289 PolarHBondContact O-N 2.69Å; L285-F298 HydrophobicContact CB-CE2 4.19Å; L285-F298 HydrophobicContact CB-CZ 3.95Å; L285-T301 HydrophobicContact CD1-CG2 3.75Å
286	N	87.8	Confident	83.5	Confident	47 Å²	47	76.2 Å²	76.2	25%	0.251	39%	0.386	S	S	.	.	H	α-helix	trans	-59.6	-41.8	178.2	-175	13	0	0	0	111.6	V282 L283 W289 Q290 F298	V282-N286 WeakPolarHBondContact O-CB 3.29Å; V282-N286 PolarHBondContact O-N 3.28Å; L283-N286 PolarHBondContact O-N 2.75Å; N286-W289 WeakPolarHBondContact O-CB 3.46Å; N286-W289 PolarHBondContact O-N 2.65Å; N286-Q290 WeakPolarHBondContact O-CG 3.41Å; N286-Q290 PolarHBondContact O-N 3.41Å; N286-Q290 PolarHBondContact OD1-NE2 2.96Å; N286-F298 HydrophobicContact CB-CD1 3.84Å; N286-F298 HydrophobicContact CB-CE1 3.92Å; N286-F298 HydrophobicContact CB-CG 4.24Å; N286-F298 HydrophobicContact CB-CZ 4.38Å
287	R	86	Confident	82.7	Confident	163 Å²	163	74.9 Å²	74.9	62%	0.615	38%	0.377	S	S	*	.	H	α-helix	trans	-64.2	-48	176.2	-178.9	177.7	175	153.3	7.9	112.4	L283 L285 W289 Q290 E291	L283-R287 WeakPolarHBondContact O-CB 3.49Å; L283-R287 PolarHBondContact O-N 2.88Å; L285-R287 VanDerWaalsContact C-N 3.31Å; L285-R287 PolarHBondContact O-N 3.02Å; R287-W289 PolarHBondContact O-N 3.39Å; R287-Q290 PolarHBondContact O-N 3.17Å; R287-E291 IonicContact CZ-OE1 3.43Å; R287-E291 IonicContact NE-OE1 2.77Å; R287-E291 PolarHBondContact NE-OE1 3.25Å; R287-E291 IonicContact NH2-OE1 3.17Å; R287-E291 PolarHBondContact NH2-OE1 2.91Å; R287-E291 VanDerWaalsContact NH2-OE1 3.17Å; R287-E291 WeakPolarHBondContact O-CG 3.45Å; R287-E291 PolarHBondContact O-N 2.85Å
288	S	83.4	Confident	82.2	Confident	25 Å²	25	75.6 Å²	75.6	18%	0.175	38%	0.38	C	S	.	.	H	α-helix	trans	-65	-28.9	176.8	-174.1	0	0	0	0	112.5	S284 L285 N292	S284-S288 WeakPolarHBondContact O-CB 3.49Å; S284-S288 PolarHBondContact O-N 2.87Å; L285-S288 PolarHBondContact O-N 3.36Å; S288-N292 WeakPolarHBondContact O-CB 3.3Å; S288-N292 VanDerWaalsContact O-CG 3.31Å; S288-N292 PolarHBondContact O-N 2.97Å; S288-N292 PolarHBondContact O-ND2 3.06Å
289	W	81.6	Confident	81.2	Confident	49 Å²	49	77 Å²	77	19%	0.186	40%	0.395	C	S	.	.	H	α-helix	trans	-68.2	-47.9	172.2	-170.9	-82.9	0	0	0	110.7	C37 S38 L285 N286 R287 E291 N292 C293 A296 F298	C37-W289 HydrophobicContact CB-CH2 3.91Å; C37-W289 HydrophobicContact CB-CZ2 4.19Å; C37-W289 HydrophobicContact CB-CZ3 4.35Å; S38-W289 VanDerWaalsContact O-CZ3 3.31Å; S38-W289 WeakPolarHBondContact O-CZ3 3.28Å; L285-W289 WeakPolarHBondContact O-CB 3.29Å; L285-W289 PolarHBondContact O-N 2.69Å; N286-W289 WeakPolarHBondContact O-CB 3.46Å; N286-W289 PolarHBondContact O-N 2.65Å; R287-W289 PolarHBondContact O-N 3.39Å; W289-E291 VanDerWaalsContact C-N 3.33Å; W289-E291 PolarHBondContact O-N 2.84Å; W289-N292 PolarHBondContact O-N 3.16Å; W289-C293 HydrophobicContact CD2-CB 4.3Å; W289-C293 HydrophobicContact CG-CB 4.25Å; W289-C293 HydrophobicContact CZ2-CB 4.46Å; W289-C293 WeakPolarHBondContact O-CA 3.09Å; W289-C293 WeakPolarHBondContact O-CB 3.23Å; W289-C293 PolarHBondContact O-N 3.03Å; W289-A296 PolarHBondContact NE1-O 2.74Å; W289-F298 HydrophobicContact CB-CD2 3.66Å; W289-F298 HydrophobicContact CB-CE2 4.29Å; W289-F298 HydrophobicContact CB-CG 4.45Å; W289-F298 AromaticContact CD2-CD2 3.89Å; W289-F298 HydrophobicContact CD2-CD2 3.89Å; W289-F298 HydrophobicContact CE3-CD2 4.28Å; W289-F298 HydrophobicContact CG-CB 4.16Å; W289-F298 AromaticContact CG-CD2 3.6Å; W289-F298 HydrophobicContact CG-CD2 3.6Å; W289-F298 HydrophobicContact CG-CG 4.35Å
290	Q	81.6	Confident	80.7	Confident	108 Å²	108	71.1 Å²	71.1	51%	0.505	37%	0.373	S	S	.	.	H	α-helix	trans	-58.1	-44.9	175	-70.4	168.4	15.3	0	0	111.8	N286 R287 N292	N286-Q290 WeakPolarHBondContact O-CG 3.41Å; N286-Q290 PolarHBondContact O-N 3.41Å; N286-Q290 PolarHBondContact OD1-NE2 2.96Å; R287-Q290 PolarHBondContact O-N 3.17Å; Q290-N292 PolarHBondContact O-N 2.93Å
291	E	80.6	Confident	80.4	Confident	122 Å²	122	66.4 Å²	66.4	57%	0.57	35%	0.352	S	S	*	.	H	α-helix	trans	-64.7	-20.8	180	-71.2	173.1	-177.7	0	0	113.7	R287 W289	R287-E291 IonicContact CZ-OE1 3.43Å; R287-E291 IonicContact NE-OE1 2.77Å; R287-E291 PolarHBondContact NE-OE1 3.25Å; R287-E291 IonicContact NH2-OE1 3.17Å; R287-E291 PolarHBondContact NH2-OE1 2.91Å; R287-E291 VanDerWaalsContact NH2-OE1 3.17Å; R287-E291 WeakPolarHBondContact O-CG 3.45Å; R287-E291 PolarHBondContact O-N 2.85Å; W289-E291 VanDerWaalsContact C-N 3.33Å; W289-E291 PolarHBondContact O-N 2.84Å
292	N	76.1	Confident	80.3	Confident	90 Å²	90	67.1 Å²	67.1	48%	0.481	36%	0.357	S	S	.	.	H	α-helix	trans	-111.9	-17.5	-179.7	-64.2	-19.9	0	0	0	114.4	S288 W289 Q290	S288-N292 WeakPolarHBondContact O-CB 3.3Å; S288-N292 VanDerWaalsContact O-CG 3.31Å; S288-N292 PolarHBondContact O-N 2.97Å; S288-N292 PolarHBondContact O-ND2 3.06Å; W289-N292 PolarHBondContact O-N 3.16Å; Q290-N292 PolarHBondContact O-N 2.93Å
293	C	74.5	Confident	80.3	Confident	6 Å²	6	65.1 Å²	65.1	4%	0.041	35%	0.345	C	S	.	.			trans	-141.3	52.3	-163.2	-57.6	0	0	0	0	113.6	C37 W289 H295 A296	C37-C293 WeakPolarHBondContact CA-SG 3.45Å; C37-C293 HydrophobicContact CB-CB 4.32Å; C37-C293 WeakPolarHBondContact CB-SG 3.37Å; C37-C293 WeakPolarHBondContact SG-CB 3.47Å; C37-C293 CovalentContact SG-SG 2.03Å; C37-C293 PolarHBondContact SG-SG 3.21Å; W289-C293 HydrophobicContact CD2-CB 4.3Å; W289-C293 HydrophobicContact CG-CB 4.25Å; W289-C293 HydrophobicContact CZ2-CB 4.46Å; W289-C293 WeakPolarHBondContact O-CA 3.09Å; W289-C293 WeakPolarHBondContact O-CB 3.23Å; W289-C293 PolarHBondContact O-N 3.03Å; C293-H295 PolarHBondContact O-N 3.12Å; C293-A296 PolarHBondContact O-N 2.86Å; C293-A296 VanDerWaalsContact O-N 3.12Å
294	D	68.1	Low	80.3	Confident	145 Å²	145	60 Å²	60	78%	0.775	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-26.7	176.9	-75.9	-42.3	0	0	0	114.3
295	H	70.9	Confident	80.4	Confident	189 Å²	189	58.5 Å²	58.5	88%	0.875	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.7	-174.9	-56.6	93.5	0	0	0	114.8	C293	C293-H295 PolarHBondContact O-N 3.12Å
296	A	68.8	Low	80.7	Confident	40 Å²	40	58.2 Å²	58.2	33%	0.331	31%	0.306	S	S	.	.	S	Bend	trans	-135.2	120.1	-171.7	0	0	0	0	0	111.8	W289 C293 F298	W289-A296 PolarHBondContact NE1-O 2.74Å; C293-A296 PolarHBondContact O-N 2.86Å; C293-A296 VanDerWaalsContact O-N 3.12Å; A296-F298 PolarHBondContact O-N 3.47Å
297	P	72.7	Confident	81	Confident	93 Å²	93	56 Å²	56	60%	0.604	29%	0.294	S	S	*	.			trans	-68.3	134	-178.8	29	-36.1	0	0	0	111.2	R254 A299	R254-P297 VanDerWaalsContact NH1-CG 3.31Å; R254-P297 VanDerWaalsContact NH2-C 3.33Å; R254-P297 PolarHBondContact NH2-O 2.79Å; P297-A299 PolarHBondContact O-N 2.7Å
298	F	77.2	Confident	81.3	Confident	40 Å²	40	48.2 Å²	48.2	18%	0.175	27%	0.265	C	S	.	.			trans	-48.3	120.3	-177.2	-179.2	-119.3	0	0	0	113.1	R254 L285 N286 W289 A296 G300 T301	R254-F298 PolarHBondContact NH2-O 2.97Å; L285-F298 HydrophobicContact CB-CE2 4.19Å; L285-F298 HydrophobicContact CB-CZ 3.95Å; N286-F298 HydrophobicContact CB-CD1 3.84Å; N286-F298 HydrophobicContact CB-CE1 3.92Å; N286-F298 HydrophobicContact CB-CG 4.24Å; N286-F298 HydrophobicContact CB-CZ 4.38Å; W289-F298 HydrophobicContact CB-CD2 3.66Å; W289-F298 HydrophobicContact CB-CE2 4.29Å; W289-F298 HydrophobicContact CB-CG 4.45Å; W289-F298 AromaticContact CD2-CD2 3.89Å; W289-F298 HydrophobicContact CD2-CD2 3.89Å; W289-F298 HydrophobicContact CE3-CD2 4.28Å; W289-F298 HydrophobicContact CG-CB 4.16Å; W289-F298 AromaticContact CG-CD2 3.6Å; W289-F298 HydrophobicContact CG-CD2 3.6Å; W289-F298 HydrophobicContact CG-CG 4.35Å; A296-F298 PolarHBondContact O-N 3.47Å; F298-G300 VanDerWaalsContact C-N 3.33Å; F298-G300 VanDerWaalsContact CE2-O 3.25Å; F298-G300 WeakPolarHBondContact CE2-O 3.11Å; F298-G300 VanDerWaalsContact CZ-C 3.41Å; F298-G300 WeakPolarHBondContact CZ-O 3.41Å; F298-G300 PolarHBondContact O-N 3.23Å; F298-T301 HydrophobicContact CZ-CG2 4.37Å
299	A	70.3	Confident	81.8	Confident	49 Å²	49	47.3 Å²	47.3	41%	0.405	26%	0.258	S	S	.	.			trans	-75.8	-19.3	-174.7	0	0	0	0	0	113.8	P297	P297-A299 PolarHBondContact O-N 2.7Å
300	G	79.3	Confident	82.4	Confident	20 Å²	20	45.1 Å²	45.1	21%	0.206	25%	0.25	C	C	.	.			trans	125.4	-175	-172.6	0	0	0	0	0	111.1	F298 P302	F298-G300 VanDerWaalsContact C-N 3.33Å; F298-G300 VanDerWaalsContact CE2-O 3.25Å; F298-G300 WeakPolarHBondContact CE2-O 3.11Å; F298-G300 VanDerWaalsContact CZ-C 3.41Å; F298-G300 WeakPolarHBondContact CZ-O 3.41Å; F298-G300 PolarHBondContact O-N 3.23Å; G300-P302 WeakPolarHBondContact O-CD 3.16Å
301	T	84.8	Confident	83	Confident	13 Å²	13	40 Å²	40	8%	0.08	23%	0.226	C	C	.	.			trans	-85.6	117.2	-179.4	49.7	0	0	0	0	112	F271 V282 L285 F298	F271-T301 VanDerWaalsContact CZ-O 3.3Å; F271-T301 WeakPolarHBondContact CZ-O 3.49Å; V282-T301 HydrophobicContact CB-CG2 4.21Å; V282-T301 HydrophobicContact CG1-CG2 4.29Å; V282-T301 HydrophobicContact CG2-CG2 3.65Å; L285-T301 HydrophobicContact CD1-CG2 3.75Å; F298-T301 HydrophobicContact CZ-CG2 4.37Å
302	P	87.5	Confident	83.7	Confident	15 Å²	15	34.1 Å²	34.1	10%	0.097	20%	0.198	C	C	.	.			trans	-66.2	148.7	174.4	-23.5	38.3	0	0	0	111.8	R39 G300	R39-P302 HydrophobicContact CB-CB 4.35Å; R39-P302 HydrophobicContact CB-CG 4.16Å; R39-P302 WeakPolarHBondContact O-CG 3.48Å; G300-P302 WeakPolarHBondContact O-CD 3.16Å
303	L	90.3	Very high	84.4	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-70.4	-38.6	-176.9	178.9	61.6	0	0	0	111.5	L248 E249 V270 F271 S305 A306 L307 T360	L248-L303 HydrophobicContact CB-CD2 3.6Å; L248-L303 HydrophobicContact CD1-CD2 3.86Å; L248-L303 HydrophobicContact CG-CD2 4.41Å; E249-L303 HydrophobicContact CG-CB 3.9Å; E249-L303 PolarHBondContact OE1-N 3.03Å; V270-L303 HydrophobicContact CB-CD1 4.45Å; V270-L303 HydrophobicContact CG2-CD1 4.36Å; F271-L303 HydrophobicContact CE1-CD1 4.17Å; F271-L303 HydrophobicContact CZ-CB 4.36Å; F271-L303 HydrophobicContact CZ-CD1 4.21Å; L303-S305 VanDerWaalsContact C-N 3.31Å; L303-S305 PolarHBondContact O-N 3.07Å; L303-A306 PolarHBondContact O-N 2.81Å; L303-A306 VanDerWaalsContact O-N 3.15Å; L303-L307 HydrophobicContact CD1-CD1 4.32Å; L303-L307 HydrophobicContact CD1-CG 4.11Å; L303-L307 HydrophobicContact CD2-CD1 4.33Å; L303-L307 HydrophobicContact CG-CD1 3.83Å; L303-L307 HydrophobicContact CG-CG 4.11Å; L303-L307 WeakPolarHBondContact O-CG 3.38Å; L303-L307 PolarHBondContact O-N 3.14Å; L303-T360 HydrophobicContact CD1-CG2 4.12Å
304	S	90.3	Very high	85.3	Confident	7 Å²	7	32.6 Å²	32.6	5%	0.049	19%	0.186	C	C	.	.	H	α-helix	trans	-54.9	-44.4	178.4	56.2	0	0	0	0	112.6	E41 A306 L307 L308	E41-S304 WeakPolarHBondContact OE1-CB 3.39Å; E41-S304 PolarHBondContact OE1-OG 2.82Å; S304-A306 PolarHBondContact O-N 3.15Å; S304-L307 PolarHBondContact O-N 3.12Å; S304-L308 WeakPolarHBondContact O-CB 3.42Å; S304-L308 WeakPolarHBondContact O-CG 3.33Å; S304-L308 PolarHBondContact O-N 3.16Å
305	S	90.9	Very high	86.4	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-39.3	178	-66	0	0	0	0	113.2	R39 G40 E41 A44 L303 F309	R39-S305 PolarHBondContact O-OG 2.88Å; G40-S305 VanDerWaalsContact C-OG 3.3Å; E41-S305 WeakPolarHBondContact CA-OG 3.43Å; E41-S305 WeakPolarHBondContact CG-OG 3.45Å; E41-S305 PolarHBondContact N-OG 3.25Å; E41-S305 VanDerWaalsContact N-OG 3.16Å; A44-S305 WeakPolarHBondContact CB-O 3.26Å; L303-S305 VanDerWaalsContact C-N 3.31Å; L303-S305 PolarHBondContact O-N 3.07Å; S305-F309 PolarHBondContact O-N 2.82Å; S305-F309 VanDerWaalsContact O-N 3.15Å
306	A	92.6	Very high	87.3	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-73.7	-40	175.4	0	0	0	0	0	112.3	F271 F281 L303 S304 L308 F309 D310 L359 T360	F271-A306 HydrophobicContact CD1-CB 4.26Å; F271-A306 HydrophobicContact CE1-CB 3.65Å; F281-A306 HydrophobicContact CE1-CB 4.33Å; L303-A306 PolarHBondContact O-N 2.81Å; L303-A306 VanDerWaalsContact O-N 3.15Å; S304-A306 PolarHBondContact O-N 3.15Å; A306-L308 VanDerWaalsContact C-N 3.33Å; A306-L308 PolarHBondContact O-N 3.4Å; A306-F309 WeakPolarHBondContact O-CB 3.47Å; A306-F309 PolarHBondContact O-N 3.4Å; A306-D310 PolarHBondContact O-N 3.2Å; A306-L359 HydrophobicContact CB-CB 4.22Å; A306-T360 HydrophobicContact CB-CG2 3.94Å
307	L	93.5	Very high	88.3	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62	-39.2	175.4	-67.6	174.1	0	0	0	111.7	V121 L139 R140 L303 S304 D310 A311 T360	V121-L307 HydrophobicContact CB-CB 3.95Å; V121-L307 HydrophobicContact CB-CD1 4.26Å; V121-L307 HydrophobicContact CG1-CB 3.74Å; L139-L307 HydrophobicContact CB-CD2 4.11Å; L139-L307 WeakPolarHBondContact O-CD2 3.37Å; R140-L307 HydrophobicContact CB-CD1 4.39Å; R140-L307 HydrophobicContact CG-CD1 4.45Å; L303-L307 HydrophobicContact CD1-CD1 4.32Å; L303-L307 HydrophobicContact CD1-CG 4.11Å; L303-L307 HydrophobicContact CD2-CD1 4.33Å; L303-L307 HydrophobicContact CG-CD1 3.83Å; L303-L307 HydrophobicContact CG-CG 4.11Å; L303-L307 WeakPolarHBondContact O-CG 3.38Å; L303-L307 PolarHBondContact O-N 3.14Å; S304-L307 PolarHBondContact O-N 3.12Å; L307-D310 PolarHBondContact O-N 2.64Å; L307-A311 VanDerWaalsContact O-CB 3.28Å; L307-A311 WeakPolarHBondContact O-CB 3.04Å; L307-A311 PolarHBondContact O-N 2.95Å; L307-T360 HydrophobicContact CD2-CG2 3.91Å; L307-T360 HydrophobicContact CG-CG2 4.43Å
308	L	93.3	Very high	89.1	Confident	1 Å²	1	12 Å²	12	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-70.4	-33.7	175.9	-74.2	168.7	0	0	0	113	L31 E41 I45 L95 V121 S304 A306 V312	L31-L308 HydrophobicContact CD2-CD1 3.84Å; E41-L308 HydrophobicContact CB-CD1 3.66Å; E41-L308 HydrophobicContact CG-CD1 3.81Å; I45-L308 HydrophobicContact CD1-CB 4.39Å; I45-L308 HydrophobicContact CD1-CD1 4.3Å; I45-L308 HydrophobicContact CD1-CD2 4.48Å; I45-L308 HydrophobicContact CG1-CB 4.11Å; L95-L308 HydrophobicContact CB-CD2 4.09Å; L95-L308 HydrophobicContact CD1-CD2 4.41Å; V121-L308 HydrophobicContact CG1-CD2 3.99Å; V121-L308 HydrophobicContact CG1-CG 4.22Å; V121-L308 HydrophobicContact CG2-CD2 3.93Å; V121-L308 HydrophobicContact CG2-CG 4.05Å; S304-L308 WeakPolarHBondContact O-CB 3.42Å; S304-L308 WeakPolarHBondContact O-CG 3.33Å; S304-L308 PolarHBondContact O-N 3.16Å; A306-L308 VanDerWaalsContact C-N 3.33Å; A306-L308 PolarHBondContact O-N 3.4Å; L308-V312 WeakPolarHBondContact O-CG2 3.36Å; L308-V312 PolarHBondContact O-N 2.81Å
309	F	93.5	Very high	89.6	Confident	6 Å²	6	10.3 Å²	10.3	3%	0.026	7%	0.069	C	C	.	.	H	α-helix	trans	-61.2	-52.2	170	-178.3	-85	0	0	0	110.3	A44 L47 A48 F277 F281 S305 A306 A311 V312 Y313 L359	A44-F309 HydrophobicContact CB-CB 4.34Å; L47-F309 HydrophobicContact CB-CE2 4.36Å; A48-F309 HydrophobicContact CB-CD2 3.71Å; A48-F309 HydrophobicContact CB-CE2 3.92Å; A48-F309 HydrophobicContact CB-CG 4.26Å; F277-F309 HydrophobicContact CD1-CE1 4.37Å; F277-F309 AromaticContact CD1-CE2 3.93Å; F277-F309 HydrophobicContact CD1-CE2 3.93Å; F277-F309 AromaticContact CD1-CZ 3.53Å; F277-F309 HydrophobicContact CD1-CZ 3.53Å; F277-F309 AromaticContact CE1-CE2 3.52Å; F277-F309 HydrophobicContact CE1-CE2 3.52Å; F277-F309 AromaticContact CE1-CZ 3.62Å; F277-F309 HydrophobicContact CE1-CZ 3.62Å; F281-F309 HydrophobicContact CD2-CD2 4.23Å; F281-F309 HydrophobicContact CE2-CB 4.29Å; F281-F309 HydrophobicContact CE2-CD2 4.04Å; F281-F309 HydrophobicContact CE2-CG 4.34Å; S305-F309 PolarHBondContact O-N 2.82Å; S305-F309 VanDerWaalsContact O-N 3.15Å; A306-F309 WeakPolarHBondContact O-CB 3.47Å; A306-F309 PolarHBondContact O-N 3.4Å; F309-A311 VanDerWaalsContact C-N 3.3Å; F309-A311 PolarHBondContact O-N 3.4Å; F309-V312 PolarHBondContact O-N 2.88Å; F309-Y313 HydrophobicContact CD1-CD2 4.04Å; F309-Y313 HydrophobicContact CD1-CE2 4.1Å; F309-Y313 AromaticContact CE1-CD2 3.75Å; F309-Y313 HydrophobicContact CE1-CD2 3.75Å; F309-Y313 AromaticContact CE1-CE2 3.44Å; F309-Y313 HydrophobicContact CE1-CE2 3.44Å; F309-Y313 VanDerWaalsContact CE1-CE2 3.44Å; F309-Y313 HydrophobicContact CE2-CE2 4.06Å; F309-Y313 HydrophobicContact CZ-CD2 4.19Å; F309-Y313 AromaticContact CZ-CE2 3.42Å; F309-Y313 HydrophobicContact CZ-CE2 3.42Å; F309-Y313 VanDerWaalsContact CZ-CE2 3.42Å; F309-Y313 WeakPolarHBondContact O-CD2 3.49Å; F309-Y313 PolarHBondContact O-N 3.29Å; F309-L359 HydrophobicContact CB-CD1 3.97Å; F309-L359 HydrophobicContact CD1-CD1 3.37Å; F309-L359 HydrophobicContact CD1-CG 3.66Å; F309-L359 HydrophobicContact CD2-CD1 4.2Å; F309-L359 HydrophobicContact CE1-CD1 3.8Å; F309-L359 HydrophobicContact CE1-CD2 4.45Å; F309-L359 HydrophobicContact CE1-CG 3.84Å; F309-L359 HydrophobicContact CG-CD1 3.59Å; F309-L359 HydrophobicContact CG-CG 4.38Å; F309-L359 HydrophobicContact CZ-CD1 4.39Å
310	D	94.4	Very high	90.3	Very high	2 Å²	2	11.2 Å²	11.2	1%	0.011	7%	0.065	C	C	.	.	H	α-helix	trans	-62.3	-36.3	179.6	-70.8	-10.8	0	0	0	111.7	A306 L307 V312 Y313 A314 G358 L359 T360 I363	A306-D310 PolarHBondContact O-N 3.2Å; L307-D310 PolarHBondContact O-N 2.64Å; D310-V312 PolarHBondContact O-N 2.82Å; D310-Y313 PolarHBondContact O-N 2.86Å; D310-Y313 VanDerWaalsContact O-N 3.17Å; D310-A314 PolarHBondContact O-N 3.32Å; D310-G358 WeakPolarHBondContact OD1-CA 3.48Å; D310-L359 PolarHBondContact OD1-N 3.48Å; D310-L359 PolarHBondContact OD2-N 3.45Å; D310-T360 WeakPolarHBondContact OD2-CB 3.45Å; D310-T360 PolarHBondContact OD2-N 3.4Å; D310-T360 PolarHBondContact OD2-OG1 2.89Å; D310-I363 HydrophobicContact CB-CD1 3.6Å
311	A	94.1	Very high	90.6	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.1	-41.9	176.1	0	0	0	0	0	113.4	L95 V119 L139 L307 F309 Y313 A314 V315	L95-A311 HydrophobicContact CD1-CB 4.36Å; L95-A311 HydrophobicContact CD2-CB 3.91Å; V119-A311 HydrophobicContact CG1-CB 3.93Å; L139-A311 HydrophobicContact CD1-CB 3.41Å; L139-A311 VanDerWaalsContact CD1-CB 3.41Å; L307-A311 VanDerWaalsContact O-CB 3.28Å; L307-A311 WeakPolarHBondContact O-CB 3.04Å; L307-A311 PolarHBondContact O-N 2.95Å; F309-A311 VanDerWaalsContact C-N 3.3Å; F309-A311 PolarHBondContact O-N 3.4Å; A311-Y313 VanDerWaalsContact C-N 3.31Å; A311-Y313 PolarHBondContact O-N 2.9Å; A311-A314 PolarHBondContact O-N 3.2Å; A311-V315 WeakPolarHBondContact O-CG2 3.41Å; A311-V315 PolarHBondContact O-N 3.49Å
312	V	93.6	Very high	90.7	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.4	-40.2	176.3	175.2	0	0	0	0	110.3	I45 A48 I52 L64 L95 L308 F309 D310 V316	I45-V312 HydrophobicContact CG1-CG2 4.49Å; I45-V312 HydrophobicContact CG2-CG2 4.44Å; A48-V312 HydrophobicContact CB-CB 3.89Å; A48-V312 HydrophobicContact CB-CG1 3.88Å; A48-V312 HydrophobicContact CB-CG2 4.37Å; I52-V312 HydrophobicContact CD1-CG1 3.85Å; L64-V312 HydrophobicContact CD2-CG1 3.92Å; L95-V312 HydrophobicContact CD1-CG2 3.73Å; L308-V312 WeakPolarHBondContact O-CG2 3.36Å; L308-V312 PolarHBondContact O-N 2.81Å; F309-V312 PolarHBondContact O-N 2.88Å; D310-V312 PolarHBondContact O-N 2.82Å; V312-V316 HydrophobicContact CG1-CG2 4.45Å; V312-V316 WeakPolarHBondContact O-CB 3.47Å; V312-V316 WeakPolarHBondContact O-CG2 3.26Å; V312-V316 PolarHBondContact O-N 3.1Å
313	Y	92.3	Very high	90.4	Very high	62 Å²	62	14.6 Å²	14.6	24%	0.243	7%	0.074	C	C	.	.	H	α-helix	trans	-66.8	-43.2	175.9	-84.3	-91.1	0	0	0	112.5	A48 N51 I52 F309 D310 A311 V315 V316 A317	A48-Y313 HydrophobicContact CB-CD2 4.25Å; A48-Y313 HydrophobicContact CB-CE2 3.92Å; N51-Y313 WeakPolarHBondContact CB-OH 3.43Å; N51-Y313 PolarHBondContact ND2-OH 3.3Å; I52-Y313 HydrophobicContact CD1-CD1 3.99Å; I52-Y313 HydrophobicContact CD1-CD2 4.04Å; I52-Y313 HydrophobicContact CD1-CE1 3.93Å; I52-Y313 HydrophobicContact CD1-CE2 3.94Å; I52-Y313 HydrophobicContact CD1-CG 4.06Å; I52-Y313 HydrophobicContact CG1-CD1 4.17Å; I52-Y313 HydrophobicContact CG1-CE1 3.62Å; I52-Y313 HydrophobicContact CG1-CE2 4.09Å; F309-Y313 HydrophobicContact CD1-CD2 4.04Å; F309-Y313 HydrophobicContact CD1-CE2 4.1Å; F309-Y313 AromaticContact CE1-CD2 3.75Å; F309-Y313 HydrophobicContact CE1-CD2 3.75Å; F309-Y313 AromaticContact CE1-CE2 3.44Å; F309-Y313 HydrophobicContact CE1-CE2 3.44Å; F309-Y313 VanDerWaalsContact CE1-CE2 3.44Å; F309-Y313 HydrophobicContact CE2-CE2 4.06Å; F309-Y313 HydrophobicContact CZ-CD2 4.19Å; F309-Y313 AromaticContact CZ-CE2 3.42Å; F309-Y313 HydrophobicContact CZ-CE2 3.42Å; F309-Y313 VanDerWaalsContact CZ-CE2 3.42Å; F309-Y313 WeakPolarHBondContact O-CD2 3.49Å; F309-Y313 PolarHBondContact O-N 3.29Å; D310-Y313 PolarHBondContact O-N 2.86Å; D310-Y313 VanDerWaalsContact O-N 3.17Å; A311-Y313 VanDerWaalsContact C-N 3.31Å; A311-Y313 PolarHBondContact O-N 2.9Å; Y313-V315 PolarHBondContact O-N 3.16Å; Y313-V316 PolarHBondContact O-N 2.85Å; Y313-A317 WeakPolarHBondContact O-CB 3.46Å; Y313-A317 PolarHBondContact O-N 2.83Å
314	A	92.5	Very high	90	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-60.1	-46.3	177.6	0	0	0	0	0	112.4	D310 A311 A317 A318 V354 L356	D310-A314 PolarHBondContact O-N 3.32Å; A311-A314 PolarHBondContact O-N 3.2Å; A314-A317 PolarHBondContact O-N 3.44Å; A314-A318 PolarHBondContact O-N 3.11Å; A314-A318 VanDerWaalsContact O-N 3.13Å; A314-V354 HydrophobicContact CB-CG1 4.46Å; A314-L356 HydrophobicContact CB-CD2 4.07Å
315	V	91.6	Very high	89.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-44.4	175.7	174.4	0	0	0	0	111.4	I27 A93 L95 V119 A311 Y313 A318 V319 L351	I27-V315 HydrophobicContact CD1-CB 4.02Å; I27-V315 HydrophobicContact CD1-CG1 3.58Å; I27-V315 HydrophobicContact CG1-CG1 4.12Å; A93-V315 HydrophobicContact CB-CB 4.46Å; A93-V315 HydrophobicContact CB-CG1 3.65Å; A93-V315 HydrophobicContact CB-CG2 3.88Å; L95-V315 HydrophobicContact CD2-CG2 4.37Å; V119-V315 HydrophobicContact CG2-CG2 3.9Å; A311-V315 WeakPolarHBondContact O-CG2 3.41Å; A311-V315 PolarHBondContact O-N 3.49Å; Y313-V315 PolarHBondContact O-N 3.16Å; V315-A318 PolarHBondContact O-N 3.12Å; V315-V319 HydrophobicContact CG1-CG2 4.31Å; V315-V319 WeakPolarHBondContact O-CB 3.41Å; V315-V319 VanDerWaalsContact O-CG2 3.28Å; V315-V319 WeakPolarHBondContact O-CG2 3.23Å; V315-V319 PolarHBondContact O-N 3.27Å; V315-L351 HydrophobicContact CG2-CD2 4.38Å
316	V	90.1	Very high	88.9	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.024	14%	0.144	C	C	.	.	H	α-helix	trans	-65.7	-39.2	-179.7	166.9	0	0	0	0	111.8	F25 I52 L64 V312 Y313 V319 Q320	F25-V316 HydrophobicContact CE2-CG2 4.08Å; F25-V316 HydrophobicContact CZ-CG2 4.42Å; I52-V316 HydrophobicContact CD1-CB 4.24Å; I52-V316 HydrophobicContact CD1-CG1 4.31Å; I52-V316 HydrophobicContact CD1-CG2 3.99Å; I52-V316 HydrophobicContact CG2-CG1 3.91Å; I52-V316 HydrophobicContact CG2-CG2 4.45Å; L64-V316 HydrophobicContact CD1-CG2 4.25Å; L64-V316 HydrophobicContact CD2-CG2 3.9Å; V312-V316 HydrophobicContact CG1-CG2 4.45Å; V312-V316 WeakPolarHBondContact O-CB 3.47Å; V312-V316 WeakPolarHBondContact O-CG2 3.26Å; V312-V316 PolarHBondContact O-N 3.1Å; Y313-V316 PolarHBondContact O-N 2.85Å; V316-V319 PolarHBondContact O-N 3.29Å; V316-Q320 HydrophobicContact CG1-CG 4.49Å; V316-Q320 VanDerWaalsContact CG1-NE2 3.26Å; V316-Q320 WeakPolarHBondContact O-CB 3.35Å; V316-Q320 VanDerWaalsContact O-CG 3.26Å; V316-Q320 WeakPolarHBondContact O-CG 3.26Å; V316-Q320 PolarHBondContact O-N 3.14Å
317	A	89.6	Confident	87.8	Confident	31 Å²	31	36.3 Å²	36.3	26%	0.256	18%	0.179	S	C	.	.	H	α-helix	trans	-62	-48	176	0	0	0	0	0	111.6	Y313 A314 V319 Q320 E321 V354	Y313-A317 WeakPolarHBondContact O-CB 3.46Å; Y313-A317 PolarHBondContact O-N 2.83Å; A314-A317 PolarHBondContact O-N 3.44Å; A317-V319 PolarHBondContact O-N 2.82Å; A317-Q320 WeakPolarHBondContact O-CB 3.4Å; A317-Q320 PolarHBondContact O-N 3.34Å; A317-E321 PolarHBondContact O-N 3.32Å; A317-E321 VanDerWaalsContact O-N 3.12Å; A317-V354 HydrophobicContact CB-CG1 4.39Å; A317-V354 HydrophobicContact CB-CG2 4.39Å
318	A	89.7	Confident	86.7	Confident	1 Å²	1	37 Å²	37	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-64	-39.3	177.2	0	0	0	0	0	113	A314 V315 Q320 E321 L322 L347 L351 V354	A314-A318 PolarHBondContact O-N 3.11Å; A314-A318 VanDerWaalsContact O-N 3.13Å; V315-A318 PolarHBondContact O-N 3.12Å; A318-Q320 VanDerWaalsContact C-N 3.32Å; A318-Q320 PolarHBondContact O-N 2.91Å; A318-E321 PolarHBondContact O-N 2.87Å; A318-L322 WeakPolarHBondContact O-CB 3.45Å; A318-L322 PolarHBondContact O-N 2.68Å; A318-L347 HydrophobicContact CB-CD1 3.69Å; A318-L351 HydrophobicContact CB-CB 4.26Å; A318-L351 HydrophobicContact CB-CD2 3.55Å; A318-L351 HydrophobicContact CB-CG 3.53Å; A318-V354 HydrophobicContact CB-CG2 3.82Å
319	V	88.4	Confident	85.6	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.018	20%	0.201	C	C	.	.	H	α-helix	trans	-65	-36	174.5	170.6	0	0	0	0	111.2	F25 V92 V315 V316 A317 N323 L347	F25-V319 HydrophobicContact CD1-CG1 4.11Å; F25-V319 HydrophobicContact CD2-CG1 4.09Å; F25-V319 HydrophobicContact CE1-CG1 4.06Å; F25-V319 HydrophobicContact CE2-CB 4.43Å; F25-V319 HydrophobicContact CE2-CG1 4.01Å; F25-V319 HydrophobicContact CG-CG1 4.14Å; F25-V319 HydrophobicContact CZ-CG1 4Å; V92-V319 HydrophobicContact CG2-CG2 4.3Å; V315-V319 HydrophobicContact CG1-CG2 4.31Å; V315-V319 WeakPolarHBondContact O-CB 3.41Å; V315-V319 VanDerWaalsContact O-CG2 3.28Å; V315-V319 WeakPolarHBondContact O-CG2 3.23Å; V315-V319 PolarHBondContact O-N 3.27Å; V316-V319 PolarHBondContact O-N 3.29Å; A317-V319 PolarHBondContact O-N 2.82Å; V319-N323 WeakPolarHBondContact O-CB 3.45Å; V319-N323 PolarHBondContact O-N 3.09Å; V319-L347 HydrophobicContact CG2-CD1 3.83Å; V319-L347 HydrophobicContact CG2-CD2 3.81Å
320	Q	84.4	Confident	84.6	Confident	68 Å²	68	40.3 Å²	40.3	32%	0.318	22%	0.215	S	C	.	.	H	α-helix	trans	-63	-46.6	175.7	-79.3	175.8	31.5	0	0	112.4	T61 V316 A317 A318 N323 R324	T61-Q320 HydrophobicContact CG2-CG 3.46Å; T61-Q320 VanDerWaalsContact CG2-CG 3.46Å; V316-Q320 HydrophobicContact CG1-CG 4.49Å; V316-Q320 VanDerWaalsContact CG1-NE2 3.26Å; V316-Q320 WeakPolarHBondContact O-CB 3.35Å; V316-Q320 VanDerWaalsContact O-CG 3.26Å; V316-Q320 WeakPolarHBondContact O-CG 3.26Å; V316-Q320 PolarHBondContact O-N 3.14Å; A317-Q320 WeakPolarHBondContact O-CB 3.4Å; A317-Q320 PolarHBondContact O-N 3.34Å; A318-Q320 VanDerWaalsContact C-N 3.32Å; A318-Q320 PolarHBondContact O-N 2.91Å; Q320-N323 PolarHBondContact O-N 2.86Å; Q320-R324 PolarHBondContact O-N 2.58Å
321	E	85.3	Confident	83.9	Confident	80 Å²	80	42 Å²	42	37%	0.374	23%	0.226	S	C	.	.	H	α-helix	trans	-69.1	-40.2	178.9	-63.7	-52.7	148.8	0	0	112.3	A317 A318 N323 R324 Y350	A317-E321 PolarHBondContact O-N 3.32Å; A317-E321 VanDerWaalsContact O-N 3.12Å; A318-E321 PolarHBondContact O-N 2.87Å; E321-N323 VanDerWaalsContact C-N 3.32Å; E321-N323 PolarHBondContact O-N 3.21Å; E321-R324 WeakPolarHBondContact O-CB 3.44Å; E321-R324 PolarHBondContact O-N 2.93Å; E321-R324 IonicContact OE1-CZ 3.5Å; E321-R324 IonicContact OE1-NH1 3.56Å; E321-R324 PolarHBondContact OE1-NH1 2.96Å; E321-R324 IonicContact OE2-CZ 3.62Å; E321-R324 IonicContact OE2-NH1 3.95Å; E321-R324 PolarHBondContact OE2-NH1 3.29Å; E321-Y350 HydrophobicContact CB-CD1 3.72Å; E321-Y350 HydrophobicContact CB-CE1 3.91Å
322	L	85.9	Confident	83.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-41	172.5	-178.9	63.6	0	0	0	111.6	A318 R324 S325 Q326 V328 H343 L347 Y350	A318-L322 WeakPolarHBondContact O-CB 3.45Å; A318-L322 PolarHBondContact O-N 2.68Å; L322-R324 PolarHBondContact O-N 2.62Å; L322-S325 PolarHBondContact O-N 3.02Å; L322-S325 PolarHBondContact O-OG 3.5Å; L322-S325 VanDerWaalsContact O-OG 3.06Å; L322-Q326 HydrophobicContact CD1-CB 4.29Å; L322-Q326 HydrophobicContact CD1-CG 4.43Å; L322-Q326 PolarHBondContact O-N 3.16Å; L322-V328 HydrophobicContact CB-CG2 4.09Å; L322-V328 HydrophobicContact CD2-CG2 3.62Å; L322-V328 HydrophobicContact CG-CG2 3.58Å; L322-H343 HydrophobicContact CD2-CB 4.44Å; L322-L347 HydrophobicContact CB-CD1 4.44Å; L322-L347 HydrophobicContact CD2-CB 3.84Å; L322-L347 HydrophobicContact CD2-CD1 4.09Å; L322-L347 HydrophobicContact CD2-CG 4.47Å; L322-Y350 HydrophobicContact CB-CD2 3.79Å; L322-Y350 HydrophobicContact CB-CE2 4.01Å; L322-Y350 HydrophobicContact CB-CG 4.4Å; L322-Y350 HydrophobicContact CD1-CD2 3.77Å; L322-Y350 HydrophobicContact CD1-CE2 3.49Å; L322-Y350 VanDerWaalsContact CD1-CE2 3.49Å; L322-Y350 HydrophobicContact CG-CD2 4.31Å; L322-Y350 HydrophobicContact CG-CE2 4.34Å
323	N	82.6	Confident	83.3	Confident	40 Å²	40	49.6 Å²	49.6	21%	0.214	26%	0.261	C	S	.	.	H	α-helix	trans	-68.1	-13.8	-179.1	-161.4	54.7	0	0	0	113.9	T60 V319 Q320 E321 Q326 V328	T60-N323 PolarHBondContact O-ND2 2.86Å; V319-N323 WeakPolarHBondContact O-CB 3.45Å; V319-N323 PolarHBondContact O-N 3.09Å; Q320-N323 PolarHBondContact O-N 2.86Å; E321-N323 VanDerWaalsContact C-N 3.32Å; E321-N323 PolarHBondContact O-N 3.21Å; N323-Q326 WeakPolarHBondContact CA-O 3.14Å; N323-V328 HydrophobicContact CB-CG2 4.09Å; N323-V328 PolarHBondContact OD1-N 3.26Å
324	R	81.2	Confident	83.1	Confident	184 Å²	184	49.3 Å²	49.3	69%	0.694	27%	0.269	S	S	*	.	H	α-helix	trans	-75.2	-24.8	168.5	-70.8	-177.8	173.5	138.7	6.7	113.1	Q320 E321 L322	Q320-R324 PolarHBondContact O-N 2.58Å; E321-R324 WeakPolarHBondContact O-CB 3.44Å; E321-R324 PolarHBondContact O-N 2.93Å; E321-R324 IonicContact OE1-CZ 3.5Å; E321-R324 IonicContact OE1-NH1 3.56Å; E321-R324 PolarHBondContact OE1-NH1 2.96Å; E321-R324 IonicContact OE2-CZ 3.62Å; E321-R324 IonicContact OE2-NH1 3.95Å; E321-R324 PolarHBondContact OE2-NH1 3.29Å; L322-R324 PolarHBondContact O-N 2.62Å
325	S	78.8	Confident	82.8	Confident	68 Å²	68	50.8 Å²	50.8	48%	0.476	28%	0.278	S	S	.	.	H	α-helix	trans	-108.6	-31.7	-175.6	67.2	0	0	0	0	113.7	L322 Y350	L322-S325 PolarHBondContact O-N 3.02Å; L322-S325 PolarHBondContact O-OG 3.5Å; L322-S325 VanDerWaalsContact O-OG 3.06Å; S325-Y350 PolarHBondContact OG-OH 2.95Å
326	Q	78.7	Confident	82.6	Confident	76 Å²	76	60.6 Å²	60.6	36%	0.355	32%	0.321	S	S	.	.	S	Bend	trans	-142.1	136.8	-178.2	-60.1	-179.7	4.9	0	0	110.1	L322 N323 V328 H343	L322-Q326 HydrophobicContact CD1-CB 4.29Å; L322-Q326 HydrophobicContact CD1-CG 4.43Å; L322-Q326 PolarHBondContact O-N 3.16Å; N323-Q326 WeakPolarHBondContact CA-O 3.14Å; Q326-V328 PolarHBondContact O-N 3.2Å; Q326-H343 PolarHBondContact OE1-CE1 3.08Å; Q326-H343 PolarHBondContact OE1-ND1 3.19Å
327	N	71.1	Confident	82.5	Confident	136 Å²	136	62.5 Å²	62.5	73%	0.727	34%	0.335	S	S	*	.			trans	-66.7	106.9	174.9	-76.4	-31.2	0	0	0	110.4	G329	N327-G329 PolarHBondContact O-N 2.9Å; N327-G329 VanDerWaalsContact O-N 3.1Å
328	V	70.5	Confident	82.2	Confident	13 Å²	13	66.7 Å²	66.7	8%	0.079	36%	0.362	C	S	.	.			trans	-76.8	102.1	-174.7	-174.5	0	0	0	0	110.9	V92 L322 N323 Q326 W341	V92-V328 HydrophobicContact CG1-CG1 4.43Å; L322-V328 HydrophobicContact CB-CG2 4.09Å; L322-V328 HydrophobicContact CD2-CG2 3.62Å; L322-V328 HydrophobicContact CG-CG2 3.58Å; N323-V328 HydrophobicContact CB-CG2 4.09Å; N323-V328 PolarHBondContact OD1-N 3.26Å; Q326-V328 PolarHBondContact O-N 3.2Å; V328-W341 HydrophobicContact CG1-CZ2 4.09Å
329	G	68.8	Low	82.1	Confident	37 Å²	37	71.3 Å²	71.3	38%	0.381	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-101.2	126.3	169.7	0	0	0	0	0	112	N327 T331 W341	N327-G329 PolarHBondContact O-N 2.9Å; N327-G329 VanDerWaalsContact O-N 3.1Å; G329-T331 PolarHBondContact O-N 3.47Å; G329-W341 PolarHBondContact O-NE1 3.1Å
330	A	72.7	Confident	82.1	Confident	40 Å²	40	74.6 Å²	74.6	33%	0.331	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-75.5	121.4	169.4	0	0	0	0	0	109.9	G90 V92	G90-A330 WeakPolarHBondContact O-CB 3.27Å; V92-A330 HydrophobicContact CG1-CB 3.91Å
331	T	80.9	Confident	82.3	Confident	39 Å²	39	71.4 Å²	71.4	24%	0.239	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-95.8	136.3	177.3	59.3	0	0	0	0	110.8	G90 G329 L333 W341	G90-T331 WeakPolarHBondContact CA-O 3.46Å; G329-T331 PolarHBondContact O-N 3.47Å; T331-L333 PolarHBondContact O-N 2.87Å; T331-W341 VanDerWaalsContact OG1-CD1 3.24Å
332	Q	86.4	Confident	82.3	Confident	148 Å²	148	74 Å²	74	69%	0.692	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-66.7	127.6	169.9	-63.2	-179.4	-24.4	0	0	109.9	S88	S88-Q332 VanDerWaalsContact O-CG 3.32Å; S88-Q332 WeakPolarHBondContact O-CG 3.3Å
333	L	87.5	Confident	82.4	Confident	10 Å²	10	76 Å²	76	5%	0.052	41%	0.405	C	S	.	.			trans	-115.8	158.7	179.3	-61.4	-175.2	0	0	0	110.7	M87 S88 K114 V116 T331 K339 W341	M87-L333 CarbonylContact C-O 3.59Å; M87-L333 VanDerWaalsContact C-O 3.25Å; M87-L333 HydrophobicContact CB-CB 4.32Å; M87-L333 PolarHBondContact O-N 2.83Å; M87-L333 HydrophobicContact SD-CB 4.33Å; M87-L333 HydrophobicContact SD-CD1 4.15Å; S88-L333 WeakPolarHBondContact CA-O 3.33Å; S88-L333 PolarHBondContact N-O 3.42Å; K114-L333 HydrophobicContact CB-CD1 3.92Å; V116-L333 HydrophobicContact CG2-CD1 4.03Å; T331-L333 PolarHBondContact O-N 2.87Å; L333-K339 HydrophobicContact CD2-CB 4.47Å; L333-K339 HydrophobicContact CD2-CD 4.26Å; L333-K339 HydrophobicContact CD2-CG 4.09Å; L333-W341 HydrophobicContact CD1-CB 4.21Å
334	S	88	Confident	82.6	Confident	57 Å²	57	74 Å²	74	40%	0.399	40%	0.395	S	S	.	.			trans	-124.1	129.9	172.7	174.6	0	0	0	0	109.6	K336 S337	S334-K336 PolarHBondContact O-N 3.17Å; S334-K336 VanDerWaalsContact O-N 3.14Å; S334-K336 PolarHBondContact OG-N 3.22Å; S334-S337 PolarHBondContact O-N 2.96Å; S334-S337 PolarHBondContact O-OG 3.34Å
335	C	87	Confident	82.8	Confident	31 Å²	31	67.9 Å²	67.9	21%	0.209	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-39.2	173.3	-74	0	0	0	0	112.5	C84 K114 S337	C84-C335 WeakPolarHBondContact CA-SG 3.42Å; C84-C335 HydrophobicContact CB-CB 3.98Å; C84-C335 WeakPolarHBondContact CB-SG 3.22Å; C84-C335 WeakPolarHBondContact SG-CB 3.33Å; C84-C335 CovalentContact SG-SG 2.03Å; C84-C335 PolarHBondContact SG-SG 3.25Å; K114-C335 PolarHBondContact NZ-O 3.38Å; C335-S337 VanDerWaalsContact C-N 3.27Å; C335-S337 PolarHBondContact O-N 2.92Å
336	K	86.9	Confident	83.3	Confident	207 Å²	207	66.2 Å²	66.2	90%	0.9	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-9.5	-176.5	-61.3	-178	-179.9	178.8	0	114.3	S334	S334-K336 PolarHBondContact O-N 3.17Å; S334-K336 VanDerWaalsContact O-N 3.14Å; S334-K336 PolarHBondContact OG-N 3.22Å
337	S	87.2	Confident	83.8	Confident	44 Å²	44	62.6 Å²	62.6	31%	0.308	35%	0.349	S	S	.	.	S	Bend	trans	-107.3	145.4	179.4	68.3	0	0	0	0	111.1	K114 S334 C335 K339	K114-S337 PolarHBondContact NZ-O 3.41Å; S334-S337 PolarHBondContact O-N 2.96Å; S334-S337 PolarHBondContact O-OG 3.34Å; C335-S337 VanDerWaalsContact C-N 3.27Å; C335-S337 PolarHBondContact O-N 2.92Å; S337-K339 PolarHBondContact O-N 2.95Å; S337-K339 VanDerWaalsContact O-N 3.09Å
338	S	85.3	Confident	84.6	Confident	119 Å²	119	56.2 Å²	56.2	83%	0.832	32%	0.315	S	S	*	.			trans	-75.8	17.2	173.7	53.8	0	0	0	0	113.9
339	K	87.2	Confident	85.4	Confident	98 Å²	98	59.3 Å²	59.3	43%	0.426	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-79.7	121.7	178.1	-170.9	178.4	-178.9	-177.5	0	110	L333 S337	L333-K339 HydrophobicContact CD2-CB 4.47Å; L333-K339 HydrophobicContact CD2-CD 4.26Å; L333-K339 HydrophobicContact CD2-CG 4.09Å; S337-K339 PolarHBondContact O-N 2.95Å; S337-K339 VanDerWaalsContact O-N 3.09Å
340	I	88.4	Confident	86.4	Confident	71 Å²	71	61.2 Å²	61.2	36%	0.364	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-91.2	166	171.5	59.2	173.6	0	0	0	111.2	E115	E115-I340 HydrophobicContact CB-CB 4.43Å; E115-I340 HydrophobicContact CG-CB 4.25Å; E115-I340 HydrophobicContact CG-CG2 4.17Å
341	W	88.4	Confident	87.2	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.008	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-83.2	118.2	170.1	-175.5	36.1	0	0	0	111.5	V92 K114 V116 P117 V328 G329 T331 L333 H343 G344 L347	V92-W341 HydrophobicContact CB-CH2 3.75Å; V92-W341 HydrophobicContact CB-CZ2 4.31Å; V92-W341 HydrophobicContact CB-CZ3 4.42Å; V92-W341 HydrophobicContact CG1-CH2 3.94Å; V92-W341 HydrophobicContact CG1-CZ2 3.99Å; V92-W341 WeakPolarHBondContact O-CZ3 3.47Å; K114-W341 PolarHBondContact O-N 3.44Å; V116-W341 HydrophobicContact CG2-CB 4.44Å; P117-W341 HydrophobicContact CG-CZ3 4.42Å; V328-W341 HydrophobicContact CG1-CZ2 4.09Å; G329-W341 PolarHBondContact O-NE1 3.1Å; T331-W341 VanDerWaalsContact OG1-CD1 3.24Å; L333-W341 HydrophobicContact CD1-CB 4.21Å; W341-H343 HydrophobicContact CD2-CB 4.47Å; W341-H343 HydrophobicContact CZ2-CB 4.01Å; W341-H343 PolarHBondContact O-N 3.31Å; W341-H343 VanDerWaalsContact O-N 3.09Å; W341-G344 PolarHBondContact O-N 3.44Å; W341-L347 HydrophobicContact CH2-CB 4.41Å; W341-L347 HydrophobicContact CH2-CD2 3.64Å; W341-L347 HydrophobicContact CZ3-CB 4.33Å; W341-L347 HydrophobicContact CZ3-CD2 3.82Å
342	E	85.3	Confident	87.6	Confident	134 Å²	134	60.5 Å²	60.5	63%	0.626	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.8	-173.1	-65.9	167.1	-149.2	0	0	114.4
343	H	86.9	Confident	87.6	Confident	41 Å²	41	60.3 Å²	60.3	19%	0.19	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-0	177.6	-59.9	-71.5	0	0	0	114	L322 Q326 W341 S346 L347	L322-H343 HydrophobicContact CD2-CB 4.44Å; Q326-H343 PolarHBondContact OE1-CE1 3.08Å; Q326-H343 PolarHBondContact OE1-ND1 3.19Å; W341-H343 HydrophobicContact CD2-CB 4.47Å; W341-H343 HydrophobicContact CZ2-CB 4.01Å; W341-H343 PolarHBondContact O-N 3.31Å; W341-H343 VanDerWaalsContact O-N 3.09Å; H343-S346 WeakPolarHBondContact O-CB 3.32Å; H343-S346 PolarHBondContact O-N 3.11Å; H343-S346 VanDerWaalsContact O-N 3.14Å; H343-L347 PolarHBondContact O-N 2.61Å
344	G	86.6	Confident	87.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-56.4	-56.5	-171.9	0	0	0	0	0	114.2	E115 W341 S346 L347 M348	E115-G344 WeakPolarHBondContact O-CA 3.48Å; W341-G344 PolarHBondContact O-N 3.44Å; G344-S346 VanDerWaalsContact C-N 3.27Å; G344-S346 PolarHBondContact O-N 3.45Å; G344-L347 PolarHBondContact O-N 2.96Å; G344-M348 WeakPolarHBondContact O-CB 3.15Å; G344-M348 PolarHBondContact O-N 3.42Å
345	T	86.4	Confident	87.9	Confident	54 Å²	54	64.9 Å²	64.9	33%	0.331	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-33.8	175.7	44.1	0	0	0	0	113.2	E115 F134 N349	E115-T345 WeakPolarHBondContact OE2-CG2 3.01Å; F134-T345 HydrophobicContact CD2-CG2 4.31Å; T345-N349 VanDerWaalsContact O-CG 3.32Å; T345-N349 PolarHBondContact O-N 3.27Å; T345-N349 VanDerWaalsContact O-N 3.09Å; T345-N349 PolarHBondContact O-ND2 3.47Å
346	S	88.4	Confident	88.1	Confident	33 Å²	33	64.8 Å²	64.8	23%	0.231	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-48.4	175.7	-63.5	0	0	0	0	111	H343 G344 M348 N349 Y350	H343-S346 WeakPolarHBondContact O-CB 3.32Å; H343-S346 PolarHBondContact O-N 3.11Å; H343-S346 VanDerWaalsContact O-N 3.14Å; G344-S346 VanDerWaalsContact C-N 3.27Å; G344-S346 PolarHBondContact O-N 3.45Å; S346-M348 VanDerWaalsContact C-N 3.34Å; S346-M348 PolarHBondContact O-N 2.88Å; S346-N349 PolarHBondContact O-N 2.93Å; S346-Y350 VanDerWaalsContact O-CD2 3.27Å; S346-Y350 WeakPolarHBondContact O-CD2 3.48Å; S346-Y350 PolarHBondContact O-N 3.34Å; S346-Y350 VanDerWaalsContact O-N 3.13Å
347	L	88.8	Confident	88.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-38.5	176.9	-174.7	56.7	0	0	0	112	V92 P117 A318 V319 L322 W341 H343 G344 N349 Y350 L351	V92-L347 HydrophobicContact CB-CD2 4.48Å; P117-L347 HydrophobicContact CG-CB 4.4Å; P117-L347 HydrophobicContact CG-CD2 4.08Å; P117-L347 HydrophobicContact CG-CG 4.21Å; A318-L347 HydrophobicContact CB-CD1 3.69Å; V319-L347 HydrophobicContact CG2-CD1 3.83Å; V319-L347 HydrophobicContact CG2-CD2 3.81Å; L322-L347 HydrophobicContact CB-CD1 4.44Å; L322-L347 HydrophobicContact CD2-CB 3.84Å; L322-L347 HydrophobicContact CD2-CD1 4.09Å; L322-L347 HydrophobicContact CD2-CG 4.47Å; W341-L347 HydrophobicContact CH2-CB 4.41Å; W341-L347 HydrophobicContact CH2-CD2 3.64Å; W341-L347 HydrophobicContact CZ3-CB 4.33Å; W341-L347 HydrophobicContact CZ3-CD2 3.82Å; H343-L347 PolarHBondContact O-N 2.61Å; G344-L347 PolarHBondContact O-N 2.96Å; L347-N349 VanDerWaalsContact C-N 3.31Å; L347-N349 PolarHBondContact O-N 3.1Å; L347-Y350 PolarHBondContact O-N 2.8Å; L347-L351 HydrophobicContact CD1-CG 4.49Å; L347-L351 HydrophobicContact CG-CD1 4Å; L347-L351 HydrophobicContact CG-CG 4.39Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 WeakPolarHBondContact O-CG 3.42Å; L347-L351 PolarHBondContact O-N 3.12Å
348	M	88.5	Confident	88.5	Confident	3 Å²	3	57.8 Å²	57.8	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-37.9	175.2	-176.9	55.9	68.6	0	0	112.5	P117 F134 T135 L137 G344 S346 L351 R352	P117-M348 HydrophobicContact CB-CE 3.97Å; P117-M348 HydrophobicContact CG-CE 4.34Å; F134-M348 HydrophobicContact CD1-CE 4.12Å; F134-M348 HydrophobicContact CD2-CB 4.5Å; F134-M348 HydrophobicContact CE1-CE 3.51Å; F134-M348 HydrophobicContact CE2-CB 3.83Å; F134-M348 HydrophobicContact CE2-CE 4.23Å; F134-M348 HydrophobicContact CE2-CG 4.27Å; F134-M348 HydrophobicContact CZ-CB 4.16Å; F134-M348 HydrophobicContact CZ-CE 3.57Å; T135-M348 WeakPolarHBondContact O-CE 3.18Å; L137-M348 HydrophobicContact CD1-CE 4.18Å; L137-M348 HydrophobicContact CD1-SD 3.92Å; L137-M348 HydrophobicContact CD2-SD 4.1Å; L137-M348 HydrophobicContact CG-CE 4.33Å; L137-M348 HydrophobicContact CG-SD 3.97Å; G344-M348 WeakPolarHBondContact O-CB 3.15Å; G344-M348 PolarHBondContact O-N 3.42Å; S346-M348 VanDerWaalsContact C-N 3.34Å; S346-M348 PolarHBondContact O-N 2.88Å; M348-L351 PolarHBondContact O-N 3Å; M348-R352 WeakPolarHBondContact O-CG 3.22Å; M348-R352 PolarHBondContact O-N 2.88Å; M348-R352 VanDerWaalsContact O-N 3.11Å
349	N	88.8	Confident	88.9	Confident	78 Å²	78	52.1 Å²	52.1	42%	0.417	25%	0.252	S	S	.	.	H	α-helix	trans	-67.8	-41.4	174.7	-71.9	-29.6	0	0	0	112.1	T345 S346 L347 R352 M353	T345-N349 VanDerWaalsContact O-CG 3.32Å; T345-N349 PolarHBondContact O-N 3.27Å; T345-N349 VanDerWaalsContact O-N 3.09Å; T345-N349 PolarHBondContact O-ND2 3.47Å; S346-N349 PolarHBondContact O-N 2.93Å; L347-N349 VanDerWaalsContact C-N 3.31Å; L347-N349 PolarHBondContact O-N 3.1Å; N349-R352 PolarHBondContact O-N 3Å; N349-M353 HydrophobicContact CB-CE 4.28Å; N349-M353 WeakPolarHBondContact O-CE 3.22Å; N349-M353 WeakPolarHBondContact O-CG 3.47Å; N349-M353 PolarHBondContact O-N 2.65Å
350	Y	89.7	Confident	89.1	Confident	76 Å²	76	47.6 Å²	47.6	30%	0.298	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-40.9	173.3	-78.9	-75.1	0	0	0	112.1	E321 L322 S325 S346 L347 R352 M353 V354	E321-Y350 HydrophobicContact CB-CD1 3.72Å; E321-Y350 HydrophobicContact CB-CE1 3.91Å; L322-Y350 HydrophobicContact CB-CD2 3.79Å; L322-Y350 HydrophobicContact CB-CE2 4.01Å; L322-Y350 HydrophobicContact CB-CG 4.4Å; L322-Y350 HydrophobicContact CD1-CD2 3.77Å; L322-Y350 HydrophobicContact CD1-CE2 3.49Å; L322-Y350 VanDerWaalsContact CD1-CE2 3.49Å; L322-Y350 HydrophobicContact CG-CD2 4.31Å; L322-Y350 HydrophobicContact CG-CE2 4.34Å; S325-Y350 PolarHBondContact OG-OH 2.95Å; S346-Y350 VanDerWaalsContact O-CD2 3.27Å; S346-Y350 WeakPolarHBondContact O-CD2 3.48Å; S346-Y350 PolarHBondContact O-N 3.34Å; S346-Y350 VanDerWaalsContact O-N 3.13Å; L347-Y350 PolarHBondContact O-N 2.8Å; Y350-R352 VanDerWaalsContact C-N 3.3Å; Y350-R352 PolarHBondContact O-N 2.82Å; Y350-M353 CarbonylContact O-C 3.55Å; Y350-M353 WeakPolarHBondContact O-CA 3.03Å; Y350-M353 PolarHBondContact O-N 3.18Å; Y350-V354 PolarHBondContact O-N 3.17Å
351	L	89.6	Confident	89.2	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-57.6	-40.2	175.8	-80.6	162.5	0	0	0	112.7	P117 L137 V315 A318 L347 M348 M353 V354 F365	P117-L351 HydrophobicContact CB-CD1 3.55Å; P117-L351 HydrophobicContact CG-CD1 3.81Å; L137-L351 HydrophobicContact CD1-CB 3.65Å; L137-L351 HydrophobicContact CD1-CD1 3.67Å; L137-L351 HydrophobicContact CD1-CD2 4.1Å; L137-L351 HydrophobicContact CD1-CG 4.01Å; V315-L351 HydrophobicContact CG2-CD2 4.38Å; A318-L351 HydrophobicContact CB-CB 4.26Å; A318-L351 HydrophobicContact CB-CD2 3.55Å; A318-L351 HydrophobicContact CB-CG 3.53Å; L347-L351 HydrophobicContact CD1-CG 4.49Å; L347-L351 HydrophobicContact CG-CD1 4Å; L347-L351 HydrophobicContact CG-CG 4.39Å; L347-L351 WeakPolarHBondContact O-CB 3.48Å; L347-L351 WeakPolarHBondContact O-CG 3.42Å; L347-L351 PolarHBondContact O-N 3.12Å; M348-L351 PolarHBondContact O-N 3Å; L351-M353 PolarHBondContact O-N 3.4Å; L351-V354 WeakPolarHBondContact O-CB 3.38Å; L351-V354 PolarHBondContact O-N 3.11Å; L351-F365 WeakPolarHBondContact O-CD2 3.41Å
352	R	88	Confident	89.4	Confident	64 Å²	64	46.4 Å²	46.4	24%	0.242	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.3	175	-71.2	171.3	174.9	-178.7	-6.2	114.3	T135 L137 M348 N349 Y350	T135-R352 PolarHBondContact OG1-NH2 2.84Å; L137-R352 HydrophobicContact CD2-CG 4.3Å; M348-R352 WeakPolarHBondContact O-CG 3.22Å; M348-R352 PolarHBondContact O-N 2.88Å; M348-R352 VanDerWaalsContact O-N 3.11Å; N349-R352 PolarHBondContact O-N 3Å; Y350-R352 VanDerWaalsContact C-N 3.3Å; Y350-R352 PolarHBondContact O-N 2.82Å
353	M	87.5	Confident	89.7	Confident	144 Å²	144	40 Å²	40	71%	0.709	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.6	8.7	175.3	-58.8	177.7	-146.4	0	0	112.2	N349 Y350 L351 E355	N349-M353 HydrophobicContact CB-CE 4.28Å; N349-M353 WeakPolarHBondContact O-CE 3.22Å; N349-M353 WeakPolarHBondContact O-CG 3.47Å; N349-M353 PolarHBondContact O-N 2.65Å; Y350-M353 CarbonylContact O-C 3.55Å; Y350-M353 WeakPolarHBondContact O-CA 3.03Å; Y350-M353 PolarHBondContact O-N 3.18Å; L351-M353 PolarHBondContact O-N 3.4Å; M353-E355 PolarHBondContact O-N 3.28Å
354	V	89.6	Confident	90	Very high	11 Å²	11	41.4 Å²	41.4	7%	0.067	21%	0.205	C	C	.	.			trans	-72.4	121.9	174.2	170.7	0	0	0	0	109	A314 A317 A318 Y350 L351 L356	A314-V354 HydrophobicContact CB-CG1 4.46Å; A317-V354 HydrophobicContact CB-CG1 4.39Å; A317-V354 HydrophobicContact CB-CG2 4.39Å; A318-V354 HydrophobicContact CB-CG2 3.82Å; Y350-V354 PolarHBondContact O-N 3.17Å; L351-V354 WeakPolarHBondContact O-CB 3.38Å; L351-V354 PolarHBondContact O-N 3.11Å; V354-L356 HydrophobicContact CG1-CB 4.38Å; V354-L356 HydrophobicContact CG1-CD2 3.59Å; V354-L356 HydrophobicContact CG1-CG 4Å
355	E	91.9	Very high	90.1	Very high	151 Å²	151	41.9 Å²	41.9	71%	0.706	21%	0.207	S	C	*	.			trans	-114.9	117.4	167	-170.4	-170.3	157.6	0	0	107.1	M353 H362 I363	M353-E355 PolarHBondContact O-N 3.28Å; E355-H362 VanDerWaalsContact CG-CE1 3.48Å; E355-H362 WeakPolarHBondContact CG-CE1 3.44Å; E355-H362 IonicContact OE1-CE1 3.68Å; E355-I363 WeakPolarHBondContact CA-O 3.31Å
356	L	90.8	Very high	90.2	Very high	30 Å²	30	41.5 Å²	41.5	16%	0.157	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	155.5	177.1	69.7	81.4	0	0	0	113.3	A314 V354 I363	A314-L356 HydrophobicContact CB-CD2 4.07Å; V354-L356 HydrophobicContact CG1-CB 4.38Å; V354-L356 HydrophobicContact CG1-CD2 3.59Å; V354-L356 HydrophobicContact CG1-CG 4Å; L356-I363 HydrophobicContact CD1-CB 3.94Å; L356-I363 HydrophobicContact CD1-CD1 3.65Å; L356-I363 HydrophobicContact CD1-CG1 4.26Å; L356-I363 HydrophobicContact CG-CB 4.12Å; L356-I363 HydrophobicContact CG-CG2 4.43Å; L356-I363 PolarHBondContact N-O 2.92Å; L356-I363 VanDerWaalsContact N-O 3.12Å; L356-I363 PolarHBondContact O-N 2.92Å
357	E	91.9	Very high	89.9	Confident	99 Å²	99	44.8 Å²	44.8	46%	0.463	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	112.7	169.3	-78.6	-63.9	144	0	0	110.1	N272 H362	N272-E357 PolarHBondContact ND2-OE2 3.08Å; E357-H362 WeakPolarHBondContact OE1-CA 3.07Å; E357-H362 VanDerWaalsContact OE1-CB 3.31Å; E357-H362 WeakPolarHBondContact OE1-CB 3.15Å; E357-H362 IonicContact OE1-CG 3.33Å; E357-H362 IonicContact OE1-ND1 2.65Å; E357-H362 PolarHBondContact OE1-ND1 3.01Å; E357-H362 PolarHBondContact OE2-N 3.3Å
358	G	91.3	Very high	89.6	Confident	4 Å²	4	51 Å²	51	4%	0.041	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-172.7	178.5	0	0	0	0	0	114.1	D310 T360 G361	D310-G358 WeakPolarHBondContact OD1-CA 3.48Å; G358-T360 PolarHBondContact O-N 3.08Å; G358-G361 PolarHBondContact N-O 2.95Å; G358-G361 PolarHBondContact O-N 3.07Å
359	L	92	Very high	89.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.4	169.5	-63.3	-179.9	0	0	0	112	N272 F278 F281 A306 F309 D310	N272-L359 PolarHBondContact N-O 3.35Å; F278-L359 HydrophobicContact CB-CD2 4.26Å; F278-L359 HydrophobicContact CD2-CD2 4.16Å; F281-L359 HydrophobicContact CB-CD1 4.32Å; F281-L359 HydrophobicContact CD1-CD1 3.72Å; F281-L359 HydrophobicContact CD2-CD1 3.72Å; F281-L359 HydrophobicContact CE1-CD1 3.8Å; F281-L359 HydrophobicContact CE2-CD1 3.81Å; F281-L359 HydrophobicContact CG-CD1 3.66Å; F281-L359 HydrophobicContact CZ-CD1 3.84Å; A306-L359 HydrophobicContact CB-CB 4.22Å; F309-L359 HydrophobicContact CB-CD1 3.97Å; F309-L359 HydrophobicContact CD1-CD1 3.37Å; F309-L359 HydrophobicContact CD1-CG 3.66Å; F309-L359 HydrophobicContact CD2-CD1 4.2Å; F309-L359 HydrophobicContact CE1-CD1 3.8Å; F309-L359 HydrophobicContact CE1-CD2 4.45Å; F309-L359 HydrophobicContact CE1-CG 3.84Å; F309-L359 HydrophobicContact CG-CD1 3.59Å; F309-L359 HydrophobicContact CG-CG 4.38Å; F309-L359 HydrophobicContact CZ-CD1 4.39Å; D310-L359 PolarHBondContact OD1-N 3.48Å; D310-L359 PolarHBondContact OD2-N 3.45Å
360	T	92.1	Very high	89.3	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.025	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	16.9	172	64.5	0	0	0	0	113.4	V270 L303 A306 L307 D310 G358 R371	V270-T360 CarbonylContact O-C 3.58Å; V270-T360 WeakPolarHBondContact O-CA 3.33Å; L303-T360 HydrophobicContact CD1-CG2 4.12Å; A306-T360 HydrophobicContact CB-CG2 3.94Å; L307-T360 HydrophobicContact CD2-CG2 3.91Å; L307-T360 HydrophobicContact CG-CG2 4.43Å; D310-T360 WeakPolarHBondContact OD2-CB 3.45Å; D310-T360 PolarHBondContact OD2-N 3.4Å; D310-T360 PolarHBondContact OD2-OG1 2.89Å; G358-T360 PolarHBondContact O-N 3.08Å; T360-R371 PolarHBondContact O-NH2 2.76Å; T360-R371 PolarHBondContact OG1-NH1 3.42Å; T360-R371 PolarHBondContact OG1-NH2 3Å
361	G	91.2	Very high	89.3	Confident	9 Å²	9	45.3 Å²	45.3	9%	0.093	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.8	-151.2	-180	0	0	0	0	0	113.4	G358 I363	G358-G361 PolarHBondContact N-O 2.95Å; G358-G361 PolarHBondContact O-N 3.07Å; G361-I363 PolarHBondContact O-N 3.24Å
362	H	92.1	Very high	89.3	Confident	38 Å²	38	46.5 Å²	46.5	18%	0.176	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	130	-175.6	-158.4	74.9	0	0	0	112.9	E355 E357 R371 N373	E355-H362 VanDerWaalsContact CG-CE1 3.48Å; E355-H362 WeakPolarHBondContact CG-CE1 3.44Å; E355-H362 IonicContact OE1-CE1 3.68Å; E357-H362 WeakPolarHBondContact OE1-CA 3.07Å; E357-H362 VanDerWaalsContact OE1-CB 3.31Å; E357-H362 WeakPolarHBondContact OE1-CB 3.15Å; E357-H362 IonicContact OE1-CG 3.33Å; E357-H362 IonicContact OE1-ND1 2.65Å; E357-H362 PolarHBondContact OE1-ND1 3.01Å; E357-H362 PolarHBondContact OE2-N 3.3Å; H362-R371 PolarHBondContact O-NE 3.41Å; H362-R371 PolarHBondContact O-NH2 3.12Å; H362-N373 PolarHBondContact CD2-O 2.69Å; H362-N373 VanDerWaalsContact CD2-O 3.26Å
363	I	92.4	Very high	89.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	111.9	179.5	-69.2	164.8	0	0	0	108.5	L139 D310 E355 L356 G361 F365 R371	L139-I363 HydrophobicContact CD2-CD1 4.18Å; L139-I363 HydrophobicContact CD2-CG1 4.38Å; L139-I363 HydrophobicContact CD2-CG2 3.77Å; D310-I363 HydrophobicContact CB-CD1 3.6Å; E355-I363 WeakPolarHBondContact CA-O 3.31Å; L356-I363 HydrophobicContact CD1-CB 3.94Å; L356-I363 HydrophobicContact CD1-CD1 3.65Å; L356-I363 HydrophobicContact CD1-CG1 4.26Å; L356-I363 HydrophobicContact CG-CB 4.12Å; L356-I363 HydrophobicContact CG-CG2 4.43Å; L356-I363 PolarHBondContact N-O 2.92Å; L356-I363 VanDerWaalsContact N-O 3.12Å; L356-I363 PolarHBondContact O-N 2.92Å; G361-I363 PolarHBondContact O-N 3.24Å; I363-F365 HydrophobicContact CG2-CE2 3.99Å; I363-F365 HydrophobicContact CG2-CZ 4.14Å; I363-R371 VanDerWaalsContact CG1-CZ 3.48Å
364	E	91.8	Very high	89.5	Confident	71 Å²	71	39.1 Å²	39.1	33%	0.332	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	152.2	171.1	-171.2	-170.3	162.9	0	0	107.5	R371 S372 N373	E364-R371 CarbonylContact O-C 3.55Å; E364-R371 VanDerWaalsContact O-CA 3.29Å; E364-R371 WeakPolarHBondContact O-CA 3.41Å; E364-S372 PolarHBondContact O-N 2.95Å; E364-N373 HydrophobicContact CB-CB 4.42Å; E364-N373 WeakPolarHBondContact OE2-CB 3.45Å; E364-N373 PolarHBondContact OE2-ND2 2.76Å
365	F	90.2	Very high	89.5	Confident	9 Å²	9	40 Å²	40	4%	0.039	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.6	177.3	-61.7	-82.1	0	0	0	112.4	L137 L139 L351 I363	L137-F365 HydrophobicContact CB-CE1 4.17Å; L137-F365 HydrophobicContact CB-CZ 4.48Å; L137-F365 HydrophobicContact CD2-CB 4.44Å; L137-F365 HydrophobicContact CD2-CD1 4.07Å; L137-F365 HydrophobicContact CD2-CD2 4.44Å; L137-F365 HydrophobicContact CD2-CE1 4.39Å; L137-F365 HydrophobicContact CD2-CG 4.08Å; L139-F365 HydrophobicContact CD2-CE1 4.01Å; L139-F365 HydrophobicContact CD2-CZ 3.54Å; L139-F365 HydrophobicContact CG-CE1 4.22Å; L139-F365 HydrophobicContact CG-CZ 4Å; L351-F365 WeakPolarHBondContact O-CD2 3.41Å; I363-F365 HydrophobicContact CG2-CE2 3.99Å; I363-F365 HydrophobicContact CG2-CZ 4.14Å
366	N	86.8	Confident	89.5	Confident	47 Å²	47	32.9 Å²	32.9	25%	0.251	18%	0.179	S	C	.	.			trans	-76.6	175.1	174	75.3	22.2	0	0	0	112.6	K368 G369 Q370 S372	N366-K368 PolarHBondContact O-N 2.98Å; N366-K368 WeakPolarHBondContact OD1-CA 3.45Å; N366-K368 VanDerWaalsContact OD1-CB 3.31Å; N366-K368 WeakPolarHBondContact OD1-CB 3.32Å; N366-K368 PolarHBondContact OD1-N 2.65Å; N366-G369 PolarHBondContact O-N 3.42Å; N366-G369 PolarHBondContact OD1-N 3.32Å; N366-Q370 VanDerWaalsContact CG-O 3.26Å; N366-Q370 PolarHBondContact N-O 3.13Å; N366-Q370 PolarHBondContact OD1-N 2.93Å; N366-Q370 VanDerWaalsContact OD1-N 3.08Å; N366-Q370 PolarHBondContact OD1-O 2.91Å; N366-S372 PolarHBondContact N-OG 3.05Å
367	S	83.9	Confident	89.6	Confident	102 Å²	102	33.4 Å²	33.4	71%	0.713	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-16	-179.7	59.2	0	0	0	0	115.5
368	K	80.9	Confident	89.6	Confident	129 Å²	129	28.7 Å²	28.7	56%	0.561	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-7.5	175.1	-54.8	173.5	-175.6	167.6	0	112.8	T135 N366 Q370	T135-K368 WeakPolarHBondContact CB-O 3.45Å; T135-K368 PolarHBondContact OG1-O 3.01Å; N366-K368 PolarHBondContact O-N 2.98Å; N366-K368 WeakPolarHBondContact OD1-CA 3.45Å; N366-K368 VanDerWaalsContact OD1-CB 3.31Å; N366-K368 WeakPolarHBondContact OD1-CB 3.32Å; N366-K368 PolarHBondContact OD1-N 2.65Å; K368-Q370 HydrophobicContact CB-CG 4.46Å
369	G	83.9	Confident	89.4	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.01	16%	0.156	C	C	.	.	S	Bend	trans	84.2	9.8	-174.2	0	0	0	0	0	114.8	L137 D138 N366	L137-G369 CarbonylContact C-O 3.28Å; L137-G369 VanDerWaalsContact CA-O 3.32Å; L137-G369 WeakPolarHBondContact CA-O 3.47Å; D138-G369 PolarHBondContact N-O 3.11Å; N366-G369 PolarHBondContact O-N 3.42Å; N366-G369 PolarHBondContact OD1-N 3.32Å
370	Q	87.7	Confident	89.1	Confident	35 Å²	35	30.6 Å²	30.6	16%	0.164	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-87.3	145.4	173	-54.9	170.8	-70.1	0	0	109.4	E124 T142 N366 K368	E124-Q370 PolarHBondContact OE1-NE2 2.81Å; T142-Q370 HydrophobicContact CG2-CB 4.23Å; N366-Q370 VanDerWaalsContact CG-O 3.26Å; N366-Q370 PolarHBondContact N-O 3.13Å; N366-Q370 PolarHBondContact OD1-N 2.93Å; N366-Q370 VanDerWaalsContact OD1-N 3.08Å; N366-Q370 PolarHBondContact OD1-O 2.91Å; K368-Q370 HydrophobicContact CB-CG 4.46Å
371	R	89.9	Confident	88.7	Confident	3 Å²	3	31.8 Å²	31.8	1%	0.011	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	137.7	174.2	-168.9	174.2	176.8	172.4	-2.8	111.9	D138 L139 T360 H362 I363 E364 Y374	D138-R371 PolarHBondContact O-N 3.4Å; D138-R371 VanDerWaalsContact O-N 3.08Å; L139-R371 WeakPolarHBondContact O-CD 3.32Å; L139-R371 PolarHBondContact O-NH1 2.81Å; L139-R371 VanDerWaalsContact O-NH1 3.09Å; T360-R371 PolarHBondContact O-NH2 2.76Å; T360-R371 PolarHBondContact OG1-NH1 3.42Å; T360-R371 PolarHBondContact OG1-NH2 3Å; H362-R371 PolarHBondContact O-NE 3.41Å; H362-R371 PolarHBondContact O-NH2 3.12Å; I363-R371 VanDerWaalsContact CG1-CZ 3.48Å; E364-R371 CarbonylContact O-C 3.55Å; E364-R371 VanDerWaalsContact O-CA 3.29Å; E364-R371 WeakPolarHBondContact O-CA 3.41Å; R371-Y374 HydrophobicContact CB-CD1 4.4Å; R371-Y374 HydrophobicContact CG-CD1 3.85Å; R371-Y374 HydrophobicContact CG-CE1 4.48Å; R371-Y374 HydrophobicContact CG-CG 4.43Å
372	S	89.1	Confident	87.8	Confident	26 Å²	26	34 Å²	34	18%	0.182	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	171.3	175.7	46.7	0	0	0	0	111	E364 N366 Y374	E364-S372 PolarHBondContact O-N 2.95Å; N366-S372 PolarHBondContact N-OG 3.05Å; S372-Y374 PolarHBondContact O-N 2.82Å
373	N	88.8	Confident	86.6	Confident	51 Å²	51	40 Å²	40	27%	0.273	21%	0.21	S	C	.	.	S	Bend	trans	53.5	49.2	169.8	-166.1	15.9	0	0	0	113.4	H362 E364 H393 S394	H362-N373 PolarHBondContact CD2-O 2.69Å; H362-N373 VanDerWaalsContact CD2-O 3.26Å; E364-N373 HydrophobicContact CB-CB 4.42Å; E364-N373 WeakPolarHBondContact OE2-CB 3.45Å; E364-N373 PolarHBondContact OE2-ND2 2.76Å; N373-H393 PolarHBondContact OD1-CE1 3.4Å; N373-H393 PolarHBondContact OD1-NE2 2.87Å; N373-S394 WeakPolarHBondContact CA-OG 3.46Å; N373-S394 PolarHBondContact N-OG 2.85Å
374	Y	90.6	Very high	85.4	Confident	1 Å²	1	49.7 Å²	49.7	0%	0.004	26%	0.255	C	S	.	.			trans	-126	158.7	-178.7	67	-89.3	0	0	0	110.7	P141 T142 D145 R371 S372 L376 H393 S394	P141-Y374 WeakPolarHBondContact CA-OH 3.32Å; P141-Y374 HydrophobicContact CB-CD2 4.42Å; P141-Y374 HydrophobicContact CB-CE2 3.49Å; P141-Y374 VanDerWaalsContact CB-CE2 3.49Å; P141-Y374 WeakPolarHBondContact CB-OH 3.16Å; P141-Y374 HydrophobicContact CG-CD2 4.14Å; P141-Y374 HydrophobicContact CG-CE2 3.68Å; T142-Y374 PolarHBondContact N-OH 2.99Å; T142-Y374 VanDerWaalsContact N-OH 3.14Å; D145-Y374 WeakPolarHBondContact CB-OH 3.48Å; D145-Y374 VanDerWaalsContact CG-OH 3.22Å; D145-Y374 PolarHBondContact OD2-OH 3.31Å; R371-Y374 HydrophobicContact CB-CD1 4.4Å; R371-Y374 HydrophobicContact CG-CD1 3.85Å; R371-Y374 HydrophobicContact CG-CE1 4.48Å; R371-Y374 HydrophobicContact CG-CG 4.43Å; S372-Y374 PolarHBondContact O-N 2.82Å; Y374-L376 HydrophobicContact CD2-CD2 4.23Å; Y374-L376 HydrophobicContact CD2-CG 4.43Å; Y374-L376 HydrophobicContact CE2-CD2 3.89Å; Y374-L376 HydrophobicContact CE2-CG 4.01Å; Y374-H393 PolarHBondContact O-CD2 3.06Å; Y374-S394 PolarHBondContact O-N 3.33Å
375	A	90.6	Very high	84.5	Confident	31 Å²	31	47.3 Å²	47.3	26%	0.256	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.5	-174.8	0	0	0	0	0	112	L391 W392	A375-L391 HydrophobicContact CB-CD1 3.7Å; A375-L391 HydrophobicContact CB-CD2 4.04Å; A375-L391 HydrophobicContact CB-CG 3.92Å; A375-W392 CarbonylContact C-O 3.25Å; A375-W392 WeakPolarHBondContact CA-O 3.49Å
376	L	92.3	Very high	84.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.3	171.4	-62.1	179.4	0	0	0	109.2	P141 I146 A149 L248 F268 V270 Y374 W392	P141-L376 HydrophobicContact CB-CD2 4.22Å; P141-L376 HydrophobicContact CG-CD2 3.99Å; I146-L376 HydrophobicContact CG1-CD1 4.45Å; A149-L376 HydrophobicContact CB-CD1 4.11Å; L248-L376 HydrophobicContact CD2-CD2 3.92Å; F268-L376 HydrophobicContact CD1-CB 4.48Å; V270-L376 HydrophobicContact CG2-CD2 4.04Å; Y374-L376 HydrophobicContact CD2-CD2 4.23Å; Y374-L376 HydrophobicContact CD2-CG 4.43Å; Y374-L376 HydrophobicContact CE2-CD2 3.89Å; Y374-L376 HydrophobicContact CE2-CG 4.01Å; L376-W392 HydrophobicContact CB-CB 4.36Å; L376-W392 HydrophobicContact CB-CE3 4.3Å; L376-W392 HydrophobicContact CD1-CE3 3.83Å; L376-W392 HydrophobicContact CD1-CZ3 4.18Å; L376-W392 HydrophobicContact CG-CE3 4.04Å; L376-W392 PolarHBondContact N-O 3.21Å; L376-W392 PolarHBondContact O-N 3.25Å
377	R	91.4	Very high	84	Confident	42 Å²	42	53 Å²	53	16%	0.158	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.3	176.6	-61.8	175.9	-175.8	-155.3	3	109.3	F268 S269 F271 N272 M379 Q388 L391	F268-R377 CarbonylContact C-O 3.6Å; S269-R377 PolarHBondContact N-O 2.97Å; S269-R377 WeakPolarHBondContact O-CA 3.47Å; S269-R377 WeakPolarHBondContact O-CB 3.39Å; S269-R377 PolarHBondContact O-N 2.59Å; F271-R377 PolarHBondContact O-NE 3.04Å; N272-R377 PolarHBondContact OD1-NH2 3.39Å; R377-M379 HydrophobicContact CB-SD 4.5Å; R377-Q388 HydrophobicContact CB-CG 4.37Å; R377-L391 HydrophobicContact CG-CD1 3.72Å
378	I	91.7	Very high	84.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	118.8	-178.8	-58.9	173.2	0	0	0	107.7	L153 V266 F268 Q388 I389 G390 W392 L398 M400	L153-I378 HydrophobicContact CD1-CG2 4.34Å; L153-I378 HydrophobicContact CD2-CD1 4.02Å; L153-I378 HydrophobicContact CD2-CG2 4.27Å; L153-I378 HydrophobicContact CG-CD1 4.35Å; V266-I378 HydrophobicContact CG1-CG2 3.48Å; V266-I378 VanDerWaalsContact CG1-CG2 3.48Å; F268-I378 HydrophobicContact CD1-CG1 4.16Å; F268-I378 HydrophobicContact CE1-CG1 4.13Å; I378-Q388 WeakPolarHBondContact O-CA 3.46Å; I378-I389 HydrophobicContact CB-CG1 4.27Å; I378-I389 HydrophobicContact CG2-CD1 3.89Å; I378-I389 HydrophobicContact CG2-CG1 3.78Å; I378-I389 WeakPolarHBondContact O-CG1 3.22Å; I378-I389 PolarHBondContact O-N 3.33Å; I378-G390 PolarHBondContact N-O 2.88Å; I378-W392 HydrophobicContact CD1-CB 4.43Å; I378-L398 HydrophobicContact CD1-CD1 3.21Å; I378-M400 HydrophobicContact CD1-SD 4.04Å
379	M	88.1	Confident	84.4	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.02	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.5	-173.9	-58.2	-59.5	-59.6	0	0	109.3	F250 V266 G267 R377 L386 R387 Q388	F250-M379 HydrophobicContact CD1-CB 3.93Å; F250-M379 HydrophobicContact CE1-CB 3.86Å; F250-M379 WeakPolarHBondContact CE1-O 3.43Å; V266-M379 CarbonylContact C-O 3.46Å; V266-M379 VanDerWaalsContact CA-O 3.31Å; V266-M379 WeakPolarHBondContact CA-O 3.35Å; G267-M379 PolarHBondContact N-O 2.04Å; G267-M379 PolarHBondContact O-N 2.84Å; R377-M379 HydrophobicContact CB-SD 4.5Å; M379-L386 HydrophobicContact CE-CB 3.86Å; M379-L386 WeakPolarHBondContact CE-O 3.34Å; M379-R387 CarbonylContact C-O 3.57Å; M379-R387 WeakPolarHBondContact CA-O 3.43Å; M379-Q388 HydrophobicContact CE-CB 4.42Å; M379-Q388 HydrophobicContact SD-CB 3.84Å; M379-Q388 HydrophobicContact SD-CG 4.28Å
380	Q	86.6	Confident	84.6	Confident	39 Å²	39	46.1 Å²	46.1	18%	0.182	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	146.3	176.6	-166.4	-173.3	34.6	0	0	109.9	N264 I265 V266 L386 R387 I389	N264-Q380 PolarHBondContact OD1-NE2 3.4Å; I265-Q380 WeakPolarHBondContact O-CA 3.36Å; V266-Q380 HydrophobicContact CG2-CG 4.38Å; Q380-L386 WeakPolarHBondContact O-CA 3.35Å; Q380-R387 PolarHBondContact N-O 3.33Å; Q380-R387 PolarHBondContact O-N 3.17Å; Q380-I389 HydrophobicContact CB-CD1 3.9Å; Q380-I389 HydrophobicContact CB-CG1 4.1Å; Q380-I389 HydrophobicContact CB-CG2 3.69Å; Q380-I389 HydrophobicContact CG-CD1 4.42Å
381	N	81.8	Confident	84.7	Confident	29 Å²	29	47.3 Å²	47.3	16%	0.155	24%	0.238	C	C	.	.			trans	-64.3	139.8	168.4	-167.6	30.5	0	0	0	112	L255 A259 I265	L255-N381 HydrophobicContact CD1-CB 3.71Å; A259-N381 VanDerWaalsContact CB-ND2 3.28Å; A259-N381 WeakPolarHBondContact CB-ND2 3.48Å; I265-N381 HydrophobicContact CB-CB 4.09Å; I265-N381 PolarHBondContact O-N 2.92Å
382	S	73.9	Confident	84.8	Confident	56 Å²	56	47.7 Å²	47.7	39%	0.392	24%	0.24	S	C	.	.			trans	-151.7	170.5	177.9	-154.5	0	0	0	0	111.4	E384 G385	S382-E384 PolarHBondContact O-N 3.35Å; S382-G385 WeakPolarHBondContact CA-O 2.97Å; S382-G385 VanDerWaalsContact CB-O 3.25Å; S382-G385 WeakPolarHBondContact CB-O 3.33Å; S382-G385 PolarHBondContact N-O 3.18Å; S382-G385 VanDerWaalsContact N-O 3.13Å; S382-G385 PolarHBondContact O-N 2.97Å
383	K	66.4	Low	84.9	Confident	164 Å²	164	48.3 Å²	48.3	71%	0.713	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.4	-176.2	-57	-167.2	-171	-157.1	0	114.2
384	E	66.1	Low	84.6	Confident	203 Å²	203	47.8 Å²	47.8	95%	0.949	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	14.9	177.6	-61.9	175.7	-175.5	0	0	111.5	S382	S382-E384 PolarHBondContact O-N 3.35Å
385	G	74.6	Confident	84.1	Confident	22 Å²	22	55.6 Å²	55.6	23%	0.227	28%	0.276	C	S	.	.	S	Bend	trans	93.1	-160.2	-173.2	0	0	0	0	0	113.2	S382 R387	S382-G385 WeakPolarHBondContact CA-O 2.97Å; S382-G385 VanDerWaalsContact CB-O 3.25Å; S382-G385 WeakPolarHBondContact CB-O 3.33Å; S382-G385 PolarHBondContact N-O 3.18Å; S382-G385 VanDerWaalsContact N-O 3.13Å; S382-G385 PolarHBondContact O-N 2.97Å; G385-R387 PolarHBondContact O-N 3.16Å
386	L	81.5	Confident	83.6	Confident	43 Å²	43	60.4 Å²	60.4	23%	0.225	30%	0.298	C	S	.	.			trans	-70.8	110.7	-174.5	-64.7	179.8	0	0	0	112.7	F250 T251 L255 M379 Q380	F250-L386 HydrophobicContact CD1-CD1 4.22Å; F250-L386 HydrophobicContact CE1-CD1 4.12Å; F250-L386 HydrophobicContact CE1-CD2 3.63Å; F250-L386 HydrophobicContact CE1-CG 4.5Å; F250-L386 HydrophobicContact CZ-CD2 3.9Å; T251-L386 HydrophobicContact CG2-CD1 4.19Å; L255-L386 HydrophobicContact CD1-CD2 3.84Å; M379-L386 HydrophobicContact CE-CB 3.86Å; M379-L386 WeakPolarHBondContact CE-O 3.34Å; Q380-L386 WeakPolarHBondContact O-CA 3.35Å
387	R	83.8	Confident	83.3	Confident	132 Å²	132	61.4 Å²	61.4	50%	0.498	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	140.2	176	173.8	172.5	172.6	171.3	-2.3	111.1	M379 Q380 G385 E401	M379-R387 CarbonylContact C-O 3.57Å; M379-R387 WeakPolarHBondContact CA-O 3.43Å; Q380-R387 PolarHBondContact N-O 3.33Å; Q380-R387 PolarHBondContact O-N 3.17Å; G385-R387 PolarHBondContact O-N 3.16Å; R387-E401 IonicContact NH2-OE2 2.86Å
388	Q	86.8	Confident	83.1	Confident	76 Å²	76	61.8 Å²	61.8	36%	0.355	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	132.1	169.7	-173.5	178.7	-26.4	0	0	110.1	R377 I378 M379	R377-Q388 HydrophobicContact CB-CG 4.37Å; I378-Q388 WeakPolarHBondContact O-CA 3.46Å; M379-Q388 HydrophobicContact CE-CB 4.42Å; M379-Q388 HydrophobicContact SD-CB 3.84Å; M379-Q388 HydrophobicContact SD-CG 4.28Å
389	I	86.6	Confident	82.9	Confident	6 Å²	6	65.5 Å²	65.5	3%	0.031	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	-14.8	-179	56.2	161	0	0	0	114.1	I378 Q380 M400 E401 L404	I378-I389 HydrophobicContact CB-CG1 4.27Å; I378-I389 HydrophobicContact CG2-CD1 3.89Å; I378-I389 HydrophobicContact CG2-CG1 3.78Å; I378-I389 WeakPolarHBondContact O-CG1 3.22Å; I378-I389 PolarHBondContact O-N 3.33Å; Q380-I389 HydrophobicContact CB-CD1 3.9Å; Q380-I389 HydrophobicContact CB-CG1 4.1Å; Q380-I389 HydrophobicContact CB-CG2 3.69Å; Q380-I389 HydrophobicContact CG-CD1 4.42Å; I389-M400 HydrophobicContact CD1-CE 4.05Å; I389-E401 WeakPolarHBondContact O-CB 3.46Å; I389-E401 PolarHBondContact O-N 2.95Å; I389-E401 VanDerWaalsContact O-N 3.12Å; I389-L404 HydrophobicContact CB-CD1 4.16Å; I389-L404 HydrophobicContact CB-CD2 3.95Å; I389-L404 HydrophobicContact CB-CG 4.05Å; I389-L404 HydrophobicContact CD1-CD2 3.91Å; I389-L404 HydrophobicContact CG2-CD2 4.14Å; I389-L404 HydrophobicContact CG2-CG 4.5Å; I389-L404 WeakPolarHBondContact O-CD1 3.48Å
390	G	87.9	Confident	82.5	Confident	5 Å²	5	66.5 Å²	66.5	5%	0.052	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	175.2	-177.8	0	0	0	0	0	112.6	I378 S399	I378-G390 PolarHBondContact N-O 2.88Å; G390-S399 WeakPolarHBondContact CA-O 3.43Å
391	L	90.7	Very high	81.7	Confident	61 Å²	61	69.2 Å²	69.2	32%	0.319	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130	177.6	-165.1	74.5	0	0	0	108	A375 R377 S399	A375-L391 HydrophobicContact CB-CD1 3.7Å; A375-L391 HydrophobicContact CB-CD2 4.04Å; A375-L391 HydrophobicContact CB-CG 3.92Å; R377-L391 HydrophobicContact CG-CD1 3.72Å; L391-S399 PolarHBondContact N-O 3.05Å; L391-S399 CarbonylContact O-C 3.51Å; L391-S399 WeakPolarHBondContact O-CA 3.21Å; L391-S399 WeakPolarHBondContact O-CB 3.32Å; L391-S399 PolarHBondContact O-N 2.76Å
392	W	91.9	Very high	80.2	Confident	11 Å²	11	79.9 Å²	79.9	4%	0.042	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.2	167.4	-178.4	94.6	0	0	0	108.6	D145 L148 A149 A375 L376 I378 G397 L398	D145-W392 HydrophobicContact CB-CH2 3.53Å; D145-W392 HydrophobicContact CB-CZ3 3.78Å; L148-W392 HydrophobicContact CB-CZ2 3.91Å; A149-W392 HydrophobicContact CB-CB 4.28Å; A149-W392 HydrophobicContact CB-CD2 3.73Å; A149-W392 HydrophobicContact CB-CE3 4.29Å; A149-W392 HydrophobicContact CB-CG 3.71Å; A375-W392 CarbonylContact C-O 3.25Å; A375-W392 WeakPolarHBondContact CA-O 3.49Å; L376-W392 HydrophobicContact CB-CB 4.36Å; L376-W392 HydrophobicContact CB-CE3 4.3Å; L376-W392 HydrophobicContact CD1-CE3 3.83Å; L376-W392 HydrophobicContact CD1-CZ3 4.18Å; L376-W392 HydrophobicContact CG-CE3 4.04Å; L376-W392 PolarHBondContact N-O 3.21Å; L376-W392 PolarHBondContact O-N 3.25Å; I378-W392 HydrophobicContact CD1-CB 4.43Å; W392-G397 WeakPolarHBondContact CA-O 3.05Å; W392-L398 HydrophobicContact CB-CD1 4.27Å
393	H	90.5	Very high	78.9	Confident	39 Å²	39	82.1 Å²	82.1	18%	0.181	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	145.7	178.6	-159.3	-129.7	0	0	0	110.2	N373 Y374 E395 D396 G397	N373-H393 PolarHBondContact OD1-CE1 3.4Å; N373-H393 PolarHBondContact OD1-NE2 2.87Å; Y374-H393 PolarHBondContact O-CD2 3.06Å; H393-E395 PolarHBondContact O-N 2.97Å; H393-D396 HydrophobicContact CB-CB 4.2Å; H393-D396 IonicContact CE1-OD2 3.64Å; H393-D396 IonicContact CG-OD2 2.65Å; H393-D396 IonicContact ND1-OD2 2.69Å; H393-D396 PolarHBondContact ND1-OD2 3.25Å; H393-G397 PolarHBondContact N-O 3.03Å; H393-G397 WeakPolarHBondContact O-CA 3.43Å; H393-G397 PolarHBondContact O-N 2.7Å
394	S	81.9	Confident	77.9	Confident	39 Å²	39	75.3 Å²	75.3	27%	0.273	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.6	-175.8	56.8	0	0	0	0	114.1	N373 Y374	N373-S394 WeakPolarHBondContact CA-OG 3.46Å; N373-S394 PolarHBondContact N-OG 2.85Å; Y374-S394 PolarHBondContact O-N 3.33Å
395	E	81	Confident	76.8	Confident	165 Å²	165	70 Å²	70	77%	0.771	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-47.2	178.2	-57.6	-156.9	153.5	0	0	112.8	H393	H393-E395 PolarHBondContact O-N 2.97Å
396	D	80.9	Confident	75	Confident	132 Å²	132	73.2 Å²	73.2	71%	0.706	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-9.7	-175.1	-50.6	-81.7	0	0	0	114.1	H393	H393-D396 HydrophobicContact CB-CB 4.2Å; H393-D396 IonicContact CE1-OD2 3.64Å; H393-D396 IonicContact CG-OD2 2.65Å; H393-D396 IonicContact ND1-OD2 2.69Å; H393-D396 PolarHBondContact ND1-OD2 3.25Å
397	G	85.1	Confident	73.4	Confident	22 Å²	22	76.1 Å²	76.1	23%	0.227	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	72	-144.6	-178.8	0	0	0	0	0	113.6	W392 H393 S399	W392-G397 WeakPolarHBondContact CA-O 3.05Å; H393-G397 PolarHBondContact N-O 3.03Å; H393-G397 WeakPolarHBondContact O-CA 3.43Å; H393-G397 PolarHBondContact O-N 2.7Å; G397-S399 PolarHBondContact O-N 3.34Å
398	L	87.4	Confident	71.3	Confident	49 Å²	49	73.6 Å²	73.6	26%	0.257	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	113.9	-171.8	-176.2	63.4	0	0	0	112.7	G152 L153 F156 I378 W392 M400	G152-L398 VanDerWaalsContact C-CD2 3.46Å; G152-L398 WeakPolarHBondContact O-CD2 3.01Å; L153-L398 HydrophobicContact CD2-CD2 4.35Å; F156-L398 HydrophobicContact CB-CD2 3.93Å; F156-L398 HydrophobicContact CG-CD2 4.49Å; I378-L398 HydrophobicContact CD1-CD1 3.21Å; W392-L398 HydrophobicContact CB-CD1 4.27Å; L398-M400 HydrophobicContact CD1-CG 4.15Å; L398-M400 HydrophobicContact CD1-SD 3.79Å; L398-M400 HydrophobicContact CD2-CG 4.01Å; L398-M400 HydrophobicContact CD2-SD 4.36Å; L398-M400 HydrophobicContact CG-CG 3.9Å; L398-M400 HydrophobicContact CG-SD 4.21Å
399	S	87.4	Confident	69.5	Low	78 Å²	78	71.2 Å²	71.2	55%	0.545	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	99.7	171.6	-174.1	0	0	0	0	110.9	G390 L391 G397	G390-S399 WeakPolarHBondContact CA-O 3.43Å; L391-S399 PolarHBondContact N-O 3.05Å; L391-S399 CarbonylContact O-C 3.51Å; L391-S399 WeakPolarHBondContact O-CA 3.21Å; L391-S399 WeakPolarHBondContact O-CB 3.32Å; L391-S399 PolarHBondContact O-N 2.76Å; G397-S399 PolarHBondContact O-N 3.34Å
400	M	79.5	Confident	67.7	Low	26 Å²	26	74.3 Å²	74.3	13%	0.128	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	140.6	176.1	-66.2	-59.6	-106.8	0	0	111.1	L153 F156 I378 I389 L398 R402 L404	L153-M400 HydrophobicContact CD2-CE 3.71Å; L153-M400 HydrophobicContact CD2-SD 4.45Å; F156-M400 HydrophobicContact CD1-CE 3.72Å; F156-M400 HydrophobicContact CD1-CG 4.44Å; F156-M400 HydrophobicContact CD2-CB 4.36Å; F156-M400 HydrophobicContact CD2-CG 3.81Å; F156-M400 HydrophobicContact CE1-CE 3.62Å; F156-M400 HydrophobicContact CE1-CG 4.39Å; F156-M400 HydrophobicContact CE2-CB 3.86Å; F156-M400 HydrophobicContact CE2-CG 3.75Å; F156-M400 HydrophobicContact CG-CE 4.28Å; F156-M400 HydrophobicContact CG-CG 4.17Å; F156-M400 HydrophobicContact CZ-CB 4.17Å; F156-M400 HydrophobicContact CZ-CE 4.12Å; F156-M400 HydrophobicContact CZ-CG 4.05Å; I378-M400 HydrophobicContact CD1-SD 4.04Å; I389-M400 HydrophobicContact CD1-CE 4.05Å; L398-M400 HydrophobicContact CD1-CG 4.15Å; L398-M400 HydrophobicContact CD1-SD 3.79Å; L398-M400 HydrophobicContact CD2-CG 4.01Å; L398-M400 HydrophobicContact CD2-SD 4.36Å; L398-M400 HydrophobicContact CG-CG 3.9Å; L398-M400 HydrophobicContact CG-SD 4.21Å; M400-R402 PolarHBondContact O-N 3.45Å; M400-L404 HydrophobicContact CB-CD1 3.8Å; M400-L404 HydrophobicContact CE-CD1 3.61Å; M400-L404 HydrophobicContact CG-CD1 4.25Å; M400-L404 HydrophobicContact SD-CD1 4.09Å
401	E	70.1	Confident	65.9	Low	96 Å²	96	79.2 Å²	79.2	45%	0.449	43%	0.426	S	S	.	.			trans	-64.5	120.6	172.6	-168.9	173.7	-135.9	0	0	108.2	R387 I389 T403 L404	R387-E401 IonicContact NH2-OE2 2.86Å; I389-E401 WeakPolarHBondContact O-CB 3.46Å; I389-E401 PolarHBondContact O-N 2.95Å; I389-E401 VanDerWaalsContact O-N 3.12Å; E401-T403 PolarHBondContact O-N 3.48Å; E401-L404 WeakPolarHBondContact O-CB 3.38Å; E401-L404 PolarHBondContact O-N 3.25Å
402	R	50.7	Low	64.1	Low	252 Å²	252	78.6 Å²	78.6	95%	0.951	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-8.3	-174.6	-70.4	-175.2	179.1	-179.3	0.1	114.3	M400	M400-R402 PolarHBondContact O-N 3.45Å
403	T	46	Very low	62.7	Low	103 Å²	103	78.1 Å²	78.1	63%	0.632	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	21.1	172.2	54.8	0	0	0	0	113.2	E401	E401-T403 PolarHBondContact O-N 3.48Å
404	L	45.7	Very low	61.3	Low	22 Å²	22	82.3 Å²	82.3	12%	0.115	44%	0.441	C	S	.	.	S	Bend	trans	-49.1	133.5	142.6	-96.2	142.6	0	0	0	107.5	F156 I389 M400 E401 S406	F156-L404 HydrophobicContact CE1-CD1 4.34Å; F156-L404 HydrophobicContact CZ-CD1 4.02Å; I389-L404 HydrophobicContact CB-CD1 4.16Å; I389-L404 HydrophobicContact CB-CD2 3.95Å; I389-L404 HydrophobicContact CB-CG 4.05Å; I389-L404 HydrophobicContact CD1-CD2 3.91Å; I389-L404 HydrophobicContact CG2-CD2 4.14Å; I389-L404 HydrophobicContact CG2-CG 4.5Å; I389-L404 WeakPolarHBondContact O-CD1 3.48Å; M400-L404 HydrophobicContact CB-CD1 3.8Å; M400-L404 HydrophobicContact CE-CD1 3.61Å; M400-L404 HydrophobicContact CG-CD1 4.25Å; M400-L404 HydrophobicContact SD-CD1 4.09Å; E401-L404 WeakPolarHBondContact O-CB 3.38Å; E401-L404 PolarHBondContact O-N 3.25Å; L404-S406 VanDerWaalsContact C-N 3.31Å; L404-S406 PolarHBondContact O-N 2.97Å
405	P	42.5	Very low	60.5	Low	90 Å²	90	85.5 Å²	85.5	58%	0.584	46%	0.455	S	S	*	.			trans	-62.4	104.2	163.7	27.6	-31.1	0	0	0	106.8	I407	P405-I407 VanDerWaalsContact C-N 3.35Å; P405-I407 PolarHBondContact O-N 3.28Å; P405-I407 VanDerWaalsContact O-N 3.07Å
406	S	38	Very low	60.1	Low	91 Å²	91	79 Å²	79	64%	0.636	43%	0.426	S	S	*	.			trans	-42.3	117.2	132.6	52	0	0	0	0	104.6	L404 N408	L404-S406 VanDerWaalsContact C-N 3.31Å; L404-S406 PolarHBondContact O-N 2.97Å; S406-N408 PolarHBondContact O-N 3.3Å
407	I	46.6	Very low	60.2	Low	103 Å²	103	76.1 Å²	76.1	53%	0.528	41%	0.414	S	S	.	.			trans	-60.3	95.2	-170.1	-62.1	175.3	0	0	0	106.8	P405 V409 T412	P405-I407 VanDerWaalsContact C-N 3.35Å; P405-I407 PolarHBondContact O-N 3.28Å; P405-I407 VanDerWaalsContact O-N 3.07Å; I407-V409 WeakPolarHBondContact O-CG2 3.42Å; I407-V409 PolarHBondContact O-N 2.89Å; I407-T412 HydrophobicContact CG2-CG2 3.63Å
408	N	41	Very low	60.4	Low	79 Å²	79	75.1 Å²	75.1	42%	0.422	40%	0.403	S	S	.	.			trans	-67.8	95.9	174.7	-85.5	-1.8	0	0	0	103.7	S406 T410 D411 T412	S406-N408 PolarHBondContact O-N 3.3Å; N408-T410 PolarHBondContact O-N 3.29Å; N408-T410 VanDerWaalsContact O-N 3.12Å; N408-D411 HydrophobicContact CB-CB 3.95Å; N408-D411 VanDerWaalsContact CB-OD2 3.28Å; N408-D411 WeakPolarHBondContact CB-OD2 3.48Å; N408-D411 PolarHBondContact ND2-OD2 2.99Å; N408-D411 WeakPolarHBondContact O-CA 3.46Å; N408-D411 PolarHBondContact O-N 3.05Å; N408-T412 PolarHBondContact O-N 2.93Å
409	V	48.8	Very low	60.5	Low	26 Å²	26	74.8 Å²	74.8	16%	0.158	40%	0.403	C	S	.	.	H	α-helix	trans	-56.2	-34.6	-173.9	-171	0	0	0	0	109.5	I407 T412 L413 V758 Y759 E762	I407-V409 WeakPolarHBondContact O-CG2 3.42Å; I407-V409 PolarHBondContact O-N 2.89Å; V409-T412 WeakPolarHBondContact CA-OG1 3.34Å; V409-T412 PolarHBondContact O-N 3.27Å; V409-T412 PolarHBondContact O-OG1 3.34Å; V409-L413 HydrophobicContact CG1-CD1 4.38Å; V409-L413 PolarHBondContact O-N 3.11Å; V409-V758 HydrophobicContact CB-CG1 4.46Å; V409-V758 HydrophobicContact CG1-CG1 3.99Å; V409-V758 HydrophobicContact CG2-CG1 3.58Å; V409-Y759 HydrophobicContact CG1-CD1 4.02Å; V409-Y759 HydrophobicContact CG1-CE1 4.49Å; V409-E762 HydrophobicContact CB-CG 4.19Å; V409-E762 HydrophobicContact CG1-CG 3.84Å
410	T	47.9	Very low	60.9	Low	72 Å²	72	71.2 Å²	71.2	44%	0.442	38%	0.378	S	S	.	.	H	α-helix	trans	-52.6	-45.6	167.8	51.7	0	0	0	0	115	N408	N408-T410 PolarHBondContact O-N 3.29Å; N408-T410 VanDerWaalsContact O-N 3.12Å
411	D	49.9	Very low	61.6	Low	108 Å²	108	70 Å²	70	58%	0.578	37%	0.372	S	S	*	.	H	α-helix	trans	-78.1	-26.9	177.2	-69.1	-42.1	0	0	0	112.1	N408	N408-D411 HydrophobicContact CB-CB 3.95Å; N408-D411 VanDerWaalsContact CB-OD2 3.28Å; N408-D411 WeakPolarHBondContact CB-OD2 3.48Å; N408-D411 PolarHBondContact ND2-OD2 2.99Å; N408-D411 WeakPolarHBondContact O-CA 3.46Å; N408-D411 PolarHBondContact O-N 3.05Å
412	T	54.4	Low	62.8	Low	47 Å²	47	65.6 Å²	65.6	29%	0.288	35%	0.351	S	S	.	.	H	α-helix	trans	-79.5	-25.7	177.4	65.7	0	0	0	0	114.6	I407 N408 V409 F414 T416	I407-T412 HydrophobicContact CG2-CG2 3.63Å; N408-T412 PolarHBondContact O-N 2.93Å; V409-T412 WeakPolarHBondContact CA-OG1 3.34Å; V409-T412 PolarHBondContact O-N 3.27Å; V409-T412 PolarHBondContact O-OG1 3.34Å; T412-F414 VanDerWaalsContact C-N 3.31Å; T412-T416 WeakPolarHBondContact O-CG2 3.42Å; T412-T416 PolarHBondContact O-OG1 3.13Å
413	L	61.3	Low	64.9	Low	1 Å²	1	54.7 Å²	54.7	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-74.4	-25.5	171.1	-79	165.8	0	0	0	111.8	V409 N415 T416 L418 F461 Y759 E762	V409-L413 HydrophobicContact CG1-CD1 4.38Å; V409-L413 PolarHBondContact O-N 3.11Å; L413-N415 PolarHBondContact O-N 3.44Å; L413-N415 VanDerWaalsContact O-N 3.12Å; L413-T416 WeakPolarHBondContact CA-OG1 3.38Å; L413-T416 PolarHBondContact O-N 3.27Å; L413-T416 PolarHBondContact O-OG1 3.12Å; L413-L418 HydrophobicContact CD2-CD1 4.09Å; L413-F461 HydrophobicContact CD2-CB 4.29Å; L413-F461 VanDerWaalsContact O-CA 3.26Å; L413-F461 WeakPolarHBondContact O-CA 3.4Å; L413-F461 WeakPolarHBondContact O-CB 3.34Å; L413-Y759 HydrophobicContact CD1-CD1 4.1Å; L413-Y759 HydrophobicContact CD2-CD1 3.65Å; L413-Y759 HydrophobicContact CD2-CE1 3.73Å; L413-Y759 HydrophobicContact CD2-CG 4.28Å; L413-Y759 HydrophobicContact CG-CD1 3.88Å; L413-Y759 HydrophobicContact CG-CE1 3.97Å; L413-E762 HydrophobicContact CD1-CB 4.22Å; L413-E762 HydrophobicContact CD1-CG 4.31Å
414	F	60.6	Low	67.1	Low	128 Å²	128	53.6 Å²	53.6	56%	0.561	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	116	-179.8	-127.8	-84.5	0	0	0	111.2	T412 T416 K460	T412-F414 VanDerWaalsContact C-N 3.31Å; F414-T416 PolarHBondContact O-N 3.35Å; F414-T416 VanDerWaalsContact O-N 3.14Å; F414-K460 HydrophobicContact CD1-CB 4.34Å; F414-K460 HydrophobicContact CD2-CB 3.71Å; F414-K460 HydrophobicContact CD2-CG 4.29Å; F414-K460 HydrophobicContact CE1-CB 4.14Å; F414-K460 HydrophobicContact CE2-CB 3.49Å; F414-K460 VanDerWaalsContact CE2-CB 3.49Å; F414-K460 HydrophobicContact CE2-CG 3.58Å; F414-K460 HydrophobicContact CG-CB 4.14Å; F414-K460 HydrophobicContact CZ-CB 3.73Å; F414-K460 HydrophobicContact CZ-CG 3.72Å
415	N	65.6	Low	69.2	Low	105 Å²	105	53.7 Å²	53.7	56%	0.561	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	7.2	177.4	-161.8	31.4	0	0	0	116.1	L413 K460 K462	L413-N415 PolarHBondContact O-N 3.44Å; L413-N415 VanDerWaalsContact O-N 3.12Å; N415-K460 PolarHBondContact N-O 3.15Å; N415-K460 VanDerWaalsContact N-O 3.15Å; N415-K462 VanDerWaalsContact OD1-CE 3.24Å; N415-K462 WeakPolarHBondContact OD1-CE 3.34Å; N415-K462 PolarHBondContact OD1-NZ 3.26Å
416	T	71.9	Confident	71.5	Confident	29 Å²	29	52.1 Å²	52.1	18%	0.178	29%	0.288	C	S	.	.			trans	-76.3	151.9	166.7	46.9	0	0	0	0	111	T412 L413 F414 K462	T412-T416 WeakPolarHBondContact O-CG2 3.42Å; T412-T416 PolarHBondContact O-OG1 3.13Å; L413-T416 WeakPolarHBondContact CA-OG1 3.38Å; L413-T416 PolarHBondContact O-N 3.27Å; L413-T416 PolarHBondContact O-OG1 3.12Å; F414-T416 PolarHBondContact O-N 3.35Å; F414-T416 VanDerWaalsContact O-N 3.14Å; T416-K462 WeakPolarHBondContact O-CA 3.46Å; T416-K462 WeakPolarHBondContact O-CB 3.34Å; T416-K462 PolarHBondContact O-N 3.38Å; T416-K462 VanDerWaalsContact O-O 3.12Å
417	T	84.1	Confident	74.1	Confident	72 Å²	72	47.8 Å²	47.8	44%	0.442	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	109.1	-179.4	-53	0	0	0	0	110.5	K462	T417-K462 CarbonylContact C-O 3.34Å; T417-K462 VanDerWaalsContact CA-O 3.26Å; T417-K462 WeakPolarHBondContact CA-O 3.42Å; T417-K462 HydrophobicContact CG2-CB 4.28Å
418	L	88.2	Confident	76.4	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	135.5	179.3	-58.6	-178.1	0	0	0	111.5	L413 F461 K462 Y463 R464 D495 L496 Y759 F763	L413-L418 HydrophobicContact CD2-CD1 4.09Å; L418-F461 HydrophobicContact CB-CD2 4.48Å; L418-F461 HydrophobicContact CD1-CB 4.37Å; L418-F461 HydrophobicContact CD1-CD2 3.8Å; L418-F461 HydrophobicContact CD1-CE2 4.23Å; L418-F461 HydrophobicContact CD1-CG 4.02Å; L418-F461 HydrophobicContact CG-CD2 4.19Å; L418-K462 PolarHBondContact N-O 2.86Å; L418-Y463 CarbonylContact O-C 3.6Å; L418-Y463 VanDerWaalsContact O-CA 3.23Å; L418-Y463 WeakPolarHBondContact O-CA 3.4Å; L418-R464 PolarHBondContact O-N 3.26Å; L418-D495 HydrophobicContact CB-CB 4.37Å; L418-D495 HydrophobicContact CD2-CB 4.23Å; L418-L496 HydrophobicContact CD1-CD1 3.84Å; L418-Y759 HydrophobicContact CD2-CE2 4.1Å; L418-F763 HydrophobicContact CD1-CE2 4.46Å; L418-F763 HydrophobicContact CD1-CZ 4.35Å
419	T	90.4	Very high	79	Confident	43 Å²	43	39.3 Å²	39.3	26%	0.264	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	117.8	174.4	-57.6	0	0	0	0	109.6	D495 L496	T419-D495 PolarHBondContact N-OD2 3.06Å; T419-D495 PolarHBondContact O-N 3.48Å; T419-L496 PolarHBondContact O-N 3.06Å
420	I	95.1	Very high	81.1	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.7	-172.7	-58.9	-177	0	0	0	109.1	L452 F461 Y463 R464 R466 L496 V498	I420-L452 HydrophobicContact CD1-CD1 3.35Å; I420-L452 HydrophobicContact CD1-CD2 3.56Å; I420-L452 HydrophobicContact CD1-CG 4.03Å; I420-L452 HydrophobicContact CG2-CD2 4.43Å; I420-F461 HydrophobicContact CD1-CE2 4.49Å; I420-Y463 HydrophobicContact CD1-CD2 4.25Å; I420-Y463 HydrophobicContact CD1-CG 4.04Å; I420-R464 PolarHBondContact N-O 3.42Å; I420-R466 PolarHBondContact O-N 2.98Å; I420-L496 CarbonylContact C-O 3.5Å; I420-L496 WeakPolarHBondContact CA-O 3.38Å; I420-L496 HydrophobicContact CD1-CD1 4.31Å; I420-L496 HydrophobicContact CG1-CB 4.27Å; I420-L496 HydrophobicContact CG1-CD1 4.42Å; I420-V498 HydrophobicContact CG2-CB 3.95Å; I420-V498 HydrophobicContact CG2-CG2 3.77Å
421	T	95.7	Very high	83.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	141.2	172.7	-168.1	0	0	0	0	110.7	R466 M485 E488 A494 L496 A497 V498	T421-R466 WeakPolarHBondContact CA-O 3.48Å; T421-M485 HydrophobicContact CG2-CB 3.92Å; T421-M485 HydrophobicContact CG2-CG 3.93Å; T421-E488 VanDerWaalsContact CB-OE2 3.26Å; T421-E488 WeakPolarHBondContact CB-OE2 3.36Å; T421-E488 PolarHBondContact OG1-OE2 3.05Å; T421-A494 HydrophobicContact CG2-CB 3.73Å; T421-L496 PolarHBondContact N-O 2.99Å; T421-A497 HydrophobicContact CG2-CB 3.69Å; T421-A497 WeakPolarHBondContact O-CA 3.4Å; T421-V498 PolarHBondContact O-N 3.03Å; T421-V498 VanDerWaalsContact O-N 3.16Å
422	T	95.3	Very high	85.3	Confident	4 Å²	4	38.3 Å²	38.3	3%	0.025	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	170.4	178.6	-161.5	0	0	0	0	111.4	V429 I465 R466 L467 V468 M485 V498	T422-V429 HydrophobicContact CG2-CG1 4.13Å; T422-V429 HydrophobicContact CG2-CG2 4.2Å; T422-V429 WeakPolarHBondContact OG1-CG2 3.43Å; T422-I465 HydrophobicContact CG2-CG2 3.67Å; T422-R466 PolarHBondContact N-O 3.45Å; T422-L467 HydrophobicContact CG2-CD2 4Å; T422-L467 WeakPolarHBondContact O-CA 3.37Å; T422-V468 PolarHBondContact O-N 3.45Å; T422-M485 VanDerWaalsContact CA-SD 3.6Å; T422-V498 WeakPolarHBondContact CB-O 3.47Å; T422-V498 PolarHBondContact OG1-O 3.36Å
423	I	93.1	Very high	86.9	Confident	23 Å²	23	41.3 Å²	41.3	12%	0.118	22%	0.218	C	C	.	.			trans	-122.7	145.5	179.5	-171.4	169.6	0	0	0	109.4	E425 V468 G471 Y473 M485 A499	I423-E425 PolarHBondContact O-N 3.08Å; I423-V468 HydrophobicContact CB-CG1 4.21Å; I423-V468 HydrophobicContact CG1-CG1 4.38Å; I423-G471 VanDerWaalsContact CD1-O 3.28Å; I423-G471 WeakPolarHBondContact CD1-O 3.21Å; I423-Y473 HydrophobicContact CD1-CD2 4.41Å; I423-Y473 HydrophobicContact CD1-CE2 4.31Å; I423-Y473 HydrophobicContact CG2-CE1 4.02Å; I423-M485 HydrophobicContact CB-CE 4.02Å; I423-M485 HydrophobicContact CB-SD 4.36Å; I423-M485 HydrophobicContact CG2-CE 3.69Å; I423-M485 HydrophobicContact CG2-SD 4.39Å; I423-A499 HydrophobicContact CG2-CB 4.03Å
424	L	92.3	Very high	88.3	Confident	81 Å²	81	45.4 Å²	45.4	42%	0.424	24%	0.24	S	C	.	.			trans	-74	115.5	174.7	-67.3	179.5	0	0	0	109.6	V429 L431 Y444 L467	L424-V429 HydrophobicContact CD2-CG1 4.22Å; L424-L431 HydrophobicContact CD1-CD1 3.97Å; L424-L431 HydrophobicContact CD1-CG 4.16Å; L424-L431 HydrophobicContact CD2-CD2 4.37Å; L424-L431 HydrophobicContact CD2-CG 4.04Å; L424-Y444 HydrophobicContact CD2-CD1 4.3Å; L424-Y444 HydrophobicContact CD2-CE1 4.22Å; L424-L467 HydrophobicContact CD1-CD1 4.07Å; L424-L467 HydrophobicContact CD2-CD1 4.36Å; L424-L467 HydrophobicContact CD2-CD2 3.84Å; L424-L467 HydrophobicContact CG-CD1 4.07Å; L424-L467 HydrophobicContact CG-CD2 3.87Å
425	E	91	Very high	89.6	Confident	24 Å²	24	42.5 Å²	42.5	11%	0.112	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-158.9	125.8	-177	-161.2	-172.4	-121.8	0	0	111	I423 Y428 V429 Y473 M726	I423-E425 PolarHBondContact O-N 3.08Å; E425-Y428 PolarHBondContact O-N 3.47Å; E425-Y428 WeakPolarHBondContact OE2-CD2 3.48Å; E425-V429 CarbonylContact C-O 3.53Å; E425-V429 PolarHBondContact N-O 3.11Å; E425-V429 PolarHBondContact O-N 3.26Å; E425-Y473 PolarHBondContact OE1-OH 3.39Å; E425-Y473 PolarHBondContact OE2-OH 2.92Å; E425-M726 HydrophobicContact CG-CE 3.52Å; E425-M726 WeakPolarHBondContact OE1-CE 3.37Å; E425-M726 WeakPolarHBondContact OE2-CE 3.41Å
426	N	90.9	Very high	90.6	Very high	57 Å²	57	45.7 Å²	45.7	31%	0.305	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	131.1	-175.9	-56.1	-30.3	0	0	0	111	M430 Y729	N426-M430 HydrophobicContact CB-CG 4.39Å; N426-M430 HydrophobicContact CB-SD 4Å; N426-M430 VanDerWaalsContact OD1-CG 3.27Å; N426-M430 WeakPolarHBondContact OD1-CG 3.17Å; N426-M430 PolarHBondContact OD1-SD 3.36Å; N426-Y729 HydrophobicContact CB-CE1 3.93Å
427	P	92.9	Very high	91.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	cis	-100.2	17.6	-1	39.8	-35.7	0	0	0	114.8	M430 G446 F447 Y729 W783 W784	P427-M430 HydrophobicContact CB-CE 4.38Å; P427-M430 HydrophobicContact CB-SD 4.42Å; P427-G446 CarbonylContact O-C 3.42Å; P427-G446 WeakPolarHBondContact O-CA 3.37Å; P427-F447 PolarHBondContact O-N 3.49Å; P427-Y729 HydrophobicContact CB-CD2 3.97Å; P427-Y729 HydrophobicContact CB-CE2 3.39Å; P427-Y729 HydrophobicContact CG-CD2 3.5Å; P427-Y729 HydrophobicContact CG-CE2 3.5Å; P427-Y729 VanDerWaalsContact CG-CE2 3.5Å; P427-Y729 HydrophobicContact CG-CG 4.21Å; P427-W783 HydrophobicContact CB-CB 4.42Å; P427-W783 HydrophobicContact CB-CE3 4.47Å; P427-W784 HydrophobicContact CG-CD2 4.2Å; P427-W784 HydrophobicContact CG-CE3 3.99Å; P427-W784 HydrophobicContact CG-CH2 3.58Å; P427-W784 HydrophobicContact CG-CZ2 3.77Å; P427-W784 HydrophobicContact CG-CZ3 3.7Å
428	Y	94.1	Very high	91.6	Very high	1 Å²	1	51 Å²	51	0%	0.004	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-51.9	-174.7	-59.1	-84.3	0	0	0	111.8	E425 G446 F447 C448 T725 M726 Y749 W784	E425-Y428 PolarHBondContact O-N 3.47Å; E425-Y428 WeakPolarHBondContact OE2-CD2 3.48Å; Y428-G446 CarbonylContact O-C 3.54Å; Y428-G446 VanDerWaalsContact O-C 3.28Å; Y428-G446 WeakPolarHBondContact O-CA 3.49Å; Y428-F447 HydrophobicContact CD1-CD1 4.29Å; Y428-F447 PolarHBondContact O-N 3.21Å; Y428-C448 WeakPolarHBondContact O-CB 3.15Å; Y428-C448 PolarHBondContact O-N 3.33Å; Y428-T725 WeakPolarHBondContact OH-CB 3.33Å; Y428-T725 PolarHBondContact OH-OG1 3.49Å; Y428-M726 HydrophobicContact CD2-CE 3.93Å; Y428-M726 HydrophobicContact CE2-CE 3.41Å; Y428-M726 VanDerWaalsContact CE2-CE 3.41Å; Y428-M726 HydrophobicContact CE2-SD 3.84Å; Y428-Y749 HydrophobicContact CE1-CD2 4.18Å; Y428-Y749 AromaticContact CE1-CE2 3.73Å; Y428-Y749 HydrophobicContact CE1-CE2 3.73Å; Y428-Y749 AromaticContact CZ-CE2 3.69Å; Y428-Y749 VanDerWaalsContact OH-CE2 3.29Å; Y428-Y749 WeakPolarHBondContact OH-CE2 3.48Å; Y428-Y749 PolarHBondContact OH-OH 2.82Å; Y428-W784 HydrophobicContact CD1-CH2 4.26Å; Y428-W784 AromaticContact CE1-CH2 3.63Å; Y428-W784 HydrophobicContact CE1-CH2 3.63Å; Y428-W784 HydrophobicContact CE1-CZ2 4.11Å; Y428-W784 HydrophobicContact CE2-CH2 4.44Å; Y428-W784 HydrophobicContact CE2-CZ2 4.37Å; Y428-W784 AromaticContact CZ-CH2 3.74Å; Y428-W784 AromaticContact CZ-CZ2 3.74Å; Y428-W784 WeakPolarHBondContact OH-CZ2 3.43Å
429	V	95.3	Very high	91.6	Very high	3 Å²	3	59 Å²	59	2%	0.018	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-143.1	118.8	174.5	-175.9	0	0	0	0	109.4	T422 L424 E425 Y444 C448 V449	T422-V429 HydrophobicContact CG2-CG1 4.13Å; T422-V429 HydrophobicContact CG2-CG2 4.2Å; T422-V429 WeakPolarHBondContact OG1-CG2 3.43Å; L424-V429 HydrophobicContact CD2-CG1 4.22Å; E425-V429 CarbonylContact C-O 3.53Å; E425-V429 PolarHBondContact N-O 3.11Å; E425-V429 PolarHBondContact O-N 3.26Å; V429-Y444 HydrophobicContact CG1-CD1 3.99Å; V429-Y444 HydrophobicContact CG1-CG 4.37Å; V429-C448 HydrophobicContact CG2-CB 3.87Å; V429-V449 HydrophobicContact CG1-CG2 4.15Å; V429-V449 HydrophobicContact CG2-CG2 4.12Å
430	M	93.4	Very high	91.5	Very high	30 Å²	30	58.9 Å²	58.9	15%	0.148	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	153.4	-178	-53.3	-172	-71	0	0	109.1	N426 P427 Y444 E445 W783	N426-M430 HydrophobicContact CB-CG 4.39Å; N426-M430 HydrophobicContact CB-SD 4Å; N426-M430 VanDerWaalsContact OD1-CG 3.27Å; N426-M430 WeakPolarHBondContact OD1-CG 3.17Å; N426-M430 PolarHBondContact OD1-SD 3.36Å; P427-M430 HydrophobicContact CB-CE 4.38Å; P427-M430 HydrophobicContact CB-SD 4.42Å; M430-Y444 WeakPolarHBondContact O-CA 3.42Å; M430-E445 HydrophobicContact CB-CG 4.29Å; M430-E445 HydrophobicContact CE-CG 4.44Å; M430-E445 PolarHBondContact N-O 3.07Å; M430-E445 PolarHBondContact O-N 2.86Å; M430-W783 HydrophobicContact CE-CE3 3.85Å; M430-W783 HydrophobicContact CE-CH2 4.29Å; M430-W783 HydrophobicContact CE-CZ3 3.38Å
431	L	92.8	Very high	91.3	Very high	75 Å²	75	60.6 Å²	60.6	39%	0.393	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	131.9	168.7	-70.2	170.9	0	0	0	109.1	L424 H435 Y444	L424-L431 HydrophobicContact CD1-CD1 3.97Å; L424-L431 HydrophobicContact CD1-CG 4.16Å; L424-L431 HydrophobicContact CD2-CD2 4.37Å; L424-L431 HydrophobicContact CD2-CG 4.04Å; L431-H435 HydrophobicContact CB-CB 4.38Å; L431-H435 HydrophobicContact CD2-CB 4.36Å; L431-Y444 HydrophobicContact CD2-CD1 3.87Å; L431-Y444 HydrophobicContact CD2-CE1 3.63Å
432	R	92.3	Very high	91	Very high	80 Å²	80	65.3 Å²	65.3	30%	0.302	34%	0.338	S	S	.	.			trans	-61.2	150.1	171.5	-66.2	-160.4	178.9	-160.1	-10.3	110.6	N434 H435 D442 R443 Y444 E445	R432-N434 PolarHBondContact O-N 3.13Å; R432-N434 VanDerWaalsContact O-N 3.16Å; R432-H435 VanDerWaalsContact O-CB 3.22Å; R432-H435 WeakPolarHBondContact O-CB 3.1Å; R432-H435 PolarHBondContact O-CD2 2.99Å; R432-H435 VanDerWaalsContact O-CD2 3.25Å; R432-H435 PolarHBondContact O-N 2.68Å; R432-D442 WeakPolarHBondContact CD-O 3.35Å; R432-D442 PolarHBondContact NE-O 3.39Å; R432-D442 VanDerWaalsContact NE-O 3.14Å; R432-R443 PolarHBondContact N-O 3.48Å; R432-Y444 PolarHBondContact NE-O 3.27Å; R432-E445 HydrophobicContact CG-CB 3.98Å; R432-E445 HydrophobicContact CG-CG 3.9Å; R432-E445 IonicContact NE-OE2 2.72Å
433	P	88.9	Confident	90.9	Very high	110 Å²	110	69.1 Å²	69.1	71%	0.714	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-33.5	175	21.3	-32.5	0	0	0	113.1	H435	P433-H435 PolarHBondContact O-N 3.16Å
434	N	90.8	Very high	90.9	Very high	87 Å²	87	68.6 Å²	68.6	47%	0.465	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	24.2	178.2	-65.9	45.3	0	0	0	113.3	R432 Q436 E437	R432-N434 PolarHBondContact O-N 3.13Å; R432-N434 VanDerWaalsContact O-N 3.16Å; N434-Q436 PolarHBondContact O-N 2.74Å; N434-E437 PolarHBondContact ND2-OE2 3.46Å; N434-E437 PolarHBondContact O-N 2.9Å
435	H	86.4	Confident	91.1	Very high	66 Å²	66	67.4 Å²	67.4	31%	0.306	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-13.4	-173.9	72.5	84	0	0	0	115.6	L431 R432 P433 R443	L431-H435 HydrophobicContact CB-CB 4.38Å; L431-H435 HydrophobicContact CD2-CB 4.36Å; R432-H435 VanDerWaalsContact O-CB 3.22Å; R432-H435 WeakPolarHBondContact O-CB 3.1Å; R432-H435 PolarHBondContact O-CD2 2.99Å; R432-H435 VanDerWaalsContact O-CD2 3.25Å; R432-H435 PolarHBondContact O-N 2.68Å; P433-H435 PolarHBondContact O-N 3.16Å; H435-R443 HydrophobicContact CB-CB 4.34Å
436	Q	87.4	Confident	91.2	Very high	173 Å²	173	66.2 Å²	66.2	81%	0.808	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-23.5	177.8	-59.4	-173.8	6.8	0	0	112.7	N434	N434-Q436 PolarHBondContact O-N 2.74Å
437	E	88.9	Confident	91.5	Very high	155 Å²	155	63.5 Å²	63.5	72%	0.724	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-11.8	-179.1	-58.9	175.2	155.3	0	0	112.4	N434	N434-E437 PolarHBondContact ND2-OE2 3.46Å; N434-E437 PolarHBondContact O-N 2.9Å
438	L	88.4	Confident	91.6	Very high	57 Å²	57	63.7 Å²	63.7	30%	0.298	32%	0.321	S	S	.	.			trans	-105.5	145.4	-175.7	-62.9	171.9	0	0	0	110.2	D442 R443	L438-D442 WeakPolarHBondContact CD1-O 3.44Å; L438-R443 HydrophobicContact CB-CG 3.9Å; L438-R443 WeakPolarHBondContact O-CD 3.35Å; L438-R443 WeakPolarHBondContact O-CG 3.42Å
439	E	87.4	Confident	91.7	Very high	169 Å²	169	63.8 Å²	63.8	79%	0.79	32%	0.322	S	S	*	.			trans	-111.1	164.1	176.6	-66.6	-163.4	162	0	0	112.4	N441	E439-N441 PolarHBondContact O-N 2.9Å
440	G	88.6	Confident	91.7	Very high	39 Å²	39	65.1 Å²	65.1	40%	0.402	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-126.8	174	0	0	0	0	0	114.2	R443	G440-R443 PolarHBondContact O-NE 3.02Å; G440-R443 PolarHBondContact O-NH2 2.96Å
441	N	91.1	Very high	91.8	Very high	38 Å²	38	63.7 Å²	63.7	20%	0.203	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-27.9	-173.8	-64.8	-21.2	0	0	0	113.1	E439 R443 Y444 Y463 R464 I465	E439-N441 PolarHBondContact O-N 2.9Å; N441-R443 PolarHBondContact O-N 2.86Å; N441-R443 VanDerWaalsContact O-N 3.12Å; N441-Y444 PolarHBondContact O-N 2.61Å; N441-Y444 VanDerWaalsContact O-N 3.13Å; N441-Y463 HydrophobicContact CB-CE2 4.35Å; N441-Y463 WeakPolarHBondContact ND2-CD2 3.45Å; N441-Y463 WeakPolarHBondContact ND2-CE2 3.38Å; N441-Y463 PolarHBondContact ND2-O 3.25Å; N441-R464 WeakPolarHBondContact OD1-CA 3.46Å; N441-I465 HydrophobicContact CB-CD1 4.48Å; N441-I465 PolarHBondContact OD1-N 3.07Å
442	D	89.5	Confident	91.9	Very high	99 Å²	99	60.3 Å²	60.3	53%	0.529	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.1	-172.3	-66.4	-45.1	0	0	0	113.6	R432 L438 Y444	R432-D442 WeakPolarHBondContact CD-O 3.35Å; R432-D442 PolarHBondContact NE-O 3.39Å; R432-D442 VanDerWaalsContact NE-O 3.14Å; L438-D442 WeakPolarHBondContact CD1-O 3.44Å; D442-Y444 PolarHBondContact O-N 2.62Å
443	R	92.8	Very high	92	Very high	84 Å²	84	59.6 Å²	59.6	32%	0.317	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.9	170.9	-64.5	-179.5	-64.3	164.1	8.7	113.6	R432 H435 L438 G440 N441	R432-R443 PolarHBondContact N-O 3.48Å; H435-R443 HydrophobicContact CB-CB 4.34Å; L438-R443 HydrophobicContact CB-CG 3.9Å; L438-R443 WeakPolarHBondContact O-CD 3.35Å; L438-R443 WeakPolarHBondContact O-CG 3.42Å; G440-R443 PolarHBondContact O-NE 3.02Å; G440-R443 PolarHBondContact O-NH2 2.96Å; N441-R443 PolarHBondContact O-N 2.86Å; N441-R443 VanDerWaalsContact O-N 3.12Å
444	Y	94.4	Very high	92.2	Very high	13 Å²	13	56.5 Å²	56.5	5%	0.051	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	150.3	-175.1	-53.2	-75	0	0	0	112	L424 V429 M430 L431 R432 N441 D442 I465 L467	L424-Y444 HydrophobicContact CD2-CD1 4.3Å; L424-Y444 HydrophobicContact CD2-CE1 4.22Å; V429-Y444 HydrophobicContact CG1-CD1 3.99Å; V429-Y444 HydrophobicContact CG1-CG 4.37Å; M430-Y444 WeakPolarHBondContact O-CA 3.42Å; L431-Y444 HydrophobicContact CD2-CD1 3.87Å; L431-Y444 HydrophobicContact CD2-CE1 3.63Å; R432-Y444 PolarHBondContact NE-O 3.27Å; N441-Y444 PolarHBondContact O-N 2.61Å; N441-Y444 VanDerWaalsContact O-N 3.13Å; D442-Y444 PolarHBondContact O-N 2.62Å; Y444-I465 HydrophobicContact CD2-CB 4.03Å; Y444-I465 HydrophobicContact CD2-CD1 4.13Å; Y444-I465 HydrophobicContact CD2-CG2 3.81Å; Y444-I465 HydrophobicContact CE2-CB 4.07Å; Y444-I465 HydrophobicContact CE2-CG2 3.8Å; Y444-I465 HydrophobicContact CG-CG2 4.39Å; Y444-L467 HydrophobicContact CE1-CD1 4.23Å; Y444-L467 HydrophobicContact CE1-CD2 3.99Å; Y444-L467 HydrophobicContact CE1-CG 4.18Å
445	E	94.6	Very high	92.4	Very high	55 Å²	55	52.4 Å²	52.4	26%	0.257	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	161	170.3	66.8	-174.2	179.3	0	0	110.4	M430 R432 W783	M430-E445 HydrophobicContact CB-CG 4.29Å; M430-E445 HydrophobicContact CE-CG 4.44Å; M430-E445 PolarHBondContact N-O 3.07Å; M430-E445 PolarHBondContact O-N 2.86Å; R432-E445 HydrophobicContact CG-CB 3.98Å; R432-E445 HydrophobicContact CG-CG 3.9Å; R432-E445 IonicContact NE-OE2 2.72Å; E445-W783 HydrophobicContact CB-CH2 4.04Å; E445-W783 HydrophobicContact CG-CH2 4.23Å
446	G	94.6	Very high	92.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	135.5	173.2	-179.1	0	0	0	0	0	113.1	P427 Y428 C448 V449 D450 W783	P427-G446 CarbonylContact O-C 3.42Å; P427-G446 WeakPolarHBondContact O-CA 3.37Å; Y428-G446 CarbonylContact O-C 3.54Å; Y428-G446 VanDerWaalsContact O-C 3.28Å; Y428-G446 WeakPolarHBondContact O-CA 3.49Å; G446-C448 PolarHBondContact O-N 3.04Å; G446-V449 WeakPolarHBondContact O-CB 3.27Å; G446-V449 PolarHBondContact O-N 3.44Å; G446-V449 VanDerWaalsContact O-N 3.08Å; G446-D450 PolarHBondContact O-N 3.1Å; G446-W783 VanDerWaalsContact CA-CZ2 3.46Å; G446-W783 VanDerWaalsContact N-CH2 3.32Å; G446-W783 VanDerWaalsContact N-CZ2 3.3Å
447	F	95.8	Very high	92.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-56.7	-45.6	-175.3	175.3	-86.8	0	0	0	112.9	P427 Y428 V449 D450 M451 F517 M518 L776 L779 K780 W783 W784	P427-F447 PolarHBondContact O-N 3.49Å; Y428-F447 HydrophobicContact CD1-CD1 4.29Å; Y428-F447 PolarHBondContact O-N 3.21Å; F447-V449 VanDerWaalsContact C-N 3.31Å; F447-V449 PolarHBondContact O-N 2.96Å; F447-D450 PolarHBondContact O-N 3.24Å; F447-M451 HydrophobicContact CE1-CB 4.47Å; F447-M451 HydrophobicContact CE1-SD 3.93Å; F447-M451 HydrophobicContact CZ-SD 4.39Å; F447-M451 VanDerWaalsContact O-CB 3.26Å; F447-M451 WeakPolarHBondContact O-CB 3.37Å; F447-M451 PolarHBondContact O-N 2.99Å; F447-F517 HydrophobicContact CD1-CE2 4.49Å; F447-F517 AromaticContact CE1-CD2 3.88Å; F447-F517 HydrophobicContact CE1-CD2 3.88Å; F447-F517 AromaticContact CE1-CE2 3.68Å; F447-F517 HydrophobicContact CE1-CE2 3.68Å; F447-F517 HydrophobicContact CZ-CD2 4.35Å; F447-M518 HydrophobicContact CD1-CE 4.41Å; F447-M518 HydrophobicContact CD2-CE 4.42Å; F447-M518 HydrophobicContact CE1-CE 3.86Å; F447-M518 HydrophobicContact CE2-CE 3.83Å; F447-M518 HydrophobicContact CZ-CE 3.53Å; F447-L776 HydrophobicContact CZ-CD2 4.48Å; F447-L779 HydrophobicContact CD2-CB 3.88Å; F447-L779 HydrophobicContact CE2-CB 3.65Å; F447-K780 HydrophobicContact CE2-CB 4.2Å; F447-W783 VanDerWaalsContact CA-CD1 3.48Å; F447-W783 HydrophobicContact CB-CB 4.24Å; F447-W783 HydrophobicContact CB-CG 4.01Å; F447-W784 HydrophobicContact CB-CH2 4.35Å; F447-W784 HydrophobicContact CB-CZ3 3.85Å; F447-W784 AromaticContact CD2-CZ3 3.84Å; F447-W784 HydrophobicContact CD2-CZ3 3.84Å; F447-W784 HydrophobicContact CG-CH2 4.36Å; F447-W784 AromaticContact CG-CZ3 3.89Å; F447-W784 HydrophobicContact CG-CZ3 3.89Å
448	C	95.9	Very high	92.9	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.02	22%	0.215	C	C	.	.	H	α-helix	trans	-69.3	-31.5	179.3	-74.6	0	0	0	0	111.9	Y428 V429 G446 L452 V498	Y428-C448 WeakPolarHBondContact O-CB 3.15Å; Y428-C448 PolarHBondContact O-N 3.33Å; V429-C448 HydrophobicContact CG2-CB 3.87Å; G446-C448 PolarHBondContact O-N 3.04Å; C448-L452 WeakPolarHBondContact O-CB 3.37Å; C448-L452 PolarHBondContact O-N 3.23Å; C448-V498 HydrophobicContact CB-CG1 4.01Å
449	V	95.7	Very high	92.9	Very high	4 Å²	4	40 Å²	40	2%	0.024	21%	0.206	C	C	.	.	H	α-helix	trans	-69.2	-40.3	177.7	-174.4	0	0	0	0	111.1	V429 G446 F447 K453 I465	V429-V449 HydrophobicContact CG1-CG2 4.15Å; V429-V449 HydrophobicContact CG2-CG2 4.12Å; G446-V449 WeakPolarHBondContact O-CB 3.27Å; G446-V449 PolarHBondContact O-N 3.44Å; G446-V449 VanDerWaalsContact O-N 3.08Å; F447-V449 VanDerWaalsContact C-N 3.31Å; F447-V449 PolarHBondContact O-N 2.96Å; V449-K453 WeakPolarHBondContact O-CG 3.49Å; V449-K453 PolarHBondContact O-N 2.81Å; V449-I465 HydrophobicContact CG1-CD1 4.29Å; V449-I465 HydrophobicContact CG2-CD1 4.5Å
450	D	95.7	Very high	92.9	Very high	31 Å²	31	36.6 Å²	36.6	17%	0.166	19%	0.188	C	C	.	.	H	α-helix	trans	-78.7	-39.6	178.6	-69.4	-19.7	0	0	0	112.7	G446 F447 L452 K453 E454 L779 W783	G446-D450 PolarHBondContact O-N 3.1Å; F447-D450 PolarHBondContact O-N 3.24Å; D450-L452 PolarHBondContact O-N 2.85Å; D450-K453 WeakPolarHBondContact O-CB 3.49Å; D450-K453 PolarHBondContact O-N 2.98Å; D450-K453 VanDerWaalsContact O-N 3.11Å; D450-K453 IonicContact OD1-NZ 3.56Å; D450-K453 PolarHBondContact OD1-NZ 3.46Å; D450-E454 WeakPolarHBondContact O-CG 3.41Å; D450-E454 PolarHBondContact O-N 3.43Å; D450-E454 VanDerWaalsContact O-N 3.11Å; D450-L779 HydrophobicContact CB-CD2 3.92Å; D450-W783 WeakPolarHBondContact OD2-CZ2 3.5Å; D450-W783 PolarHBondContact OD2-NE1 3.17Å
451	M	95.2	Very high	92.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-55.9	-39.8	170.7	-178.1	-176.2	76	0	0	111.1	F447 E454 L455 V498 F517 I751 L776 L779	F447-M451 HydrophobicContact CE1-CB 4.47Å; F447-M451 HydrophobicContact CE1-SD 3.93Å; F447-M451 HydrophobicContact CZ-SD 4.39Å; F447-M451 VanDerWaalsContact O-CB 3.26Å; F447-M451 WeakPolarHBondContact O-CB 3.37Å; F447-M451 PolarHBondContact O-N 2.99Å; M451-E454 PolarHBondContact O-N 2.86Å; M451-L455 HydrophobicContact CG-CD1 4.24Å; M451-L455 WeakPolarHBondContact O-CG 3.46Å; M451-L455 PolarHBondContact O-N 3.42Å; M451-V498 HydrophobicContact CE-CG1 3.75Å; M451-F517 HydrophobicContact CE-CD1 4.15Å; M451-F517 HydrophobicContact CE-CD2 4.41Å; M451-F517 HydrophobicContact CE-CE1 4.15Å; M451-F517 HydrophobicContact CE-CE2 4.43Å; M451-F517 HydrophobicContact CE-CG 4.28Å; M451-F517 HydrophobicContact CE-CZ 4.29Å; M451-F517 HydrophobicContact SD-CB 4.13Å; M451-F517 HydrophobicContact SD-CD1 4.26Å; M451-F517 HydrophobicContact SD-CD2 3.77Å; M451-F517 HydrophobicContact SD-CE2 4.24Å; M451-F517 HydrophobicContact SD-CG 3.79Å; M451-I751 HydrophobicContact CE-CD1 4.31Å; M451-I751 HydrophobicContact CE-CG1 4.48Å; M451-L776 HydrophobicContact CG-CD2 3.9Å; M451-L776 HydrophobicContact SD-CD2 3.9Å; M451-L779 HydrophobicContact CB-CD1 4.23Å
452	L	95	Very high	92.9	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-67.8	-33.6	178.2	178.2	61.8	0	0	0	113.2	I420 C448 D450 A456 F461 Y463 I465	I420-L452 HydrophobicContact CD1-CD1 3.35Å; I420-L452 HydrophobicContact CD1-CD2 3.56Å; I420-L452 HydrophobicContact CD1-CG 4.03Å; I420-L452 HydrophobicContact CG2-CD2 4.43Å; C448-L452 WeakPolarHBondContact O-CB 3.37Å; C448-L452 PolarHBondContact O-N 3.23Å; D450-L452 PolarHBondContact O-N 2.85Å; L452-A456 WeakPolarHBondContact O-CB 3.45Å; L452-A456 PolarHBondContact O-N 3.16Å; L452-F461 HydrophobicContact CD1-CE2 4.06Å; L452-F461 HydrophobicContact CD1-CZ 3.97Å; L452-Y463 HydrophobicContact CD1-CD1 4.48Å; L452-Y463 HydrophobicContact CD2-CD2 3.64Å; L452-Y463 HydrophobicContact CD2-CE1 4.43Å; L452-Y463 HydrophobicContact CD2-CE2 3.52Å; L452-Y463 HydrophobicContact CD2-CG 4.14Å; L452-Y463 HydrophobicContact CG-CD1 4.2Å; L452-Y463 HydrophobicContact CG-CD2 4.2Å; L452-Y463 HydrophobicContact CG-CE1 4.01Å; L452-Y463 HydrophobicContact CG-CE2 4.01Å; L452-Y463 HydrophobicContact CG-CG 4.29Å; L452-I465 HydrophobicContact CD2-CD1 4.34Å; L452-I465 HydrophobicContact CD2-CG1 4.26Å
453	K	94.6	Very high	93	Very high	65 Å²	65	35.7 Å²	35.7	28%	0.283	17%	0.166	S	C	.	.	H	α-helix	trans	-63.8	-46.9	171.2	-67.6	166.3	-164.7	157.5	0	110.9	V449 D450 L455 A456 D457 Y463	V449-K453 WeakPolarHBondContact O-CG 3.49Å; V449-K453 PolarHBondContact O-N 2.81Å; D450-K453 WeakPolarHBondContact O-CB 3.49Å; D450-K453 PolarHBondContact O-N 2.98Å; D450-K453 VanDerWaalsContact O-N 3.11Å; D450-K453 IonicContact OD1-NZ 3.56Å; D450-K453 PolarHBondContact OD1-NZ 3.46Å; K453-L455 VanDerWaalsContact C-N 3.31Å; K453-L455 PolarHBondContact O-N 3.34Å; K453-A456 CarbonylContact O-C 3.58Å; K453-A456 PolarHBondContact O-N 2.7Å; K453-D457 WeakPolarHBondContact O-CB 3.37Å; K453-D457 PolarHBondContact O-N 2.91Å; K453-Y463 WeakPolarHBondContact CG-OH 3.43Å
454	E	94.3	Very high	93	Very high	45 Å²	45	39.9 Å²	39.9	21%	0.21	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-41.1	178	-59.8	-87.3	138.1	0	0	111.5	D450 M451 D457 I458 L770 R775 L779	D450-E454 WeakPolarHBondContact O-CG 3.41Å; D450-E454 PolarHBondContact O-N 3.43Å; D450-E454 VanDerWaalsContact O-N 3.11Å; M451-E454 PolarHBondContact O-N 2.86Å; E454-D457 PolarHBondContact O-N 3.33Å; E454-I458 WeakPolarHBondContact O-CG1 3.27Å; E454-I458 PolarHBondContact O-N 3.27Å; E454-L770 HydrophobicContact CB-CD1 4.27Å; E454-L770 HydrophobicContact CB-CD2 3.94Å; E454-R775 IonicContact OE1-CZ 3.73Å; E454-R775 IonicContact OE1-NE 3.66Å; E454-R775 IonicContact OE1-NH2 3.65Å; E454-R775 PolarHBondContact OE1-NH2 2.89Å; E454-R775 IonicContact OE2-CZ 2.76Å; E454-R775 VanDerWaalsContact OE2-CZ 3.3Å; E454-R775 IonicContact OE2-NE 2.65Å; E454-R775 PolarHBondContact OE2-NE 3.04Å; E454-R775 IonicContact OE2-NH2 3.73Å; E454-R775 PolarHBondContact OE2-NH2 3.24Å; E454-L779 HydrophobicContact CG-CD1 4.32Å
455	L	93.5	Very high	93	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-43.5	174.1	-71.9	169.7	0	0	0	112	M451 K453 D457 I458 L459 F461 I751 F763 A766 I767 L770	M451-L455 HydrophobicContact CG-CD1 4.24Å; M451-L455 WeakPolarHBondContact O-CG 3.46Å; M451-L455 PolarHBondContact O-N 3.42Å; K453-L455 VanDerWaalsContact C-N 3.31Å; K453-L455 PolarHBondContact O-N 3.34Å; L455-D457 VanDerWaalsContact C-N 3.31Å; L455-D457 PolarHBondContact O-N 3.27Å; L455-I458 PolarHBondContact O-N 3.42Å; L455-L459 WeakPolarHBondContact O-CB 3.26Å; L455-L459 PolarHBondContact O-N 2.73Å; L455-F461 HydrophobicContact CB-CE1 4.35Å; L455-F461 HydrophobicContact CB-CZ 4.28Å; L455-I751 HydrophobicContact CD1-CD1 3.67Å; L455-F763 HydrophobicContact CB-CE1 4.45Å; L455-F763 HydrophobicContact CD1-CD1 4.3Å; L455-F763 HydrophobicContact CD1-CE1 4.22Å; L455-F763 HydrophobicContact CD2-CD1 4.47Å; L455-A766 HydrophobicContact CD2-CB 3.68Å; L455-I767 HydrophobicContact CD2-CG1 4.27Å; L455-L770 HydrophobicContact CD2-CD1 3.63Å; L455-L770 HydrophobicContact CG-CD1 3.88Å
456	A	92.9	Very high	93	Very high	11 Å²	11	43.2 Å²	43.2	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-64.6	-34.3	175.1	0	0	0	0	0	112.4	L452 K453 K460 F461 Y463	L452-A456 WeakPolarHBondContact O-CB 3.45Å; L452-A456 PolarHBondContact O-N 3.16Å; K453-A456 CarbonylContact O-C 3.58Å; K453-A456 PolarHBondContact O-N 2.7Å; A456-K460 WeakPolarHBondContact O-CA 3.27Å; A456-K460 PolarHBondContact O-N 3.18Å; A456-F461 HydrophobicContact CB-CD2 4.37Å; A456-F461 HydrophobicContact CB-CE1 4.22Å; A456-F461 HydrophobicContact CB-CE2 4.01Å; A456-F461 HydrophobicContact CB-CZ 3.91Å; A456-Y463 HydrophobicContact CB-CD1 3.87Å; A456-Y463 HydrophobicContact CB-CE1 3.75Å
457	D	91.5	Very high	92.9	Very high	103 Å²	103	46.1 Å²	46.1	55%	0.551	21%	0.207	S	C	*	.	H	α-helix	trans	-73	-28.1	175.2	-84.7	-35.8	0	0	0	113.1	K453 E454 L455 K460	K453-D457 WeakPolarHBondContact O-CB 3.37Å; K453-D457 PolarHBondContact O-N 2.91Å; E454-D457 PolarHBondContact O-N 3.33Å; L455-D457 VanDerWaalsContact C-N 3.31Å; L455-D457 PolarHBondContact O-N 3.27Å; D457-K460 WeakPolarHBondContact O-CD 3.4Å; D457-K460 WeakPolarHBondContact O-CE 3.48Å; D457-K460 PolarHBondContact O-NZ 3.13Å
458	I	89.9	Confident	92.9	Very high	57 Å²	57	46.7 Å²	46.7	29%	0.292	21%	0.211	S	C	.	.	H	α-helix	trans	-78.9	-51.9	173.5	-69.4	167.1	0	0	0	110.9	E454 L455 A766 L770	E454-I458 WeakPolarHBondContact O-CG1 3.27Å; E454-I458 PolarHBondContact O-N 3.27Å; L455-I458 PolarHBondContact O-N 3.42Å; I458-A766 HydrophobicContact CG2-CB 4.2Å; I458-L770 HydrophobicContact CD1-CD1 4.41Å; I458-L770 HydrophobicContact CD1-CD2 3.6Å; I458-L770 HydrophobicContact CD1-CG 3.8Å
459	L	88.9	Confident	92.4	Very high	21 Å²	21	50 Å²	50	11%	0.11	25%	0.245	C	C	.	.	H	α-helix	trans	-91.9	-4.3	-171.1	-65.1	175.1	0	0	0	114.2	L455 F461 E762 F763 A766	L455-L459 WeakPolarHBondContact O-CB 3.26Å; L455-L459 PolarHBondContact O-N 2.73Å; L459-F461 VanDerWaalsContact C-N 3.26Å; L459-F461 HydrophobicContact CB-CD1 3.61Å; L459-F461 HydrophobicContact CB-CE1 3.85Å; L459-F461 HydrophobicContact CD1-CD1 4.46Å; L459-F461 HydrophobicContact CD1-CE1 4.09Å; L459-F461 PolarHBondContact O-N 3.09Å; L459-E762 HydrophobicContact CD2-CB 4.27Å; L459-F763 HydrophobicContact CD1-CD1 4.09Å; L459-F763 HydrophobicContact CD1-CD2 3.93Å; L459-F763 HydrophobicContact CD1-CE1 4.06Å; L459-F763 HydrophobicContact CD1-CE2 3.91Å; L459-F763 HydrophobicContact CD1-CG 4.03Å; L459-F763 HydrophobicContact CD1-CZ 3.97Å; L459-A766 HydrophobicContact CD1-CB 3.91Å; L459-A766 HydrophobicContact CD2-CB 4.2Å; L459-A766 HydrophobicContact CG-CB 4.02Å
460	K	87.1	Confident	92	Very high	97 Å²	97	53.7 Å²	53.7	42%	0.422	27%	0.265	S	S	.	.			trans	57.8	26.4	174.3	-56.4	-53.8	-170.6	-164.5	0	116.3	F414 N415 A456 D457	F414-K460 HydrophobicContact CD1-CB 4.34Å; F414-K460 HydrophobicContact CD2-CB 3.71Å; F414-K460 HydrophobicContact CD2-CG 4.29Å; F414-K460 HydrophobicContact CE1-CB 4.14Å; F414-K460 HydrophobicContact CE2-CB 3.49Å; F414-K460 VanDerWaalsContact CE2-CB 3.49Å; F414-K460 HydrophobicContact CE2-CG 3.58Å; F414-K460 HydrophobicContact CG-CB 4.14Å; F414-K460 HydrophobicContact CZ-CB 3.73Å; F414-K460 HydrophobicContact CZ-CG 3.72Å; N415-K460 PolarHBondContact N-O 3.15Å; N415-K460 VanDerWaalsContact N-O 3.15Å; A456-K460 WeakPolarHBondContact O-CA 3.27Å; A456-K460 PolarHBondContact O-N 3.18Å; D457-K460 WeakPolarHBondContact O-CD 3.4Å; D457-K460 WeakPolarHBondContact O-CE 3.48Å; D457-K460 PolarHBondContact O-NZ 3.13Å
461	F	88.8	Confident	91.5	Very high	8 Å²	8	54.4 Å²	54.4	4%	0.035	28%	0.28	C	S	.	.			trans	-85.7	154.7	169.7	67.3	-90	0	0	0	112.4	L413 L418 I420 L452 L455 A456 L459 Y463 F763	L413-F461 HydrophobicContact CD2-CB 4.29Å; L413-F461 VanDerWaalsContact O-CA 3.26Å; L413-F461 WeakPolarHBondContact O-CA 3.4Å; L413-F461 WeakPolarHBondContact O-CB 3.34Å; L418-F461 HydrophobicContact CB-CD2 4.48Å; L418-F461 HydrophobicContact CD1-CB 4.37Å; L418-F461 HydrophobicContact CD1-CD2 3.8Å; L418-F461 HydrophobicContact CD1-CE2 4.23Å; L418-F461 HydrophobicContact CD1-CG 4.02Å; L418-F461 HydrophobicContact CG-CD2 4.19Å; I420-F461 HydrophobicContact CD1-CE2 4.49Å; L452-F461 HydrophobicContact CD1-CE2 4.06Å; L452-F461 HydrophobicContact CD1-CZ 3.97Å; L455-F461 HydrophobicContact CB-CE1 4.35Å; L455-F461 HydrophobicContact CB-CZ 4.28Å; A456-F461 HydrophobicContact CB-CD2 4.37Å; A456-F461 HydrophobicContact CB-CE1 4.22Å; A456-F461 HydrophobicContact CB-CE2 4.01Å; A456-F461 HydrophobicContact CB-CZ 3.91Å; L459-F461 VanDerWaalsContact C-N 3.26Å; L459-F461 HydrophobicContact CB-CD1 3.61Å; L459-F461 HydrophobicContact CB-CE1 3.85Å; L459-F461 HydrophobicContact CD1-CD1 4.46Å; L459-F461 HydrophobicContact CD1-CE1 4.09Å; L459-F461 PolarHBondContact O-N 3.09Å; F461-Y463 HydrophobicContact CD2-CD1 4.33Å; F461-Y463 AromaticContact CE2-CD1 3.9Å; F461-Y463 HydrophobicContact CE2-CD1 3.9Å; F461-Y463 HydrophobicContact CE2-CG 4.33Å; F461-F763 HydrophobicContact CD1-CZ 4.29Å; F461-F763 HydrophobicContact CE1-CE1 4.05Å; F461-F763 HydrophobicContact CE1-CE2 4.5Å; F461-F763 AromaticContact CE1-CZ 3.59Å; F461-F763 HydrophobicContact CE1-CZ 3.59Å; F461-F763 HydrophobicContact CZ-CE1 4.08Å; F461-F763 AromaticContact CZ-CZ 3.76Å; F461-F763 HydrophobicContact CZ-CZ 3.76Å
462	K	90	Very high	91.2	Very high	114 Å²	114	57 Å²	57	50%	0.496	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	156.9	164.1	-72.4	171.2	173.2	166.6	0	109	N415 T416 T417 L418	N415-K462 VanDerWaalsContact OD1-CE 3.24Å; N415-K462 WeakPolarHBondContact OD1-CE 3.34Å; N415-K462 PolarHBondContact OD1-NZ 3.26Å; T416-K462 WeakPolarHBondContact O-CA 3.46Å; T416-K462 WeakPolarHBondContact O-CB 3.34Å; T416-K462 PolarHBondContact O-N 3.38Å; T416-K462 VanDerWaalsContact O-O 3.12Å; T417-K462 CarbonylContact C-O 3.34Å; T417-K462 VanDerWaalsContact CA-O 3.26Å; T417-K462 WeakPolarHBondContact CA-O 3.42Å; T417-K462 HydrophobicContact CG2-CB 4.28Å; L418-K462 PolarHBondContact N-O 2.86Å
463	Y	92.4	Very high	90.8	Very high	35 Å²	35	58.1 Å²	58.1	14%	0.137	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	160.5	178	63.4	-92.9	0	0	0	113.3	L418 I420 N441 L452 K453 A456 F461 I465	L418-Y463 CarbonylContact O-C 3.6Å; L418-Y463 VanDerWaalsContact O-CA 3.23Å; L418-Y463 WeakPolarHBondContact O-CA 3.4Å; I420-Y463 HydrophobicContact CD1-CD2 4.25Å; I420-Y463 HydrophobicContact CD1-CG 4.04Å; N441-Y463 HydrophobicContact CB-CE2 4.35Å; N441-Y463 WeakPolarHBondContact ND2-CD2 3.45Å; N441-Y463 WeakPolarHBondContact ND2-CE2 3.38Å; N441-Y463 PolarHBondContact ND2-O 3.25Å; L452-Y463 HydrophobicContact CD1-CD1 4.48Å; L452-Y463 HydrophobicContact CD2-CD2 3.64Å; L452-Y463 HydrophobicContact CD2-CE1 4.43Å; L452-Y463 HydrophobicContact CD2-CE2 3.52Å; L452-Y463 HydrophobicContact CD2-CG 4.14Å; L452-Y463 HydrophobicContact CG-CD1 4.2Å; L452-Y463 HydrophobicContact CG-CD2 4.2Å; L452-Y463 HydrophobicContact CG-CE1 4.01Å; L452-Y463 HydrophobicContact CG-CE2 4.01Å; L452-Y463 HydrophobicContact CG-CG 4.29Å; K453-Y463 WeakPolarHBondContact CG-OH 3.43Å; A456-Y463 HydrophobicContact CB-CD1 3.87Å; A456-Y463 HydrophobicContact CB-CE1 3.75Å; F461-Y463 HydrophobicContact CD2-CD1 4.33Å; F461-Y463 AromaticContact CE2-CD1 3.9Å; F461-Y463 HydrophobicContact CE2-CD1 3.9Å; F461-Y463 HydrophobicContact CE2-CG 4.33Å; Y463-I465 HydrophobicContact CD2-CG1 4Å; Y463-I465 HydrophobicContact CE2-CD1 4.04Å; Y463-I465 HydrophobicContact CE2-CG1 3.94Å
464	R	93.1	Very high	90.5	Very high	171 Å²	171	55.1 Å²	55.1	65%	0.645	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.7	119.5	171.6	-173.9	-177.6	-175.6	-168	4.2	109.6	L418 I420 N441	L418-R464 PolarHBondContact O-N 3.26Å; I420-R464 PolarHBondContact N-O 3.42Å; N441-R464 WeakPolarHBondContact OD1-CA 3.46Å
465	I	94.3	Very high	89.9	Confident	9 Å²	9	55.2 Å²	55.2	5%	0.046	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130.6	175.1	-59.1	175.8	0	0	0	109.3	T422 N441 Y444 V449 L452 Y463	T422-I465 HydrophobicContact CG2-CG2 3.67Å; N441-I465 HydrophobicContact CB-CD1 4.48Å; N441-I465 PolarHBondContact OD1-N 3.07Å; Y444-I465 HydrophobicContact CD2-CB 4.03Å; Y444-I465 HydrophobicContact CD2-CD1 4.13Å; Y444-I465 HydrophobicContact CD2-CG2 3.81Å; Y444-I465 HydrophobicContact CE2-CB 4.07Å; Y444-I465 HydrophobicContact CE2-CG2 3.8Å; Y444-I465 HydrophobicContact CG-CG2 4.39Å; V449-I465 HydrophobicContact CG1-CD1 4.29Å; V449-I465 HydrophobicContact CG2-CD1 4.5Å; L452-I465 HydrophobicContact CD2-CD1 4.34Å; L452-I465 HydrophobicContact CD2-CG1 4.26Å; Y463-I465 HydrophobicContact CD2-CG1 4Å; Y463-I465 HydrophobicContact CE2-CD1 4.04Å; Y463-I465 HydrophobicContact CE2-CG1 3.94Å
466	R	93.1	Very high	89.5	Confident	130 Å²	130	58 Å²	58	49%	0.491	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138.6	173.4	-175.9	179.4	-177.1	160.9	5.5	108.7	I420 T421 T422	I420-R466 PolarHBondContact O-N 2.98Å; T421-R466 WeakPolarHBondContact CA-O 3.48Å; T422-R466 PolarHBondContact N-O 3.45Å
467	L	93.8	Very high	88.9	Confident	60 Å²	60	58.9 Å²	58.9	31%	0.314	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	137.3	169.5	-63.7	178	0	0	0	109.9	T422 L424 Y444	T422-L467 HydrophobicContact CG2-CD2 4Å; T422-L467 WeakPolarHBondContact O-CA 3.37Å; L424-L467 HydrophobicContact CD1-CD1 4.07Å; L424-L467 HydrophobicContact CD2-CD1 4.36Å; L424-L467 HydrophobicContact CD2-CD2 3.84Å; L424-L467 HydrophobicContact CG-CD1 4.07Å; L424-L467 HydrophobicContact CG-CD2 3.87Å; Y444-L467 HydrophobicContact CE1-CD1 4.23Å; Y444-L467 HydrophobicContact CE1-CD2 3.99Å; Y444-L467 HydrophobicContact CE1-CG 4.18Å
468	V	94.3	Very high	88.2	Confident	13 Å²	13	59.3 Å²	59.3	8%	0.079	34%	0.337	C	S	.	.			trans	-56.1	136.1	174.5	62.3	0	0	0	0	111.1	T422 I423 D470 M485	T422-V468 PolarHBondContact O-N 3.45Å; I423-V468 HydrophobicContact CB-CG1 4.21Å; I423-V468 HydrophobicContact CG1-CG1 4.38Å; V468-D470 WeakPolarHBondContact CG2-OD1 3.5Å; V468-D470 PolarHBondContact O-N 2.97Å; V468-M485 HydrophobicContact CB-CG 3.73Å; V468-M485 HydrophobicContact CG1-CG 4.18Å; V468-M485 HydrophobicContact CG2-CG 3.83Å
469	G	87	Confident	87.6	Confident	72 Å²	72	63.7 Å²	63.7	74%	0.742	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-28.2	-169.1	0	0	0	0	0	116.3	E488	G469-E488 PolarHBondContact N-OE1 3.48Å
470	D	86.4	Confident	87	Confident	81 Å²	81	65.3 Å²	65.3	43%	0.433	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-5.9	-176.1	63.7	7.1	0	0	0	114.2	V468 V472 G484	V468-D470 WeakPolarHBondContact CG2-OD1 3.5Å; V468-D470 PolarHBondContact O-N 2.97Å; D470-V472 PolarHBondContact OD1-N 3.2Å; D470-G484 WeakPolarHBondContact OD1-CA 3.46Å; D470-G484 WeakPolarHBondContact OD2-CA 3.5Å; D470-G484 PolarHBondContact OD2-N 2.98Å
471	G	86.3	Confident	86.8	Confident	47 Å²	47	65 Å²	65	49%	0.485	39%	0.39	S	S	.	.	S	Bend	trans	72.8	19.7	-177.5	0	0	0	0	0	115.1	I423	I423-G471 VanDerWaalsContact CD1-O 3.28Å; I423-G471 WeakPolarHBondContact CD1-O 3.21Å
472	V	87.6	Confident	86.8	Confident	54 Å²	54	66.9 Å²	66.9	33%	0.327	40%	0.396	S	S	.	.			trans	-119.4	148.4	-176.6	-170.9	0	0	0	0	111.6	D470 V475 G484 M485	D470-V472 PolarHBondContact OD1-N 3.2Å; V472-V475 HydrophobicContact CG1-CG2 4.14Å; V472-G484 WeakPolarHBondContact O-CA 3.25Å; V472-M485 PolarHBondContact O-N 3.42Å
473	Y	88	Confident	86.7	Confident	27 Å²	27	64.4 Å²	64.4	11%	0.106	39%	0.391	C	S	.	.	S	Bend	trans	-60.2	-46.6	173.3	-81.8	-78.4	0	0	0	113.1	I423 E425 M485 V486 A499 G500 L501	I423-Y473 HydrophobicContact CD1-CD2 4.41Å; I423-Y473 HydrophobicContact CD1-CE2 4.31Å; I423-Y473 HydrophobicContact CG2-CE1 4.02Å; E425-Y473 PolarHBondContact OE1-OH 3.39Å; E425-Y473 PolarHBondContact OE2-OH 2.92Å; Y473-M485 HydrophobicContact CD1-CE 3.34Å; Y473-M485 HydrophobicContact CE1-CE 3.7Å; Y473-M485 HydrophobicContact CG-CE 4.11Å; Y473-M485 PolarHBondContact O-N 2.88Å; Y473-M485 VanDerWaalsContact O-N 3.11Å; Y473-V486 PolarHBondContact O-N 2.87Å; Y473-A499 HydrophobicContact CE1-CB 4.39Å; Y473-G500 WeakPolarHBondContact CE1-O 3.5Å; Y473-L501 HydrophobicContact CD1-CD1 3.87Å
474	G	86.7	Confident	86.7	Confident	3 Å²	3	63 Å²	63	3%	0.031	39%	0.387	C	S	.	.			trans	135.2	123	178.5	0	0	0	0	0	111.2	T483 R507	G474-T483 WeakPolarHBondContact CA-O 3.26Å; G474-R507 PolarHBondContact O-NH2 2.95Å
475	V	82.7	Confident	86.7	Confident	47 Å²	47	54.8 Å²	54.8	29%	0.285	36%	0.356	S	S	.	.			trans	-126	137	-176.5	-177.7	0	0	0	0	107.9	V472 T483 G672	V472-V475 HydrophobicContact CG1-CG2 4.14Å; V475-T483 PolarHBondContact N-OG1 3.19Å; V475-T483 VanDerWaalsContact N-OG1 3.07Å; V475-T483 PolarHBondContact O-N 2.94Å; V475-T483 PolarHBondContact O-OG1 3Å; V475-T483 VanDerWaalsContact O-OG1 3.09Å; V475-G672 WeakPolarHBondContact CG2-O 3.31Å
476	P	84.3	Confident	86.6	Confident	58 Å²	58	54.4 Å²	54.4	38%	0.377	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-69.9	132.1	175.3	28.2	-33.3	0	0	0	111	W482	P476-W482 HydrophobicContact CB-CD2 4.3Å; P476-W482 HydrophobicContact CB-CE3 4.43Å; P476-W482 HydrophobicContact CB-CH2 4.03Å; P476-W482 HydrophobicContact CB-CZ2 3.86Å; P476-W482 HydrophobicContact CB-CZ3 4.31Å; P476-W482 HydrophobicContact CG-CH2 4.12Å; P476-W482 HydrophobicContact CG-CZ2 4.39Å; P476-W482 HydrophobicContact CG-CZ3 4.38Å
477	G	81.4	Confident	86.4	Confident	30 Å²	30	48.7 Å²	48.7	31%	0.309	34%	0.336	S	S	.	.			trans	-85.6	160.3	168.7	0	0	0	0	0	112	N479 G480 T481	G477-N479 PolarHBondContact O-N 2.87Å; G477-N479 VanDerWaalsContact O-N 3.09Å; G477-G480 PolarHBondContact O-N 3.27Å; G477-T481 PolarHBondContact N-O 3.36Å
478	A	76.9	Confident	86.2	Confident	111 Å²	111	46.8 Å²	46.8	92%	0.917	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-25.6	-178.7	0	0	0	0	0	114	G480	A478-G480 VanDerWaalsContact C-N 3.33Å
479	N	76.2	Confident	86	Confident	149 Å²	149	46.2 Å²	46.2	80%	0.797	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	15.7	-178.8	-59.2	9.3	0	0	0	112.8	G477 T481	G477-N479 PolarHBondContact O-N 2.87Å; G477-N479 VanDerWaalsContact O-N 3.09Å; N479-T481 PolarHBondContact O-N 3.43Å
480	G	75.9	Confident	86	Confident	55 Å²	55	45.8 Å²	45.8	57%	0.567	30%	0.302	S	S	*	.	S	Bend	trans	75.2	-2.2	-176	0	0	0	0	0	115.1	G477 A478	G477-G480 PolarHBondContact O-N 3.27Å; A478-G480 VanDerWaalsContact C-N 3.33Å
481	T	84.3	Confident	85.7	Confident	92 Å²	92	44 Å²	44	56%	0.564	30%	0.296	S	S	*	.			trans	-71.2	153.5	173.4	53.2	0	0	0	0	111.4	G477 N479	G477-T481 PolarHBondContact N-O 3.36Å; N479-T481 PolarHBondContact O-N 3.43Å
482	W	87.8	Confident	85.4	Confident	46 Å²	46	44.8 Å²	44.8	17%	0.174	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-122.7	138.5	179.5	-75.9	78.9	0	0	0	111.4	P476 V486 G487 I490 E506 R507 V510	P476-W482 HydrophobicContact CB-CD2 4.3Å; P476-W482 HydrophobicContact CB-CE3 4.43Å; P476-W482 HydrophobicContact CB-CH2 4.03Å; P476-W482 HydrophobicContact CB-CZ2 3.86Å; P476-W482 HydrophobicContact CB-CZ3 4.31Å; P476-W482 HydrophobicContact CG-CH2 4.12Å; P476-W482 HydrophobicContact CG-CZ2 4.39Å; P476-W482 HydrophobicContact CG-CZ3 4.38Å; W482-V486 HydrophobicContact CB-CG1 4.32Å; W482-V486 HydrophobicContact CD2-CG1 3.86Å; W482-V486 HydrophobicContact CE3-CB 4.04Å; W482-V486 HydrophobicContact CE3-CG1 3.56Å; W482-V486 HydrophobicContact CG-CG1 4.21Å; W482-V486 HydrophobicContact CZ3-CG1 4.15Å; W482-G487 WeakPolarHBondContact O-CA 3.39Å; W482-I490 HydrophobicContact CB-CD1 3.71Å; W482-I490 HydrophobicContact CD2-CD1 4.45Å; W482-I490 HydrophobicContact CG-CD1 3.67Å; W482-E506 HydrophobicContact CH2-CB 4.11Å; W482-R507 HydrophobicContact CH2-CG 4.16Å; W482-R507 HydrophobicContact CZ3-CG 4.04Å; W482-V510 HydrophobicContact CD2-CG2 4.25Å; W482-V510 HydrophobicContact CZ2-CG1 4.47Å; W482-V510 HydrophobicContact CZ2-CG2 3.92Å
483	T	89.3	Confident	85.1	Confident	63 Å²	63	48.4 Å²	48.4	39%	0.387	30%	0.295	S	S	.	.			trans	-92.4	179.6	172.6	55.1	0	0	0	0	111.4	G474 V475 G487	G474-T483 WeakPolarHBondContact CA-O 3.26Å; V475-T483 PolarHBondContact N-OG1 3.19Å; V475-T483 VanDerWaalsContact N-OG1 3.07Å; V475-T483 PolarHBondContact O-N 2.94Å; V475-T483 PolarHBondContact O-OG1 3Å; V475-T483 VanDerWaalsContact O-OG1 3.09Å; T483-G487 PolarHBondContact O-N 3.28Å
484	G	90.9	Very high	85.1	Confident	4 Å²	4	47.1 Å²	47.1	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	65.5	-161.2	170.1	0	0	0	0	0	115.7	D470 V472 V486 G487 E488	D470-G484 WeakPolarHBondContact OD1-CA 3.46Å; D470-G484 WeakPolarHBondContact OD2-CA 3.5Å; D470-G484 PolarHBondContact OD2-N 2.98Å; V472-G484 WeakPolarHBondContact O-CA 3.25Å; G484-V486 PolarHBondContact O-N 3.46Å; G484-G487 WeakPolarHBondContact O-CA 3.26Å; G484-G487 PolarHBondContact O-N 3.31Å; G484-E488 PolarHBondContact O-N 2.95Å
485	M	93.3	Very high	85.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.3	-36.3	177.8	-67.2	-177.6	-76.4	0	0	112	T421 T422 I423 V468 V472 Y473 E488 L489 A497 A499	T421-M485 HydrophobicContact CG2-CB 3.92Å; T421-M485 HydrophobicContact CG2-CG 3.93Å; T422-M485 VanDerWaalsContact CA-SD 3.6Å; I423-M485 HydrophobicContact CB-CE 4.02Å; I423-M485 HydrophobicContact CB-SD 4.36Å; I423-M485 HydrophobicContact CG2-CE 3.69Å; I423-M485 HydrophobicContact CG2-SD 4.39Å; V468-M485 HydrophobicContact CB-CG 3.73Å; V468-M485 HydrophobicContact CG1-CG 4.18Å; V468-M485 HydrophobicContact CG2-CG 3.83Å; V472-M485 PolarHBondContact O-N 3.42Å; Y473-M485 HydrophobicContact CD1-CE 3.34Å; Y473-M485 HydrophobicContact CE1-CE 3.7Å; Y473-M485 HydrophobicContact CG-CE 4.11Å; Y473-M485 PolarHBondContact O-N 2.88Å; Y473-M485 VanDerWaalsContact O-N 3.11Å; M485-E488 PolarHBondContact O-N 3.34Å; M485-L489 WeakPolarHBondContact O-CG 3.39Å; M485-L489 PolarHBondContact O-N 3.08Å; M485-A497 HydrophobicContact CB-CB 4.26Å; M485-A499 HydrophobicContact CE-CB 3.85Å; M485-A499 HydrophobicContact SD-CB 4.02Å
486	V	92.1	Very high	85.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-43.8	174.8	-178.3	0	0	0	0	111.1	Y473 W482 G484 L489 I490 R507 V510 I511	Y473-V486 PolarHBondContact O-N 2.87Å; W482-V486 HydrophobicContact CB-CG1 4.32Å; W482-V486 HydrophobicContact CD2-CG1 3.86Å; W482-V486 HydrophobicContact CE3-CB 4.04Å; W482-V486 HydrophobicContact CE3-CG1 3.56Å; W482-V486 HydrophobicContact CG-CG1 4.21Å; W482-V486 HydrophobicContact CZ3-CG1 4.15Å; G484-V486 PolarHBondContact O-N 3.46Å; V486-L489 PolarHBondContact O-N 3.35Å; V486-I490 HydrophobicContact CG1-CD1 3.83Å; V486-I490 WeakPolarHBondContact O-CD1 3.38Å; V486-I490 VanDerWaalsContact O-CG1 3.3Å; V486-I490 WeakPolarHBondContact O-CG1 3.24Å; V486-I490 PolarHBondContact O-N 3.11Å; V486-R507 HydrophobicContact CG2-CG 4.19Å; V486-V510 HydrophobicContact CG1-CG2 3.94Å; V486-I511 HydrophobicContact CG1-CD1 4.16Å; V486-I511 HydrophobicContact CG1-CG1 4.32Å; V486-I511 HydrophobicContact CG1-CG2 4.2Å; V486-I511 HydrophobicContact CG2-CD1 4.03Å
487	G	89.8	Confident	86.2	Confident	11 Å²	11	43.4 Å²	43.4	11%	0.113	27%	0.265	C	S	.	.	H	α-helix	trans	-64.8	-36.6	174.1	0	0	0	0	0	113.7	W482 T483 G484 I490 S491	W482-G487 WeakPolarHBondContact O-CA 3.39Å; T483-G487 PolarHBondContact O-N 3.28Å; G484-G487 WeakPolarHBondContact O-CA 3.26Å; G484-G487 PolarHBondContact O-N 3.31Å; G487-I490 PolarHBondContact O-N 3.29Å; G487-S491 WeakPolarHBondContact O-CB 3.41Å; G487-S491 PolarHBondContact O-N 3.38Å; G487-S491 PolarHBondContact O-OG 3.21Å
488	E	89.8	Confident	86.9	Confident	20 Å²	20	42.1 Å²	42.1	9%	0.093	25%	0.251	C	S	.	.	H	α-helix	trans	-66.3	-36.2	174.7	-71	-172.2	173.3	0	0	112.7	T421 G469 G484 M485 S491 R492 K493	T421-E488 VanDerWaalsContact CB-OE2 3.26Å; T421-E488 WeakPolarHBondContact CB-OE2 3.36Å; T421-E488 PolarHBondContact OG1-OE2 3.05Å; G469-E488 PolarHBondContact N-OE1 3.48Å; G484-E488 PolarHBondContact O-N 2.95Å; M485-E488 PolarHBondContact O-N 3.34Å; E488-S491 PolarHBondContact O-OG 3.46Å; E488-R492 PolarHBondContact O-N 3.49Å; E488-K493 HydrophobicContact CB-CB 4.36Å; E488-K493 PolarHBondContact O-N 2.93Å
489	L	90.3	Very high	87.8	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.1	-44.9	172.9	-69.7	179.5	0	0	0	112.7	M485 V486 S491 R492 A494 A497 I511 G752 P754	M485-L489 WeakPolarHBondContact O-CG 3.39Å; M485-L489 PolarHBondContact O-N 3.08Å; V486-L489 PolarHBondContact O-N 3.35Å; L489-S491 VanDerWaalsContact C-N 3.31Å; L489-S491 PolarHBondContact O-N 2.85Å; L489-R492 PolarHBondContact O-N 3.49Å; L489-A494 HydrophobicContact CD2-CB 4.48Å; L489-A497 HydrophobicContact CD1-CB 3.68Å; L489-A497 HydrophobicContact CD2-CB 4.28Å; L489-A497 HydrophobicContact CG-CB 4.1Å; L489-I511 HydrophobicContact CB-CG2 3.8Å; L489-I511 HydrophobicContact CD1-CB 4.4Å; L489-I511 HydrophobicContact CD1-CD1 3.9Å; L489-I511 HydrophobicContact CD1-CG2 4.11Å; L489-G752 VanDerWaalsContact CD1-C 3.5Å; L489-P754 HydrophobicContact CD2-CG 4.38Å
490	I	85.9	Confident	88.5	Confident	64 Å²	64	29.9 Å²	29.9	33%	0.328	17%	0.171	S	C	.	.	H	α-helix	trans	-62.2	-41.3	178	-68.4	161.6	0	0	0	110.7	W482 V486 G487 R492 V510 I511	W482-I490 HydrophobicContact CB-CD1 3.71Å; W482-I490 HydrophobicContact CD2-CD1 4.45Å; W482-I490 HydrophobicContact CG-CD1 3.67Å; V486-I490 HydrophobicContact CG1-CD1 3.83Å; V486-I490 WeakPolarHBondContact O-CD1 3.38Å; V486-I490 VanDerWaalsContact O-CG1 3.3Å; V486-I490 WeakPolarHBondContact O-CG1 3.24Å; V486-I490 PolarHBondContact O-N 3.11Å; G487-I490 PolarHBondContact O-N 3.29Å; I490-R492 PolarHBondContact O-N 2.9Å; I490-V510 HydrophobicContact CD1-CB 3.83Å; I490-V510 HydrophobicContact CD1-CG2 3.83Å; I490-V510 HydrophobicContact CG1-CB 4.34Å; I490-I511 HydrophobicContact CD1-CG2 4.49Å; I490-I511 HydrophobicContact CG1-CG2 3.85Å
491	S	80.5	Confident	89.4	Confident	44 Å²	44	27.3 Å²	27.3	31%	0.308	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	8.2	175.4	59.2	0	0	0	0	114.4	G487 E488 L489 K493	G487-S491 WeakPolarHBondContact O-CB 3.41Å; G487-S491 PolarHBondContact O-N 3.38Å; G487-S491 PolarHBondContact O-OG 3.21Å; E488-S491 PolarHBondContact O-OG 3.46Å; L489-S491 VanDerWaalsContact C-N 3.31Å; L489-S491 PolarHBondContact O-N 2.85Å; S491-K493 PolarHBondContact O-N 3.02Å; S491-K493 VanDerWaalsContact O-N 3.07Å; S491-K493 WeakPolarHBondContact OG-CD 3.25Å
492	R	79.3	Confident	89.8	Confident	62 Å²	62	23.1 Å²	23.1	23%	0.234	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	30.2	-179	-57.8	-174.5	-175.8	-84.9	2.8	114.3	E488 L489 I490 A494	E488-R492 PolarHBondContact O-N 3.49Å; L489-R492 PolarHBondContact O-N 3.49Å; I490-R492 PolarHBondContact O-N 2.9Å; R492-A494 VanDerWaalsContact C-N 3.3Å
493	K	82.1	Confident	90.1	Very high	130 Å²	130	22.9 Å²	22.9	57%	0.565	12%	0.12	S	C	*	.	S	Bend	trans	-78.6	-16.9	174.4	-68.1	178.2	-175.8	172.6	0	113.1	E488 S491	E488-K493 HydrophobicContact CB-CB 4.36Å; E488-K493 PolarHBondContact O-N 2.93Å; S491-K493 PolarHBondContact O-N 3.02Å; S491-K493 VanDerWaalsContact O-N 3.07Å; S491-K493 WeakPolarHBondContact OG-CD 3.25Å
494	A	87.7	Confident	90.2	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.008	11%	0.112	C	C	.	.			trans	-137.4	148.1	172.4	0	0	0	0	0	109	T421 L489 R492	T421-A494 HydrophobicContact CG2-CB 3.73Å; L489-A494 HydrophobicContact CD2-CB 4.48Å; R492-A494 VanDerWaalsContact C-N 3.3Å
495	D	88.2	Confident	90.1	Very high	29 Å²	29	24.7 Å²	24.7	16%	0.155	14%	0.138	C	C	.	.	S	Bend	trans	-86.4	-30.3	-179.6	-58.4	-61.6	0	0	0	111.7	L418 T419 P754	L418-D495 HydrophobicContact CB-CB 4.37Å; L418-D495 HydrophobicContact CD2-CB 4.23Å; T419-D495 PolarHBondContact N-OD2 3.06Å; T419-D495 PolarHBondContact O-N 3.48Å; D495-P754 WeakPolarHBondContact O-CD 3.44Å
496	L	93.5	Very high	89.8	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	147.5	179.9	-58.7	171	0	0	0	110.5	L418 T419 I420 T421 V498 I751 G752 M753 F763	L418-L496 HydrophobicContact CD1-CD1 3.84Å; T419-L496 PolarHBondContact O-N 3.06Å; I420-L496 CarbonylContact C-O 3.5Å; I420-L496 WeakPolarHBondContact CA-O 3.38Å; I420-L496 HydrophobicContact CD1-CD1 4.31Å; I420-L496 HydrophobicContact CG1-CB 4.27Å; I420-L496 HydrophobicContact CG1-CD1 4.42Å; T421-L496 PolarHBondContact N-O 2.99Å; L496-V498 HydrophobicContact CB-CG2 4.4Å; L496-I751 HydrophobicContact CB-CG2 4.37Å; L496-I751 HydrophobicContact CD2-CG2 4.16Å; L496-G752 WeakPolarHBondContact CA-O 3.46Å; L496-M753 HydrophobicContact CD2-CB 4.49Å; L496-M753 HydrophobicContact CD2-CE 4.16Å; L496-M753 HydrophobicContact CD2-CG 3.7Å; L496-M753 HydrophobicContact CD2-SD 3.96Å; L496-F763 HydrophobicContact CD1-CE1 3.95Å; L496-F763 HydrophobicContact CD1-CE2 4.06Å; L496-F763 HydrophobicContact CD1-CZ 3.48Å; L496-F763 VanDerWaalsContact CD1-CZ 3.48Å; L496-F763 HydrophobicContact CD2-CE2 4.49Å
497	A	96.1	Very high	89.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	114	167.1	0	0	0	0	0	109.7	T421 M485 L489 L501 G752	T421-A497 HydrophobicContact CG2-CB 3.69Å; T421-A497 WeakPolarHBondContact O-CA 3.4Å; M485-A497 HydrophobicContact CB-CB 4.26Å; L489-A497 HydrophobicContact CD1-CB 3.68Å; L489-A497 HydrophobicContact CD2-CB 4.28Å; L489-A497 HydrophobicContact CG-CB 4.1Å; A497-L501 HydrophobicContact CB-CD2 4.21Å; A497-G752 PolarHBondContact N-O 3.32Å; A497-G752 PolarHBondContact O-N 2.93Å
498	V	96.3	Very high	89.8	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.024	17%	0.174	C	C	.	.			trans	-119.8	102.1	-178.1	-173.9	0	0	0	0	108.9	I420 T421 T422 C448 M451 L496 I751	I420-V498 HydrophobicContact CG2-CB 3.95Å; I420-V498 HydrophobicContact CG2-CG2 3.77Å; T421-V498 PolarHBondContact O-N 3.03Å; T421-V498 VanDerWaalsContact O-N 3.16Å; T422-V498 WeakPolarHBondContact CB-O 3.47Å; T422-V498 PolarHBondContact OG1-O 3.36Å; C448-V498 HydrophobicContact CB-CG1 4.01Å; M451-V498 HydrophobicContact CE-CG1 3.75Å; L496-V498 HydrophobicContact CB-CG2 4.4Å; V498-I751 HydrophobicContact CG2-CD1 4.38Å; V498-I751 HydrophobicContact CG2-CG1 4.38Å; V498-I751 HydrophobicContact CG2-CG2 3.99Å
499	A	94.6	Very high	89.7	Confident	2 Å²	2	39.8 Å²	39.8	2%	0.017	20%	0.202	C	C	.	.	S	Bend	trans	-159.3	-173.1	-177.6	0	0	0	0	0	110	I423 Y473 M485 L501	I423-A499 HydrophobicContact CG2-CB 4.03Å; Y473-A499 HydrophobicContact CE1-CB 4.39Å; M485-A499 HydrophobicContact CE-CB 3.85Å; M485-A499 HydrophobicContact SD-CB 4.02Å; A499-L501 PolarHBondContact O-N 3.39Å
500	G	92	Very high	89.7	Confident	1 Å²	1	41 Å²	41	1%	0.01	21%	0.21	C	C	.	.	S	Bend	trans	-67.8	48.3	162.5	0	0	0	0	0	113.2	Y473 T502 Y749	Y473-G500 WeakPolarHBondContact CE1-O 3.5Å; G500-T502 PolarHBondContact O-N 3.08Å; G500-Y749 WeakPolarHBondContact O-CD1 3.47Å; G500-Y749 WeakPolarHBondContact O-CE1 3.33Å
501	L	93.8	Very high	90	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.			trans	-82.4	100	-173.5	-174.8	64.8	0	0	0	110.5	Y473 A497 A499 I503 I511 F513 Y749 G750	Y473-L501 HydrophobicContact CD1-CD1 3.87Å; A497-L501 HydrophobicContact CB-CD2 4.21Å; A499-L501 PolarHBondContact O-N 3.39Å; L501-I503 PolarHBondContact O-N 2.73Å; L501-I511 HydrophobicContact CD2-CD1 4.45Å; L501-F513 HydrophobicContact CD2-CE1 3.68Å; L501-F513 HydrophobicContact CD2-CZ 4.14Å; L501-F513 HydrophobicContact CG-CE1 3.92Å; L501-F513 HydrophobicContact CG-CZ 4.32Å; L501-Y749 WeakPolarHBondContact O-CA 3.36Å; L501-G750 PolarHBondContact O-N 2.97Å
502	T	93.8	Very high	90.5	Very high	4 Å²	4	37.1 Å²	37.1	3%	0.025	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-58.4	126.3	175.8	-24.5	0	0	0	0	110.8	G500 T504 R507 S674 E723 K747	G500-T502 PolarHBondContact O-N 3.08Å; T502-T504 PolarHBondContact O-N 3.17Å; T502-R507 PolarHBondContact O-NH1 3.05Å; T502-S674 PolarHBondContact OG1-OG 3.44Å; T502-E723 WeakPolarHBondContact CG2-OE1 3.37Å; T502-E723 PolarHBondContact OG1-OE1 2.66Å; T502-K747 HydrophobicContact CG2-CB 4.09Å; T502-K747 HydrophobicContact CG2-CD 3.74Å; T502-K747 HydrophobicContact CG2-CG 4.03Å
503	I	94.2	Very high	91.3	Very high	42 Å²	42	35 Å²	35	22%	0.215	18%	0.178	C	C	.	.			trans	-68.6	127.4	170.6	-53.7	175.6	0	0	0	108.3	L501 F513 P516 G748	L501-I503 PolarHBondContact O-N 2.73Å; I503-F513 HydrophobicContact CD1-CB 4.36Å; I503-F513 HydrophobicContact CG1-CB 4.38Å; I503-F513 HydrophobicContact CG1-CD1 3.78Å; I503-F513 HydrophobicContact CG1-CE1 4.14Å; I503-F513 HydrophobicContact CG1-CG 4.03Å; I503-F513 HydrophobicContact CG2-CB 4.48Å; I503-F513 HydrophobicContact CG2-CD2 4Å; I503-F513 HydrophobicContact CG2-CE2 4.35Å; I503-F513 HydrophobicContact CG2-CG 4.13Å; I503-P516 HydrophobicContact CD1-CB 4.03Å; I503-G748 PolarHBondContact N-O 3.18Å
504	T	90.9	Very high	91.9	Very high	35 Å²	35	29 Å²	29	22%	0.215	15%	0.153	C	C	.	.			trans	-141.8	149.1	176.5	71.9	0	0	0	0	111.1	T502 E506 R507 E508	T502-T504 PolarHBondContact O-N 3.17Å; T504-E506 PolarHBondContact O-N 3.24Å; T504-E506 VanDerWaalsContact O-N 3.08Å; T504-R507 PolarHBondContact O-N 3.17Å; T504-R507 WeakPolarHBondContact OG1-CG 3.27Å; T504-R507 PolarHBondContact OG1-N 3.19Å; T504-E508 WeakPolarHBondContact O-CB 3.4Å; T504-E508 PolarHBondContact O-N 2.86Å
505	A	88.6	Confident	92.2	Very high	70 Å²	70	33.8 Å²	33.8	58%	0.579	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-14	-178.9	0	0	0	0	0	114.8	K509	A505-K509 WeakPolarHBondContact O-CD 3.31Å; A505-K509 WeakPolarHBondContact O-CE 3.44Å; A505-K509 VanDerWaalsContact O-CG 3.32Å; A505-K509 WeakPolarHBondContact O-CG 3.49Å
506	E	87.6	Confident	92.6	Very high	68 Å²	68	34.9 Å²	34.9	32%	0.318	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-36.7	171	-68.2	179.4	169.6	0	0	111.8	W482 T504 N681	W482-E506 HydrophobicContact CH2-CB 4.11Å; T504-E506 PolarHBondContact O-N 3.24Å; T504-E506 VanDerWaalsContact O-N 3.08Å; E506-N681 PolarHBondContact OE1-ND2 3.39Å
507	R	90.9	Very high	92.6	Very high	11 Å²	11	35.4 Å²	35.4	4%	0.042	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-41.2	177.2	-68.4	174	175.1	165.2	-3.8	111.5	G474 W482 V486 T502 T504 K509 V510 I511 F513	G474-R507 PolarHBondContact O-NH2 2.95Å; W482-R507 HydrophobicContact CH2-CG 4.16Å; W482-R507 HydrophobicContact CZ3-CG 4.04Å; V486-R507 HydrophobicContact CG2-CG 4.19Å; T502-R507 PolarHBondContact O-NH1 3.05Å; T504-R507 PolarHBondContact O-N 3.17Å; T504-R507 WeakPolarHBondContact OG1-CG 3.27Å; T504-R507 PolarHBondContact OG1-N 3.19Å; R507-K509 PolarHBondContact O-N 2.92Å; R507-K509 VanDerWaalsContact O-N 3.14Å; R507-V510 WeakPolarHBondContact O-CG2 3.43Å; R507-V510 PolarHBondContact O-N 3.23Å; R507-I511 HydrophobicContact CB-CD1 4.43Å; R507-I511 HydrophobicContact CB-CG1 4.29Å; R507-I511 VanDerWaalsContact O-CG1 3.22Å; R507-I511 WeakPolarHBondContact O-CG1 3.3Å; R507-I511 PolarHBondContact O-N 3.48Å; R507-F513 HydrophobicContact CB-CE2 3.66Å; R507-F513 HydrophobicContact CB-CZ 3.86Å
508	E	90	Very high	92.5	Very high	113 Å²	113	36.1 Å²	36.1	53%	0.528	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.7	179.3	-166.4	172.9	-168.6	0	0	113.4	T504 V510 I511 F513	T504-E508 WeakPolarHBondContact O-CB 3.4Å; T504-E508 PolarHBondContact O-N 2.86Å; E508-V510 VanDerWaalsContact C-N 3.32Å; E508-I511 CarbonylContact C-O 3.59Å; E508-I511 WeakPolarHBondContact CA-O 3.45Å; E508-F513 HydrophobicContact CB-CD2 4.37Å
509	K	88.4	Confident	92.4	Very high	156 Å²	156	41.4 Å²	41.4	68%	0.678	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-19.2	171.3	-72.8	170.6	-175.9	-179.1	0	114.1	A505 R507	A505-K509 WeakPolarHBondContact O-CD 3.31Å; A505-K509 WeakPolarHBondContact O-CE 3.44Å; A505-K509 VanDerWaalsContact O-CG 3.32Å; A505-K509 WeakPolarHBondContact O-CG 3.49Å; R507-K509 PolarHBondContact O-N 2.92Å; R507-K509 VanDerWaalsContact O-N 3.14Å
510	V	88.6	Confident	92.3	Very high	26 Å²	26	41.6 Å²	41.6	16%	0.158	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	-24.6	-170.5	-63.6	0	0	0	0	113.9	W482 V486 I490 R507 E508	W482-V510 HydrophobicContact CD2-CG2 4.25Å; W482-V510 HydrophobicContact CZ2-CG1 4.47Å; W482-V510 HydrophobicContact CZ2-CG2 3.92Å; V486-V510 HydrophobicContact CG1-CG2 3.94Å; I490-V510 HydrophobicContact CD1-CB 3.83Å; I490-V510 HydrophobicContact CD1-CG2 3.83Å; I490-V510 HydrophobicContact CG1-CB 4.34Å; R507-V510 WeakPolarHBondContact O-CG2 3.43Å; R507-V510 PolarHBondContact O-N 3.23Å; E508-V510 VanDerWaalsContact C-N 3.32Å
511	I	92.1	Very high	92.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	149.6	175	56	164	0	0	0	109.8	V486 L489 I490 L501 R507 E508 F513 M753	V486-I511 HydrophobicContact CG1-CD1 4.16Å; V486-I511 HydrophobicContact CG1-CG1 4.32Å; V486-I511 HydrophobicContact CG1-CG2 4.2Å; V486-I511 HydrophobicContact CG2-CD1 4.03Å; L489-I511 HydrophobicContact CB-CG2 3.8Å; L489-I511 HydrophobicContact CD1-CB 4.4Å; L489-I511 HydrophobicContact CD1-CD1 3.9Å; L489-I511 HydrophobicContact CD1-CG2 4.11Å; I490-I511 HydrophobicContact CD1-CG2 4.49Å; I490-I511 HydrophobicContact CG1-CG2 3.85Å; L501-I511 HydrophobicContact CD2-CD1 4.45Å; R507-I511 HydrophobicContact CB-CD1 4.43Å; R507-I511 HydrophobicContact CB-CG1 4.29Å; R507-I511 VanDerWaalsContact O-CG1 3.22Å; R507-I511 WeakPolarHBondContact O-CG1 3.3Å; R507-I511 PolarHBondContact O-N 3.48Å; E508-I511 CarbonylContact C-O 3.59Å; E508-I511 WeakPolarHBondContact CA-O 3.45Å; I511-F513 HydrophobicContact CD1-CE1 4.33Å; I511-F513 HydrophobicContact CD1-CE2 3.93Å; I511-F513 HydrophobicContact CD1-CZ 3.69Å; I511-F513 HydrophobicContact CG1-CE2 3.95Å; I511-F513 HydrophobicContact CG1-CZ 4.25Å; I511-M753 VanDerWaalsContact CB-O 3.31Å; I511-M753 WeakPolarHBondContact CB-O 3.45Å
512	D	92.1	Very high	92.4	Very high	25 Å²	25	41.6 Å²	41.6	13%	0.134	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	155.7	170.9	-88.6	-59.8	0	0	0	110.7	M753 L755 G756 R760	D512-M753 HydrophobicContact CB-CB 4.41Å; D512-M753 PolarHBondContact N-O 3.46Å; D512-M753 PolarHBondContact O-N 2.83Å; D512-L755 WeakPolarHBondContact OD2-CA 3.41Å; D512-G756 PolarHBondContact OD2-N 3.4Å; D512-R760 IonicContact OD1-NH1 2.95Å; D512-R760 PolarHBondContact OD1-NH1 2.96Å
513	F	95.2	Very high	92.4	Very high	17 Å²	17	41.4 Å²	41.4	8%	0.075	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.2	172.1	-76.9	-83.3	0	0	0	111.5	L501 I503 R507 E508 I511 I751	L501-F513 HydrophobicContact CD2-CE1 3.68Å; L501-F513 HydrophobicContact CD2-CZ 4.14Å; L501-F513 HydrophobicContact CG-CE1 3.92Å; L501-F513 HydrophobicContact CG-CZ 4.32Å; I503-F513 HydrophobicContact CD1-CB 4.36Å; I503-F513 HydrophobicContact CG1-CB 4.38Å; I503-F513 HydrophobicContact CG1-CD1 3.78Å; I503-F513 HydrophobicContact CG1-CE1 4.14Å; I503-F513 HydrophobicContact CG1-CG 4.03Å; I503-F513 HydrophobicContact CG2-CB 4.48Å; I503-F513 HydrophobicContact CG2-CD2 4Å; I503-F513 HydrophobicContact CG2-CE2 4.35Å; I503-F513 HydrophobicContact CG2-CG 4.13Å; R507-F513 HydrophobicContact CB-CE2 3.66Å; R507-F513 HydrophobicContact CB-CZ 3.86Å; E508-F513 HydrophobicContact CB-CD2 4.37Å; I511-F513 HydrophobicContact CD1-CE1 4.33Å; I511-F513 HydrophobicContact CD1-CE2 3.93Å; I511-F513 HydrophobicContact CD1-CZ 3.69Å; I511-F513 HydrophobicContact CG1-CE2 3.95Å; I511-F513 HydrophobicContact CG1-CZ 4.25Å; F513-I751 WeakPolarHBondContact CA-O 3.43Å
514	S	95.1	Very high	92.4	Very high	5 Å²	5	39.5 Å²	39.5	4%	0.035	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-71.5	171	163	74.5	0	0	0	0	112.2	I751 D764 I767	S514-I751 PolarHBondContact N-O 3.47Å; S514-I751 PolarHBondContact OG-N 2.96Å; S514-D764 VanDerWaalsContact C-OD1 3.3Å; S514-D764 WeakPolarHBondContact CA-OD1 3.36Å; S514-D764 WeakPolarHBondContact CB-OD1 3.46Å; S514-I767 VanDerWaalsContact OG-CD1 3.24Å; S514-I767 WeakPolarHBondContact OG-CD1 3.35Å
515	K	94.4	Very high	92.5	Very high	102 Å²	102	37.9 Å²	37.9	44%	0.443	20%	0.2	S	C	.	.	S	Bend	trans	-51.5	144.1	160	-61.4	-38.6	176.4	-129.9	0	110.1	F517 D764	K515-F517 PolarHBondContact O-N 3.21Å; K515-D764 WeakPolarHBondContact CD-OD2 3.03Å; K515-D764 WeakPolarHBondContact CE-OD2 3.27Å; K515-D764 HydrophobicContact CG-CB 4.25Å; K515-D764 WeakPolarHBondContact CG-OD2 3.28Å; K515-D764 PolarHBondContact N-OD1 2.92Å; K515-D764 IonicContact NZ-OD2 3.21Å; K515-D764 PolarHBondContact NZ-OD2 3.45Å
516	P	95.5	Very high	92.6	Very high	51 Å²	51	34.7 Å²	34.7	33%	0.331	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-70	119.9	-177.2	26.7	-33.6	0	0	0	111	I503 M518 Y749	I503-P516 HydrophobicContact CD1-CB 4.03Å; P516-M518 VanDerWaalsContact C-N 3.31Å; P516-Y749 CarbonylContact C-O 3.56Å; P516-Y749 WeakPolarHBondContact CA-O 3.46Å
517	F	94.6	Very high	92.6	Very high	11 Å²	11	35 Å²	35	5%	0.048	17%	0.171	C	C	.	.	S	Bend	trans	-77.8	-17	178.8	65	-99.7	0	0	0	112.8	F447 M451 K515 Y749 I751 I767 L776	F447-F517 HydrophobicContact CD1-CE2 4.49Å; F447-F517 AromaticContact CE1-CD2 3.88Å; F447-F517 HydrophobicContact CE1-CD2 3.88Å; F447-F517 AromaticContact CE1-CE2 3.68Å; F447-F517 HydrophobicContact CE1-CE2 3.68Å; F447-F517 HydrophobicContact CZ-CD2 4.35Å; M451-F517 HydrophobicContact CE-CD1 4.15Å; M451-F517 HydrophobicContact CE-CD2 4.41Å; M451-F517 HydrophobicContact CE-CE1 4.15Å; M451-F517 HydrophobicContact CE-CE2 4.43Å; M451-F517 HydrophobicContact CE-CG 4.28Å; M451-F517 HydrophobicContact CE-CZ 4.29Å; M451-F517 HydrophobicContact SD-CB 4.13Å; M451-F517 HydrophobicContact SD-CD1 4.26Å; M451-F517 HydrophobicContact SD-CD2 3.77Å; M451-F517 HydrophobicContact SD-CE2 4.24Å; M451-F517 HydrophobicContact SD-CG 3.79Å; K515-F517 PolarHBondContact O-N 3.21Å; F517-Y749 WeakPolarHBondContact CD1-O 3.4Å; F517-Y749 HydrophobicContact CE2-CD2 4.25Å; F517-Y749 HydrophobicContact CZ-CD2 4.24Å; F517-Y749 HydrophobicContact CZ-CG 4.22Å; F517-Y749 PolarHBondContact N-O 3.38Å; F517-I751 HydrophobicContact CD1-CG1 4.38Å; F517-I767 HydrophobicContact CB-CG2 4.01Å; F517-L776 HydrophobicContact CB-CD1 4.16Å
518	M	93.7	Very high	92.1	Very high	15 Å²	15	36.1 Å²	36.1	7%	0.074	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	130.1	176.8	-169.7	174.5	-63.8	0	0	110.7	F447 P516 T725 G748 Y749 K780 W784	F447-M518 HydrophobicContact CD1-CE 4.41Å; F447-M518 HydrophobicContact CD2-CE 4.42Å; F447-M518 HydrophobicContact CE1-CE 3.86Å; F447-M518 HydrophobicContact CE2-CE 3.83Å; F447-M518 HydrophobicContact CZ-CE 3.53Å; P516-M518 VanDerWaalsContact C-N 3.31Å; M518-T725 HydrophobicContact CG-CG2 4.26Å; M518-T725 HydrophobicContact SD-CG2 3.55Å; M518-T725 VanDerWaalsContact SD-CG2 3.55Å; M518-G748 CarbonylContact O-C 3.57Å; M518-G748 WeakPolarHBondContact O-CA 3.35Å; M518-Y749 HydrophobicContact CB-CD2 4.28Å; M518-Y749 PolarHBondContact O-N 2.89Å; M518-K780 HydrophobicContact CE-CB 4.27Å; M518-K780 HydrophobicContact CE-CD 4.22Å; M518-K780 HydrophobicContact CE-CG 3.98Å; M518-W784 HydrophobicContact CE-CH2 4.27Å; M518-W784 HydrophobicContact CE-CZ3 4.49Å
519	T	93.4	Very high	90.9	Very high	116 Å²	116	34.4 Å²	34.4	71%	0.712	17%	0.171	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	142	175.8	53.8	0	0	0	0	111.4	K747	T519-K747 WeakPolarHBondContact CA-O 3.48Å
520	L	93.6	Very high	89.5	Confident	6 Å²	6	33.8 Å²	33.8	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	-178.7	-171.4	62.2	101	0	0	0	111.3	E723 T725 K747 Y749	L520-E723 HydrophobicContact CD1-CB 3.99Å; L520-E723 HydrophobicContact CD1-CG 3.75Å; L520-T725 HydrophobicContact CB-CG2 3.87Å; L520-T725 HydrophobicContact CD2-CG2 4.36Å; L520-K747 HydrophobicContact CD1-CB 3.76Å; L520-K747 HydrophobicContact CD1-CD 4.5Å; L520-K747 HydrophobicContact CG-CB 4.15Å; L520-K747 PolarHBondContact N-O 3.41Å; L520-K747 PolarHBondContact O-N 2.94Å; L520-K747 VanDerWaalsContact O-O 3.08Å; L520-Y749 HydrophobicContact CD2-CD1 3.61Å; L520-Y749 HydrophobicContact CD2-CD2 3.51Å; L520-Y749 HydrophobicContact CD2-CE1 3.46Å; L520-Y749 VanDerWaalsContact CD2-CE1 3.46Å; L520-Y749 HydrophobicContact CD2-CE2 3.33Å; L520-Y749 HydrophobicContact CD2-CG 3.64Å
521	G	93.9	Very high	87.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.191	C	C	.	.			trans	-159.8	169.2	169.5	0	0	0	0	0	111.2	S724 D745	G521-S724 PolarHBondContact N-OG 3.02Å; G521-S724 WeakPolarHBondContact O-CB 3.22Å; G521-S724 PolarHBondContact O-N 3.41Å; G521-S724 PolarHBondContact O-OG 3.37Å; G521-D745 WeakPolarHBondContact CA-O 3.41Å; G521-D745 WeakPolarHBondContact CA-OD1 3.39Å
522	I	94.4	Very high	86.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	135.1	171	-51.2	159.4	0	0	0	108.2	T675 F678 F679 L721 L744 D745	I522-T675 HydrophobicContact CD1-CG2 3.82Å; I522-T675 HydrophobicContact CG1-CG2 3.88Å; I522-T675 HydrophobicContact CG2-CG2 3.78Å; I522-F678 HydrophobicContact CD1-CB 4.41Å; I522-F678 HydrophobicContact CD1-CD1 3.37Å; I522-F678 HydrophobicContact CD1-CE1 3.66Å; I522-F678 HydrophobicContact CD1-CG 3.86Å; I522-F678 HydrophobicContact CD1-CZ 4.33Å; I522-F679 HydrophobicContact CD1-CE2 4.34Å; I522-L721 HydrophobicContact CG2-CB 4.34Å; I522-L721 HydrophobicContact CG2-CD2 4.11Å; I522-L744 HydrophobicContact CB-CB 4.05Å; I522-L744 HydrophobicContact CB-CD1 4.1Å; I522-L744 HydrophobicContact CG2-CD1 3.8Å; I522-L744 PolarHBondContact O-N 3.48Å; I522-D745 VanDerWaalsContact CD1-OD2 3.3Å; I522-D745 WeakPolarHBondContact CD1-OD2 3.24Å; I522-D745 PolarHBondContact N-OD1 2.86Å
523	S	93.8	Very high	84.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	155.4	177.9	68.6	0	0	0	0	110	L722 N727	S523-L722 PolarHBondContact N-O 3.22Å; S523-L722 PolarHBondContact O-N 3.28Å; S523-L722 VanDerWaalsContact O-N 3.1Å; S523-L722 VanDerWaalsContact O-O 3.06Å; S523-L722 PolarHBondContact OG-O 2.98Å; S523-N727 WeakPolarHBondContact OG-CB 3.46Å; S523-N727 PolarHBondContact OG-ND2 2.92Å
524	I	93.5	Very high	83.1	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.015	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.7	172.6	-62.9	164.5	0	0	0	108.5	V656 L659 A719 L721 N727 Q739 I740	I524-V656 HydrophobicContact CD1-CB 4.3Å; I524-V656 HydrophobicContact CD1-CG1 4.45Å; I524-V656 HydrophobicContact CD1-CG2 3.46Å; I524-V656 VanDerWaalsContact CD1-CG2 3.46Å; I524-V656 HydrophobicContact CG1-CG2 4.48Å; I524-L659 HydrophobicContact CD1-CD2 3.83Å; I524-L659 HydrophobicContact CG1-CD2 4.38Å; I524-A719 HydrophobicContact CG2-CB 4.02Å; I524-L721 HydrophobicContact CG1-CD2 3.65Å; I524-N727 PolarHBondContact O-ND2 3.03Å; I524-Q739 VanDerWaalsContact O-CA 3.32Å; I524-Q739 WeakPolarHBondContact O-CA 3.38Å; I524-I740 HydrophobicContact CB-CB 4.15Å; I524-I740 HydrophobicContact CG2-CB 4.07Å; I524-I740 HydrophobicContact CG2-CD1 4.45Å; I524-I740 PolarHBondContact O-N 2.95Å
525	M	92.6	Very high	81.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	131	165	176.6	-173.4	-71.5	0	0	109.7	I710 Y720 L722 N727 L737	M525-I710 HydrophobicContact CE-CG1 4.42Å; M525-I710 HydrophobicContact SD-CG1 3.89Å; M525-Y720 PolarHBondContact N-O 3.33Å; M525-Y720 PolarHBondContact O-N 3.3Å; M525-L722 HydrophobicContact CB-CD2 3.48Å; M525-L722 VanDerWaalsContact CB-CD2 3.48Å; M525-L722 HydrophobicContact CE-CD1 3.89Å; M525-L722 HydrophobicContact CE-CD2 4.14Å; M525-N727 HydrophobicContact CE-CB 4.28Å; M525-N727 WeakPolarHBondContact CE-OD1 3.26Å; M525-L737 HydrophobicContact CE-CD1 4.14Å; M525-L737 HydrophobicContact CG-CB 4.48Å; M525-L737 HydrophobicContact CG-CD2 4.13Å; M525-L737 HydrophobicContact SD-CD1 3.85Å; M525-L737 HydrophobicContact SD-CD2 4Å; M525-L737 HydrophobicContact SD-CG 4.4Å
526	Y	91.1	Very high	80.8	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.016	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	160.7	177.7	-173.4	-113.7	0	0	0	110.8	H529 P652 I665 Y718 A719 T738 I740	Y526-H529 AromaticContact CE1-CD2 3.59Å; Y526-H529 AromaticContact CE1-NE2 2.69Å; Y526-H529 WeakPolarHBondContact CE1-NE2 3.45Å; Y526-H529 AromaticContact CZ-NE2 2.82Å; Y526-H529 PolarHBondContact OH-NE2 3.26Å; Y526-P652 HydrophobicContact CE1-CG 4.43Å; Y526-I665 HydrophobicContact CE2-CG2 3.99Å; Y526-Y718 WeakPolarHBondContact CD2-O 3.28Å; Y526-A719 HydrophobicContact CD2-CB 3.92Å; Y526-T738 PolarHBondContact N-O 3.13Å; Y526-T738 PolarHBondContact O-N 3.04Å; Y526-T738 VanDerWaalsContact O-O 3.08Å; Y526-T738 PolarHBondContact O-OG1 3.15Å; Y526-I740 HydrophobicContact CD1-CD1 3.7Å; Y526-I740 HydrophobicContact CG-CD1 3.87Å
527	R	87.9	Confident	80	Confident	73 Å²	73	64.7 Å²	64.7	28%	0.275	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	143.5	-179.7	66.8	-172.9	-170.2	160.5	0.5	112.4	H529 V713 N717 N736	R527-H529 PolarHBondContact O-N 3.27Å; R527-V713 HydrophobicContact CB-CG1 4.33Å; R527-V713 WeakPolarHBondContact CD-O 3.36Å; R527-N717 PolarHBondContact NH2-OD1 3.01Å; R527-N736 CarbonylContact C-O 3.49Å; R527-N736 VanDerWaalsContact CA-O 3.29Å; R527-N736 WeakPolarHBondContact CA-O 3.45Å
528	V	80.9	Confident	79.1	Confident	36 Å²	36	64.5 Å²	64.5	22%	0.218	32%	0.316	C	S	.	.			trans	-66.8	119.5	176.3	-178.4	0	0	0	0	109	L530 N736 T738	V528-L530 HydrophobicContact CG1-CD1 4.04Å; V528-L530 PolarHBondContact O-N 3.11Å; V528-N736 PolarHBondContact N-O 2.98Å; V528-T738 WeakPolarHBondContact CA-OG1 3.45Å; V528-T738 HydrophobicContact CB-CG2 4.49Å; V528-T738 HydrophobicContact CG2-CG2 3.55Å; V528-T738 PolarHBondContact N-OG1 3.26Å
529	H	64.8	Low	78.6	Confident	76 Å²	76	65.3 Å²	65.3	35%	0.352	32%	0.319	S	S	.	.			trans	-78.2	100.3	165.9	-77.9	-64.4	0	0	0	109.6	Y526 R527 G531 P652	Y526-H529 AromaticContact CE1-CD2 3.59Å; Y526-H529 AromaticContact CE1-NE2 2.69Å; Y526-H529 WeakPolarHBondContact CE1-NE2 3.45Å; Y526-H529 AromaticContact CZ-NE2 2.82Å; Y526-H529 PolarHBondContact OH-NE2 3.26Å; R527-H529 PolarHBondContact O-N 3.27Å; H529-G531 PolarHBondContact O-N 3.02Å; H529-G531 VanDerWaalsContact O-N 3.15Å; H529-P652 WeakPolarHBondContact NE2-CG 3.43Å
530	L	58.3	Low	78.2	Confident	144 Å²	144	63 Å²	63	75%	0.754	30%	0.302	S	S	*	.			trans	-63.8	115	161	-87.1	75.5	0	0	0	107.5	V528	V528-L530 HydrophobicContact CG1-CD1 4.04Å; V528-L530 PolarHBondContact O-N 3.11Å
531	G	54.8	Low	77.7	Confident	49 Å²	49	67.3 Å²	67.3	51%	0.505	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-49	140.1	-179.8	0	0	0	0	0	112	H529 R533	H529-G531 PolarHBondContact O-N 3.02Å; H529-G531 VanDerWaalsContact O-N 3.15Å; G531-R533 PolarHBondContact O-N 3.5Å
532	R	55	Low	77.4	Confident	246 Å²	246	68 Å²	68	93%	0.928	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-52.8	126.8	-178.4	-175.7	175	-179.1	145.1	-1.3	109.5
533	R	58.4	Low	77.2	Confident	210 Å²	210	69 Å²	69	79%	0.792	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-53	136.2	176.8	-65.3	-171.8	-173.6	-175.9	2.8	109.4	G531 G535	G531-R533 PolarHBondContact O-N 3.5Å; R533-G535 PolarHBondContact O-N 3.37Å
534	P	64.4	Low	77	Confident	39 Å²	39	72.4 Å²	72.4	25%	0.253	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-56	134.5	-179	21.3	-31.4	0	0	0	110.2	N831	P534-N831 WeakPolarHBondContact CG-OD1 3.38Å
535	G	68	Low	76.8	Confident	47 Å²	47	77.6 Å²	77.6	49%	0.485	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-74.8	157.5	177.9	0	0	0	0	0	111.3	R533 F537 S538	R533-G535 PolarHBondContact O-N 3.37Å; G535-F537 PolarHBondContact O-N 2.99Å; G535-S538 WeakPolarHBondContact O-CB 3.45Å; G535-S538 PolarHBondContact O-N 3.01Å; G535-S538 PolarHBondContact O-OG 3.25Å
536	Y	74.3	Confident	76.8	Confident	162 Å²	162	79.2 Å²	79.2	64%	0.635	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-24.3	-179.9	-73.6	-77.7	0	0	0	114.9	G834	Y536-G834 VanDerWaalsContact O-CA 3.22Å; Y536-G834 WeakPolarHBondContact O-CA 3.4Å; Y536-G834 PolarHBondContact O-N 2.83Å
537	F	78.4	Confident	76.8	Confident	122 Å²	122	81.4 Å²	81.4	54%	0.535	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	12.9	179	-65.1	-69	0	0	0	114.7	G535 F539 L540	G535-F537 PolarHBondContact O-N 2.99Å; F537-F539 AromaticContact CD1-CE1 3.96Å; F537-F539 HydrophobicContact CD1-CE1 3.96Å; F537-F539 HydrophobicContact CD1-CZ 4.18Å; F537-F539 PolarHBondContact O-N 3Å; F537-L540 HydrophobicContact CB-CD1 4.42Å; F537-L540 HydrophobicContact CD1-CD1 4.43Å; F537-L540 WeakPolarHBondContact O-CB 3.4Å; F537-L540 PolarHBondContact O-N 3.05Å
538	S	76.9	Confident	77	Confident	7 Å²	7	82.1 Å²	82.1	5%	0.049	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.1	-176.2	65.3	0	0	0	0	115.2	G535 L540 D541	G535-S538 WeakPolarHBondContact O-CB 3.45Å; G535-S538 PolarHBondContact O-N 3.01Å; G535-S538 PolarHBondContact O-OG 3.25Å; S538-L540 PolarHBondContact O-N 3.02Å; S538-D541 WeakPolarHBondContact CA-OD2 3.5Å
539	F	81.4	Confident	77.5	Confident	32 Å²	32	85.2 Å²	85.2	14%	0.14	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-14.4	170.9	70.6	-90.4	0	0	0	113.4	F537 P542 Y636 I835 V838	F537-F539 AromaticContact CD1-CE1 3.96Å; F537-F539 HydrophobicContact CD1-CE1 3.96Å; F537-F539 HydrophobicContact CD1-CZ 4.18Å; F537-F539 PolarHBondContact O-N 3Å; F539-P542 WeakPolarHBondContact O-CD 3.46Å; F539-Y636 WeakPolarHBondContact O-CE2 3.36Å; F539-Y636 PolarHBondContact O-OH 3.39Å; F539-I835 HydrophobicContact CB-CD1 4.36Å; F539-I835 HydrophobicContact CB-CG1 4.44Å; F539-I835 HydrophobicContact CD1-CG1 3.92Å; F539-I835 HydrophobicContact CD2-CG1 4.32Å; F539-I835 HydrophobicContact CE1-CG1 4.24Å; F539-I835 HydrophobicContact CG-CD1 4.39Å; F539-I835 HydrophobicContact CG-CG1 3.97Å; F539-V838 HydrophobicContact CZ-CG2 4.27Å
540	L	85.4	Confident	78.8	Confident	68 Å²	68	88.5 Å²	88.5	36%	0.356	45%	0.453	S	S	.	.	S	Bend	trans	-87	-26	174.6	-64.3	177.6	0	0	0	112.8	F537 S538 P542 F543 W548	F537-L540 HydrophobicContact CB-CD1 4.42Å; F537-L540 HydrophobicContact CD1-CD1 4.43Å; F537-L540 WeakPolarHBondContact O-CB 3.4Å; F537-L540 PolarHBondContact O-N 3.05Å; S538-L540 PolarHBondContact O-N 3.02Å; L540-P542 VanDerWaalsContact C-N 3.35Å; L540-P542 WeakPolarHBondContact O-CD 3.07Å; L540-F543 PolarHBondContact O-N 2.96Å; L540-W548 HydrophobicContact CD2-CH2 4.43Å; L540-W548 HydrophobicContact CD2-CZ2 3.9Å; L540-W548 PolarHBondContact O-NE1 2.91Å; L540-W548 VanDerWaalsContact O-NE1 3.07Å
541	D	84.1	Confident	80.4	Confident	96 Å²	96	82.4 Å²	82.4	51%	0.513	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.4	-178.1	-59.6	-14.7	0	0	0	116.2	S538 F543 F643	S538-D541 WeakPolarHBondContact CA-OD2 3.5Å; D541-F543 PolarHBondContact O-N 2.67Å; D541-F643 HydrophobicContact CB-CZ 4.19Å
542	P	87.5	Confident	82	Confident	13 Å²	13	84.6 Å²	84.6	8%	0.084	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-16.2	176.8	-27.4	36.3	0	0	0	115.5	F539 L540 Y636 N639 L640	F539-P542 WeakPolarHBondContact O-CD 3.46Å; L540-P542 VanDerWaalsContact C-N 3.35Å; L540-P542 WeakPolarHBondContact O-CD 3.07Å; P542-Y636 HydrophobicContact CB-CD2 4.04Å; P542-Y636 HydrophobicContact CB-CE2 4.02Å; P542-Y636 HydrophobicContact CG-CE2 4.01Å; P542-N639 HydrophobicContact CB-CB 3.93Å; P542-N639 PolarHBondContact O-ND2 2.96Å; P542-N639 VanDerWaalsContact O-ND2 3.12Å; P542-L640 HydrophobicContact CB-CB 4.4Å; P542-L640 HydrophobicContact CG-CB 3.91Å; P542-L640 HydrophobicContact CG-CD1 3.8Å; P542-L640 HydrophobicContact CG-CG 4.45Å
543	F	88.9	Confident	83.8	Confident	23 Å²	23	77.2 Å²	77.2	10%	0.101	40%	0.398	C	S	.	.	S	Bend	trans	-130.9	139.1	171.7	-72.6	-29	0	0	0	110.7	L540 D541 V547 W548 I632 Y636	L540-F543 PolarHBondContact O-N 2.96Å; D541-F543 PolarHBondContact O-N 2.67Å; F543-V547 HydrophobicContact CB-CB 4.18Å; F543-V547 HydrophobicContact CB-CG1 4.12Å; F543-V547 HydrophobicContact CD1-CG1 4.28Å; F543-V547 HydrophobicContact CD2-CG1 4.15Å; F543-V547 HydrophobicContact CG-CG1 3.96Å; F543-W548 HydrophobicContact CB-CZ2 4.47Å; F543-W548 HydrophobicContact CD2-CH2 4.5Å; F543-W548 HydrophobicContact CD2-CZ2 4.15Å; F543-W548 PolarHBondContact O-NE1 2.79Å; F543-I632 HydrophobicContact CE2-CG2 3.94Å; F543-I632 HydrophobicContact CZ-CG2 4.23Å; F543-Y636 HydrophobicContact CD2-CD2 4.07Å; F543-Y636 HydrophobicContact CE2-CD2 4.02Å; F543-Y636 HydrophobicContact CE2-CG 4.3Å
544	S	89.8	Confident	85.4	Confident	70 Å²	70	68.6 Å²	68.6	49%	0.49	37%	0.372	S	S	.	.			trans	-66	154	176.1	70.9	0	0	0	0	111.6	G546 V547 W548	S544-G546 PolarHBondContact O-N 2.81Å; S544-V547 PolarHBondContact O-N 3.49Å; S544-W548 PolarHBondContact O-N 3.1Å
545	P	88.9	Confident	86.7	Confident	113 Å²	113	69.4 Å²	69.4	73%	0.734	37%	0.37	S	S	*	.	H	α-helix	trans	-53.9	-29.9	178.1	-28.8	36	0	0	0	114.3	W548 L549	P545-W548 PolarHBondContact O-N 2.76Å; P545-L549 PolarHBondContact O-N 2.65Å; P545-L549 VanDerWaalsContact O-N 3.07Å
546	G	92.5	Very high	87.8	Confident	33 Å²	33	70.8 Å²	70.8	34%	0.34	37%	0.366	S	S	.	.	H	α-helix	trans	-65.1	-41.1	174.2	0	0	0	0	0	113.3	S544 L549 F550	S544-G546 PolarHBondContact O-N 2.81Å; G546-L549 PolarHBondContact O-N 3.46Å; G546-F550 WeakPolarHBondContact O-CD2 3.36Å; G546-F550 PolarHBondContact O-N 3.37Å
547	V	92.4	Very high	88.7	Confident	51 Å²	51	65.6 Å²	65.6	31%	0.309	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-43.5	176.3	174.8	0	0	0	0	110.4	F543 S544 L549 F550 M551	F543-V547 HydrophobicContact CB-CB 4.18Å; F543-V547 HydrophobicContact CB-CG1 4.12Å; F543-V547 HydrophobicContact CD1-CG1 4.28Å; F543-V547 HydrophobicContact CD2-CG1 4.15Å; F543-V547 HydrophobicContact CG-CG1 3.96Å; S544-V547 PolarHBondContact O-N 3.49Å; V547-L549 VanDerWaalsContact C-N 3.31Å; V547-L549 PolarHBondContact O-N 3.06Å; V547-F550 PolarHBondContact O-N 2.86Å; V547-M551 HydrophobicContact CG1-CG 4.41Å; V547-M551 WeakPolarHBondContact O-CB 3.39Å; V547-M551 VanDerWaalsContact O-CG 3.31Å; V547-M551 WeakPolarHBondContact O-CG 3.11Å; V547-M551 PolarHBondContact O-N 3.49Å
548	W	91.4	Very high	89.3	Confident	87 Å²	87	61.1 Å²	61.1	33%	0.33	34%	0.34	S	S	.	.	H	α-helix	trans	-58.4	-40.5	174.5	-72.6	112.4	0	0	0	112.8	L540 F543 S544 P545 M551 L552 Y636	L540-W548 HydrophobicContact CD2-CH2 4.43Å; L540-W548 HydrophobicContact CD2-CZ2 3.9Å; L540-W548 PolarHBondContact O-NE1 2.91Å; L540-W548 VanDerWaalsContact O-NE1 3.07Å; F543-W548 HydrophobicContact CB-CZ2 4.47Å; F543-W548 HydrophobicContact CD2-CH2 4.5Å; F543-W548 HydrophobicContact CD2-CZ2 4.15Å; F543-W548 PolarHBondContact O-NE1 2.79Å; S544-W548 PolarHBondContact O-N 3.1Å; P545-W548 PolarHBondContact O-N 2.76Å; W548-M551 PolarHBondContact O-N 3.39Å; W548-L552 PolarHBondContact O-N 3.39Å; W548-L552 VanDerWaalsContact O-N 3.13Å; W548-Y636 HydrophobicContact CH2-CE2 4.49Å; W548-Y636 HydrophobicContact CZ2-CE2 4.24Å
549	L	91.8	Very high	90	Very high	101 Å²	101	60.9 Å²	60.9	53%	0.529	34%	0.338	S	S	.	.	H	α-helix	trans	-64.9	-46	175.1	-176.9	66.1	0	0	0	112.2	P545 G546 V547 M551 L552 L553	P545-L549 PolarHBondContact O-N 2.65Å; P545-L549 VanDerWaalsContact O-N 3.07Å; G546-L549 PolarHBondContact O-N 3.46Å; V547-L549 VanDerWaalsContact C-N 3.31Å; V547-L549 PolarHBondContact O-N 3.06Å; L549-M551 VanDerWaalsContact C-N 3.31Å; L549-M551 PolarHBondContact O-N 2.97Å; L549-L552 PolarHBondContact O-N 2.96Å; L549-L553 HydrophobicContact CG-CD1 4.29Å; L549-L553 WeakPolarHBondContact O-CG 3.14Å; L549-L553 PolarHBondContact O-N 3.42Å
550	F	92.7	Very high	90.4	Very high	146 Å²	146	63.1 Å²	63.1	64%	0.64	36%	0.356	S	S	*	.	H	α-helix	trans	-64.8	-34.2	177	-73.2	-59.7	0	0	0	112.7	G546 V547 L553 A554	G546-F550 WeakPolarHBondContact O-CD2 3.36Å; G546-F550 PolarHBondContact O-N 3.37Å; V547-F550 PolarHBondContact O-N 2.86Å; F550-L553 HydrophobicContact CD1-CD1 4.33Å; F550-L553 PolarHBondContact O-N 2.81Å; F550-A554 VanDerWaalsContact O-CB 3.3Å; F550-A554 WeakPolarHBondContact O-CB 3.44Å; F550-A554 PolarHBondContact O-N 2.94Å
551	M	90.6	Very high	90.6	Very high	15 Å²	15	63 Å²	63	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-44.2	172.6	-76.3	-58.8	-54.2	0	0	112.3	V547 W548 L549 A554 Y555 F604 F628 I632	V547-M551 HydrophobicContact CG1-CG 4.41Å; V547-M551 WeakPolarHBondContact O-CB 3.39Å; V547-M551 VanDerWaalsContact O-CG 3.31Å; V547-M551 WeakPolarHBondContact O-CG 3.11Å; V547-M551 PolarHBondContact O-N 3.49Å; W548-M551 PolarHBondContact O-N 3.39Å; L549-M551 VanDerWaalsContact C-N 3.31Å; L549-M551 PolarHBondContact O-N 2.97Å; M551-A554 PolarHBondContact O-N 3.27Å; M551-Y555 WeakPolarHBondContact O-CB 3.38Å; M551-Y555 PolarHBondContact O-N 2.7Å; M551-F604 HydrophobicContact CE-CD2 4.2Å; M551-F604 HydrophobicContact CE-CE2 3.53Å; M551-F604 HydrophobicContact CE-CZ 4.29Å; M551-F628 HydrophobicContact CE-CE1 3.69Å; M551-F628 HydrophobicContact CE-CZ 4.14Å; M551-F628 HydrophobicContact SD-CE1 3.69Å; M551-F628 HydrophobicContact SD-CZ 3.48Å; M551-F628 WeakPolarHBondContact SD-CZ 3.39Å; M551-I632 HydrophobicContact CE-CB 4.39Å; M551-I632 HydrophobicContact CE-CG1 4.2Å; M551-I632 HydrophobicContact CE-CG2 3.84Å; M551-I632 HydrophobicContact SD-CB 4.35Å; M551-I632 HydrophobicContact SD-CD1 3.74Å; M551-I632 HydrophobicContact SD-CG1 3.71Å; M551-I632 HydrophobicContact SD-CG2 3.83Å
552	L	90.4	Very high	90.8	Very high	95 Å²	95	58.4 Å²	58.4	50%	0.497	33%	0.334	S	S	.	.	H	α-helix	trans	-63.3	-44.8	175.7	-178.8	65.1	0	0	0	111.5	W548 L549 Y555 L556	W548-L552 PolarHBondContact O-N 3.39Å; W548-L552 VanDerWaalsContact O-N 3.13Å; L549-L552 PolarHBondContact O-N 2.96Å; L552-Y555 HydrophobicContact CD1-CD1 4.27Å; L552-Y555 PolarHBondContact O-N 3.26Å; L552-L556 HydrophobicContact CG-CD1 4.48Å; L552-L556 WeakPolarHBondContact O-CG 3.07Å; L552-L556 PolarHBondContact O-N 3.33Å
553	L	92.1	Very high	90.9	Very high	91 Å²	91	60.8 Å²	60.8	48%	0.476	34%	0.343	S	S	.	.	H	α-helix	trans	-63.1	-43.1	177.4	-70.4	170.6	0	0	0	112.1	L549 F550 L556 A557	L549-L553 HydrophobicContact CG-CD1 4.29Å; L549-L553 WeakPolarHBondContact O-CG 3.14Å; L549-L553 PolarHBondContact O-N 3.42Å; F550-L553 HydrophobicContact CD1-CD1 4.33Å; F550-L553 PolarHBondContact O-N 2.81Å; L553-L556 PolarHBondContact O-N 3.4Å; L553-A557 WeakPolarHBondContact O-CB 3.45Å; L553-A557 PolarHBondContact O-N 2.86Å
554	A	91.6	Very high	90.8	Very high	29 Å²	29	64.5 Å²	64.5	24%	0.24	36%	0.363	C	S	.	.	H	α-helix	trans	-62.7	-42.7	176.4	0	0	0	0	0	111.9	F550 M551 A557 V558 W625 F628	F550-A554 VanDerWaalsContact O-CB 3.3Å; F550-A554 WeakPolarHBondContact O-CB 3.44Å; F550-A554 PolarHBondContact O-N 2.94Å; M551-A554 PolarHBondContact O-N 3.27Å; A554-A557 PolarHBondContact O-N 2.9Å; A554-V558 WeakPolarHBondContact O-CG2 3.35Å; A554-V558 PolarHBondContact O-N 3.07Å; A554-W625 HydrophobicContact CB-CZ3 4.49Å; A554-F628 HydrophobicContact CB-CE1 4.3Å; A554-F628 HydrophobicContact CB-CZ 4.33Å
555	Y	91.7	Very high	90.6	Very high	56 Å²	56	62.6 Å²	62.6	22%	0.22	35%	0.349	C	S	.	.	H	α-helix	trans	-58	-48.7	174	159.5	-107.2	0	0	0	112.4	M551 L552 S559 F597 P600 V601	M551-Y555 WeakPolarHBondContact O-CB 3.38Å; M551-Y555 PolarHBondContact O-N 2.7Å; L552-Y555 HydrophobicContact CD1-CD1 4.27Å; L552-Y555 PolarHBondContact O-N 3.26Å; Y555-S559 WeakPolarHBondContact O-CB 3.46Å; Y555-S559 PolarHBondContact O-N 2.88Å; Y555-S559 PolarHBondContact O-OG 3.46Å; Y555-F597 HydrophobicContact CE1-CD1 4.3Å; Y555-F597 WeakPolarHBondContact CE2-O 2.93Å; Y555-F597 AromaticContact CZ-CD1 3.96Å; Y555-F597 PolarHBondContact OH-O 2.85Å; Y555-P600 HydrophobicContact CD2-CB 3.88Å; Y555-P600 HydrophobicContact CE2-CB 4.01Å; Y555-V601 HydrophobicContact CE2-CG2 3.64Å
556	L	92.1	Very high	90.4	Very high	76 Å²	76	57.2 Å²	57.2	40%	0.398	31%	0.314	S	S	.	.	H	α-helix	trans	-63.7	-42	178	-66.8	175.1	0	0	0	111.6	L552 L553 S559 C560 F597	L552-L556 HydrophobicContact CG-CD1 4.48Å; L552-L556 WeakPolarHBondContact O-CG 3.07Å; L552-L556 PolarHBondContact O-N 3.33Å; L553-L556 PolarHBondContact O-N 3.4Å; L556-S559 PolarHBondContact O-N 3.16Å; L556-C560 WeakPolarHBondContact O-CB 3.45Å; L556-C560 PolarHBondContact O-N 3.14Å; L556-F597 HydrophobicContact CD2-CD1 4.37Å; L556-F597 HydrophobicContact CD2-CE1 3.67Å; L556-F597 HydrophobicContact CD2-CZ 4.48Å
557	A	91.9	Very high	89.9	Confident	53 Å²	53	60.6 Å²	60.6	44%	0.438	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-48.8	178	0	0	0	0	0	112.2	L553 A554 S559 C560 V561	L553-A557 WeakPolarHBondContact O-CB 3.45Å; L553-A557 PolarHBondContact O-N 2.86Å; A554-A557 PolarHBondContact O-N 2.9Å; A557-S559 VanDerWaalsContact C-N 3.34Å; A557-S559 PolarHBondContact O-N 3.13Å; A557-C560 PolarHBondContact O-N 3.43Å; A557-V561 WeakPolarHBondContact O-CG2 3.29Å; A557-V561 PolarHBondContact O-N 3.02Å
558	V	91.5	Very high	89.4	Confident	29 Å²	29	64.4 Å²	64.4	18%	0.176	33%	0.334	C	S	.	.	H	α-helix	trans	-64.6	-38.8	178.4	171.7	0	0	0	0	111.6	A554 C560 V561 L562 P600 V621 W625	A554-V558 WeakPolarHBondContact O-CG2 3.35Å; A554-V558 PolarHBondContact O-N 3.07Å; V558-C560 VanDerWaalsContact C-N 3.35Å; V558-C560 PolarHBondContact O-N 3.06Å; V558-V561 PolarHBondContact O-N 3.49Å; V558-L562 HydrophobicContact CG1-CD1 3.99Å; V558-L562 HydrophobicContact CG1-CG 4.35Å; V558-L562 WeakPolarHBondContact O-CB 3.33Å; V558-L562 WeakPolarHBondContact O-CG 3.35Å; V558-L562 PolarHBondContact O-N 3.31Å; V558-P600 HydrophobicContact CG1-CG 4.25Å; V558-V621 HydrophobicContact CG1-CG1 4.37Å; V558-W625 HydrophobicContact CB-CD2 4.45Å; V558-W625 HydrophobicContact CB-CE3 4.04Å; V558-W625 HydrophobicContact CB-CZ3 4.35Å; V558-W625 HydrophobicContact CG1-CB 4.11Å; V558-W625 HydrophobicContact CG1-CD2 3.98Å; V558-W625 HydrophobicContact CG1-CE3 4.02Å; V558-W625 HydrophobicContact CG1-CG 4.04Å; V558-W625 HydrophobicContact CG2-CD2 4.47Å; V558-W625 HydrophobicContact CG2-CE3 3.68Å; V558-W625 HydrophobicContact CG2-CZ3 4.05Å
559	S	91.3	Very high	89.1	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.014	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-43.6	174.7	-56	0	0	0	0	111.9	Y555 L556 A557 F563 S596 F597	Y555-S559 WeakPolarHBondContact O-CB 3.46Å; Y555-S559 PolarHBondContact O-N 2.88Å; Y555-S559 PolarHBondContact O-OG 3.46Å; L556-S559 PolarHBondContact O-N 3.16Å; A557-S559 VanDerWaalsContact C-N 3.34Å; A557-S559 PolarHBondContact O-N 3.13Å; S559-F563 WeakPolarHBondContact O-CB 3.47Å; S559-F563 PolarHBondContact O-N 3.21Å; S559-S596 WeakPolarHBondContact CA-O 3.05Å; S559-S596 WeakPolarHBondContact CB-O 3.39Å; S559-S596 WeakPolarHBondContact O-CB 3.32Å; S559-S596 PolarHBondContact OG-O 2.77Å; S559-F597 WeakPolarHBondContact OG-CD1 3.24Å
560	C	90.1	Very high	88.2	Confident	78 Å²	78	60.9 Å²	60.9	53%	0.527	33%	0.328	S	S	.	.	H	α-helix	trans	-66.5	-45.4	176.3	-172	0	0	0	0	112.2	L556 A557 V558 L562 F563 L564	L556-C560 WeakPolarHBondContact O-CB 3.45Å; L556-C560 PolarHBondContact O-N 3.14Å; A557-C560 PolarHBondContact O-N 3.43Å; V558-C560 VanDerWaalsContact C-N 3.35Å; V558-C560 PolarHBondContact O-N 3.06Å; C560-L562 PolarHBondContact O-N 2.83Å; C560-F563 WeakPolarHBondContact O-CB 3.41Å; C560-F563 PolarHBondContact O-N 3.14Å; C560-L564 WeakPolarHBondContact O-CB 3.37Å; C560-L564 PolarHBondContact O-N 2.92Å
561	V	90.3	Very high	87.4	Confident	65 Å²	65	62.7 Å²	62.7	39%	0.394	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-43.5	177.3	170.7	0	0	0	0	111.1	A557 V558 L564 V565 V621	A557-V561 WeakPolarHBondContact O-CG2 3.29Å; A557-V561 PolarHBondContact O-N 3.02Å; V558-V561 PolarHBondContact O-N 3.49Å; V561-L564 PolarHBondContact O-N 3.19Å; V561-V565 HydrophobicContact CG1-CG2 4.03Å; V561-V565 VanDerWaalsContact O-CB 3.3Å; V561-V565 WeakPolarHBondContact O-CB 3Å; V561-V565 VanDerWaalsContact O-CG2 3.24Å; V561-V565 WeakPolarHBondContact O-CG2 3.38Å; V561-V565 PolarHBondContact O-N 2.83Å; V561-V621 HydrophobicContact CG1-CG1 4.12Å; V561-V621 HydrophobicContact CG1-CG2 4.12Å
562	L	87.8	Confident	86.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-43.7	175.3	-76.6	171.8	0	0	0	112	V558 C560 A566 F599 P600 V621	V558-L562 HydrophobicContact CG1-CD1 3.99Å; V558-L562 HydrophobicContact CG1-CG 4.35Å; V558-L562 WeakPolarHBondContact O-CB 3.33Å; V558-L562 WeakPolarHBondContact O-CG 3.35Å; V558-L562 PolarHBondContact O-N 3.31Å; C560-L562 PolarHBondContact O-N 2.83Å; L562-A566 WeakPolarHBondContact O-CB 3.07Å; L562-A566 PolarHBondContact O-N 3.07Å; L562-F599 HydrophobicContact CD1-CD1 3.54Å; L562-F599 HydrophobicContact CD1-CE1 3.9Å; L562-P600 HydrophobicContact CD1-CG 3.87Å; L562-V621 HydrophobicContact CD2-CB 3.92Å; L562-V621 HydrophobicContact CD2-CG1 3.62Å; L562-V621 HydrophobicContact CG-CG1 3.83Å
563	F	88.4	Confident	86.3	Confident	63 Å²	63	61.4 Å²	61.4	28%	0.276	32%	0.32	S	S	.	.	H	α-helix	trans	-58.7	-47.9	174.6	179.5	-104.8	0	0	0	112.2	S559 C560 R567 L593 S596	S559-F563 WeakPolarHBondContact O-CB 3.47Å; S559-F563 PolarHBondContact O-N 3.21Å; C560-F563 WeakPolarHBondContact O-CB 3.41Å; C560-F563 PolarHBondContact O-N 3.14Å; F563-R567 HydrophobicContact CE2-CG 4.36Å; F563-R567 HydrophobicContact CZ-CG 4.43Å; F563-R567 WeakPolarHBondContact O-CB 3.1Å; F563-R567 WeakPolarHBondContact O-CG 3.22Å; F563-R567 PolarHBondContact O-N 2.92Å; F563-R567 VanDerWaalsContact O-N 3.16Å; F563-L593 HydrophobicContact CD1-CD1 4.39Å; F563-L593 HydrophobicContact CD2-CB 4.41Å; F563-L593 HydrophobicContact CD2-CD1 4.38Å; F563-L593 HydrophobicContact CE2-CB 4.17Å; F563-L593 HydrophobicContact CG-CD1 4.28Å; F563-S596 WeakPolarHBondContact CA-OG 3.27Å; F563-S596 WeakPolarHBondContact CB-OG 3.34Å
564	L	87.1	Confident	85.3	Confident	101 Å²	101	59.7 Å²	59.7	53%	0.529	31%	0.308	S	S	.	.	H	α-helix	trans	-65.4	-51.9	-179.5	-170	75.1	0	0	0	111.7	C560 V561 A566 R567 L568	C560-L564 WeakPolarHBondContact O-CB 3.37Å; C560-L564 PolarHBondContact O-N 2.92Å; V561-L564 PolarHBondContact O-N 3.19Å; L564-A566 PolarHBondContact O-N 3.09Å; L564-R567 PolarHBondContact O-N 3.3Å; L564-L568 HydrophobicContact CD1-CD1 4.35Å; L564-L568 HydrophobicContact CD2-CD1 4.41Å; L564-L568 HydrophobicContact CG-CD1 3.91Å; L564-L568 WeakPolarHBondContact O-CG 3.19Å; L564-L568 PolarHBondContact O-N 2.78Å
565	V	86.7	Confident	84.2	Confident	31 Å²	31	61 Å²	61	19%	0.188	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-40.3	-177.5	173.1	0	0	0	0	111.4	V561 R567 L568 T569 T618	V561-V565 HydrophobicContact CG1-CG2 4.03Å; V561-V565 VanDerWaalsContact O-CB 3.3Å; V561-V565 WeakPolarHBondContact O-CB 3Å; V561-V565 VanDerWaalsContact O-CG2 3.24Å; V561-V565 WeakPolarHBondContact O-CG2 3.38Å; V561-V565 PolarHBondContact O-N 2.83Å; V565-R567 VanDerWaalsContact C-N 3.3Å; V565-R567 PolarHBondContact O-N 2.7Å; V565-L568 PolarHBondContact O-N 3.49Å; V565-T569 VanDerWaalsContact O-CB 3.29Å; V565-T569 WeakPolarHBondContact O-CB 3.37Å; V565-T569 PolarHBondContact O-N 3.19Å; V565-T569 PolarHBondContact O-OG1 3.22Å; V565-T618 HydrophobicContact CG1-CG2 3.96Å
566	A	83.4	Confident	82.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-66.6	-31.6	176.6	0	0	0	0	0	112.5	L562 L564 E572 N589 Y591 T618	L562-A566 WeakPolarHBondContact O-CB 3.07Å; L562-A566 PolarHBondContact O-N 3.07Å; L564-A566 PolarHBondContact O-N 3.09Å; A566-E572 HydrophobicContact CB-CG 4.25Å; A566-N589 PolarHBondContact O-ND2 3.42Å; A566-Y591 HydrophobicContact CB-CD2 3.52Å; A566-Y591 HydrophobicContact CB-CE2 4.34Å; A566-Y591 HydrophobicContact CB-CG 3.65Å; A566-T618 HydrophobicContact CB-CG2 3.99Å
567	R	83.1	Confident	81.5	Confident	104 Å²	104	62.8 Å²	62.8	39%	0.392	32%	0.323	S	S	.	.	H	α-helix	trans	-75.5	-42.5	176.2	-73.3	-73.7	168.6	157.2	-3.7	112.6	F563 L564 V565 W573 Y591	F563-R567 HydrophobicContact CE2-CG 4.36Å; F563-R567 HydrophobicContact CZ-CG 4.43Å; F563-R567 WeakPolarHBondContact O-CB 3.1Å; F563-R567 WeakPolarHBondContact O-CG 3.22Å; F563-R567 PolarHBondContact O-N 2.92Å; F563-R567 VanDerWaalsContact O-N 3.16Å; L564-R567 PolarHBondContact O-N 3.3Å; V565-R567 VanDerWaalsContact C-N 3.3Å; V565-R567 PolarHBondContact O-N 2.7Å; R567-W573 PolarHBondContact O-NE1 2.87Å; R567-Y591 PolarHBondContact NE-O 3.49Å; R567-Y591 PolarHBondContact NH2-O 3.19Å
568	L	82.6	Confident	79.8	Confident	131 Å²	131	65.4 Å²	65.4	69%	0.686	34%	0.335	S	S	*	.	H	α-helix	trans	-71.5	-29.9	179.5	-68.1	173.8	0	0	0	113.4	L564 V565 P570	L564-L568 HydrophobicContact CD1-CD1 4.35Å; L564-L568 HydrophobicContact CD2-CD1 4.41Å; L564-L568 HydrophobicContact CG-CD1 3.91Å; L564-L568 WeakPolarHBondContact O-CG 3.19Å; L564-L568 PolarHBondContact O-N 2.78Å; V565-L568 PolarHBondContact O-N 3.49Å; L568-P570 WeakPolarHBondContact O-CD 3.45Å
569	T	83.8	Confident	78.2	Confident	24 Å²	24	69.6 Å²	69.6	15%	0.147	37%	0.365	C	S	.	.			trans	-86.3	114.3	-175.3	-50.1	0	0	0	0	111.4	V565 Y571 E572 A615 S617	V565-T569 VanDerWaalsContact O-CB 3.29Å; V565-T569 WeakPolarHBondContact O-CB 3.37Å; V565-T569 PolarHBondContact O-N 3.19Å; V565-T569 PolarHBondContact O-OG1 3.22Å; T569-Y571 HydrophobicContact CG2-CD2 4.02Å; T569-Y571 PolarHBondContact O-N 3.46Å; T569-Y571 VanDerWaalsContact O-N 3.14Å; T569-E572 PolarHBondContact O-N 3.2Å; T569-A615 HydrophobicContact CG2-CB 3.62Å; T569-S617 PolarHBondContact OG1-OG 3.38Å
570	P	74.1	Confident	76.6	Confident	90 Å²	90	75.3 Å²	75.3	58%	0.584	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-63.7	-24.5	-176.8	25.4	-34.6	0	0	0	113.3	L568 E572 W573	L568-P570 WeakPolarHBondContact O-CD 3.45Å; P570-E572 VanDerWaalsContact C-N 3.28Å; P570-E572 PolarHBondContact O-N 2.86Å; P570-W573 WeakPolarHBondContact O-CB 3.46Å; P570-W573 PolarHBondContact O-N 3.23Å; P570-W573 VanDerWaalsContact O-N 3.16Å
571	Y	75.6	Confident	74.8	Confident	184 Å²	184	81.9 Å²	81.9	72%	0.722	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-71.5	-11.5	180	-58.2	-72.8	0	0	0	115.3	T569	T569-Y571 HydrophobicContact CG2-CD2 4.02Å; T569-Y571 PolarHBondContact O-N 3.46Å; T569-Y571 VanDerWaalsContact O-N 3.14Å
572	E	80.1	Confident	73.2	Confident	2 Å²	2	82.5 Å²	82.5	1%	0.009	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-82.4	-21	169.3	-79	-59.6	164.1	0	0	113.3	A566 T569 P570 Y574 R614 A615 T618	A566-E572 HydrophobicContact CB-CG 4.25Å; T569-E572 PolarHBondContact O-N 3.2Å; P570-E572 VanDerWaalsContact C-N 3.28Å; P570-E572 PolarHBondContact O-N 2.86Å; E572-Y574 PolarHBondContact O-N 2.76Å; E572-R614 PolarHBondContact OE1-N 2.76Å; E572-R614 PolarHBondContact OE2-N 2.82Å; E572-A615 HydrophobicContact CG-CB 3.88Å; E572-A615 PolarHBondContact OE1-N 3.07Å; E572-T618 HydrophobicContact CG-CG2 3.83Å; E572-T618 WeakPolarHBondContact OE1-CB 3.37Å; E572-T618 PolarHBondContact OE1-OG1 2.72Å
573	W	77.8	Confident	71.7	Confident	81 Å²	81	93.9 Å²	93.9	31%	0.307	48%	0.476	S	S	.	.			trans	-82.1	119.2	-177.9	-67.4	85.1	0	0	0	109.7	R567 P570 L587 N589	R567-W573 PolarHBondContact O-NE1 2.87Å; P570-W573 WeakPolarHBondContact O-CB 3.46Å; P570-W573 PolarHBondContact O-N 3.23Å; P570-W573 VanDerWaalsContact O-N 3.16Å; W573-L587 HydrophobicContact CB-CB 4.13Å; W573-L587 HydrophobicContact CB-CD2 3.8Å; W573-L587 HydrophobicContact CE3-CB 3.95Å; W573-N589 HydrophobicContact CD2-CB 3.97Å; W573-N589 HydrophobicContact CE3-CB 3.9Å; W573-N589 HydrophobicContact CH2-CB 4.36Å; W573-N589 HydrophobicContact CZ2-CB 4.39Å; W573-N589 HydrophobicContact CZ3-CB 4.11Å
574	Y	70.1	Confident	70	Confident	55 Å²	55	92.9 Å²	92.9	22%	0.216	48%	0.477	C	S	.	.	B	Isolated β-bridge	trans	-131	156.5	-178.7	74.4	-75.4	0	0	0	112.3	E572 P576 I588 Q590 R614	E572-Y574 PolarHBondContact O-N 2.76Å; Y574-P576 HydrophobicContact CE2-CB 4.17Å; Y574-I588 WeakPolarHBondContact CD1-O 3.38Å; Y574-I588 WeakPolarHBondContact CE1-O 3.38Å; Y574-I588 PolarHBondContact N-O 3.45Å; Y574-I588 PolarHBondContact O-N 3.36Å; Y574-Q590 HydrophobicContact CE1-CG 3.92Å; Y574-Q590 PolarHBondContact OH-NE2 3.26Å; Y574-R614 VanDerWaalsContact CB-NH1 3.28Å; Y574-R614 VanDerWaalsContact CD2-NH1 3.32Å
575	N	68.4	Low	68.5	Low	55 Å²	55	96 Å²	96	29%	0.294	49%	0.494	S	S	.	.			trans	-90.8	120.1	171	179.9	-5	0	0	0	108.9	H577	N575-H577 PolarHBondContact ND2-O 2.04Å; N575-H577 PolarHBondContact O-N 2.98Å; N575-H577 PolarHBondContact OD1-N 3.07Å; N575-H577 PolarHBondContact OD1-O 3.13Å
576	P	63.8	Low	67.2	Low	50 Å²	50	99.9 Å²	99.9	33%	0.325	51%	0.513	S	S	.	.	S	Bend	trans	-70.3	-12.1	178.1	30.7	-37.8	0	0	0	113.9	Y574 I588	Y574-P576 HydrophobicContact CE2-CB 4.17Å; P576-I588 HydrophobicContact CG-CD1 4.16Å
577	H	62.6	Low	66.3	Low	121 Å²	121	104.4 Å²	104.4	56%	0.56	54%	0.537	S	S	*	.			trans	-127.6	79.5	-178.7	-62.8	-31.5	0	0	0	111.4	N575 C579	N575-H577 PolarHBondContact ND2-O 2.04Å; N575-H577 PolarHBondContact O-N 2.98Å; N575-H577 PolarHBondContact OD1-N 3.07Å; N575-H577 PolarHBondContact OD1-O 3.13Å; H577-C579 PolarHBondContact O-N 3.25Å; H577-C579 VanDerWaalsContact O-N 3.12Å
578	P	56.4	Low	65.6	Low	107 Å²	107	102.8 Å²	102.8	70%	0.695	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-8.9	-177.6	27.2	-35.1	0	0	0	114.7
579	C	57.6	Low	65.4	Low	118 Å²	118	97.3 Å²	97.3	80%	0.797	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-6.7	-169.7	-55.1	0	0	0	0	115.4	H577	H577-C579 PolarHBondContact O-N 3.25Å; H577-C579 VanDerWaalsContact O-N 3.12Å
580	L	58.1	Low	65.2	Low	122 Å²	122	98.4 Å²	98.4	64%	0.639	51%	0.51	S	S	*	.			trans	-105.8	78.3	-178.4	-79.9	162.7	0	0	0	111.9	G582	L580-G582 PolarHBondContact O-N 2.86Å
581	K	53.2	Low	65.5	Low	216 Å²	216	94.1 Å²	94.1	94%	0.939	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	114.3	168.7	-78	-176.1	174.8	-179.8	0	109.9
582	G	56.3	Low	65.8	Low	77 Å²	77	87.5 Å²	87.5	79%	0.794	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	140	-30	168.8	0	0	0	0	0	116	L580	L580-G582 PolarHBondContact O-N 2.86Å
583	R	55.4	Low	65.9	Low	239 Å²	239	92.2 Å²	92.2	90%	0.902	49%	0.487	S	S	*	.	S	Bend	trans	-152.2	75.3	176.1	-77.7	-170	174.2	178.4	-1.9	112.4
584	C	54.2	Low	66.1	Low	42 Å²	42	90.6 Å²	90.6	28%	0.284	50%	0.496	S	S	.	.			trans	-153.5	74.8	170.5	-86.5	0	0	0	0	112.3	L586	C584-L586 PolarHBondContact O-N 3.37Å
585	N	55.9	Low	66.8	Low	166 Å²	166	91 Å²	91	89%	0.888	50%	0.502	S	S	*	.			trans	-88	27.6	163.6	-73.5	7.2	0	0	0	111.8	L587	N585-L587 PolarHBondContact O-N 3.06Å
586	L	57.6	Low	67.7	Low	114 Å²	114	88.4 Å²	88.4	60%	0.597	49%	0.488	S	S	*	.			trans	-93.3	83	179.4	-164.1	78.5	0	0	0	109.4	C584 I588	C584-L586 PolarHBondContact O-N 3.37Å; L586-I588 HydrophobicContact CD2-CD1 3.92Å; L586-I588 HydrophobicContact CD2-CG1 4.34Å; L586-I588 HydrophobicContact CG-CD1 4.32Å; L586-I588 HydrophobicContact CG-CG1 4.2Å
587	L	65.5	Low	68.8	Low	94 Å²	94	89 Å²	89	49%	0.492	49%	0.486	S	S	.	.			trans	-79.2	124.7	170.6	-73.9	78.8	0	0	0	108.4	W573 N585	W573-L587 HydrophobicContact CB-CB 4.13Å; W573-L587 HydrophobicContact CB-CD2 3.8Å; W573-L587 HydrophobicContact CE3-CB 3.95Å; N585-L587 PolarHBondContact O-N 3.06Å
588	I	68.8	Low	70	Confident	71 Å²	71	90.8 Å²	90.8	36%	0.364	49%	0.487	S	S	.	.	B	Isolated β-bridge	trans	-112.7	136.2	178.8	-66.3	177.2	0	0	0	109	Y574 P576 L586	Y574-I588 WeakPolarHBondContact CD1-O 3.38Å; Y574-I588 WeakPolarHBondContact CE1-O 3.38Å; Y574-I588 PolarHBondContact N-O 3.45Å; Y574-I588 PolarHBondContact O-N 3.36Å; P576-I588 HydrophobicContact CG-CD1 4.16Å; L586-I588 HydrophobicContact CD2-CD1 3.92Å; L586-I588 HydrophobicContact CD2-CG1 4.34Å; L586-I588 HydrophobicContact CG-CD1 4.32Å; L586-I588 HydrophobicContact CG-CG1 4.2Å
589	N	79	Confident	71.5	Confident	16 Å²	16	85.8 Å²	85.8	9%	0.086	46%	0.455	C	S	.	.			trans	-106.2	129.5	174.6	-165.8	-38.9	0	0	0	108.9	A566 W573 Y591	A566-N589 PolarHBondContact O-ND2 3.42Å; W573-N589 HydrophobicContact CD2-CB 3.97Å; W573-N589 HydrophobicContact CE3-CB 3.9Å; W573-N589 HydrophobicContact CH2-CB 4.36Å; W573-N589 HydrophobicContact CZ2-CB 4.39Å; W573-N589 HydrophobicContact CZ3-CB 4.11Å; N589-Y591 VanDerWaalsContact C-N 3.28Å; N589-Y591 PolarHBondContact O-N 3.48Å; N589-Y591 PolarHBondContact OD1-N 2.98Å
590	Q	77.7	Confident	72.9	Confident	47 Å²	47	80.1 Å²	80.1	22%	0.22	42%	0.417	C	S	.	.	S	Bend	trans	-71.4	-23.1	178.5	-80.2	170.7	7.3	0	0	112.7	Y574 S592 N595 I611	Y574-Q590 HydrophobicContact CE1-CG 3.92Å; Y574-Q590 PolarHBondContact OH-NE2 3.26Å; Q590-S592 PolarHBondContact O-N 3.16Å; Q590-S592 VanDerWaalsContact O-N 3.15Å; Q590-N595 WeakPolarHBondContact O-CB 3.19Å; Q590-N595 PolarHBondContact O-ND2 2.91Å; Q590-I611 HydrophobicContact CB-CG2 3.99Å
591	Y	80.3	Confident	74.4	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	40%	0.396	C	S	.	.			trans	-84.1	87.3	177.6	-67.4	-82.9	0	0	0	110.8	A566 R567 N589 F599 I611	A566-Y591 HydrophobicContact CB-CD2 3.52Å; A566-Y591 HydrophobicContact CB-CE2 4.34Å; A566-Y591 HydrophobicContact CB-CG 3.65Å; R567-Y591 PolarHBondContact NE-O 3.49Å; R567-Y591 PolarHBondContact NH2-O 3.19Å; N589-Y591 VanDerWaalsContact C-N 3.28Å; N589-Y591 PolarHBondContact O-N 3.48Å; N589-Y591 PolarHBondContact OD1-N 2.98Å; Y591-F599 HydrophobicContact CE1-CB 4.22Å; Y591-F599 HydrophobicContact CE1-CD2 4.3Å; Y591-F599 HydrophobicContact CE1-CG 4.09Å; Y591-I611 HydrophobicContact CE1-CG2 4.01Å; Y591-I611 HydrophobicContact CE2-CG2 4.02Å
592	S	82.3	Confident	75.9	Confident	45 Å²	45	66 Å²	66	32%	0.315	36%	0.355	S	S	.	.			trans	-79.4	165.7	155.6	75.7	0	0	0	0	110.1	Q590 G594 N595 S596	Q590-S592 PolarHBondContact O-N 3.16Å; Q590-S592 VanDerWaalsContact O-N 3.15Å; S592-G594 VanDerWaalsContact C-N 3.34Å; S592-G594 PolarHBondContact O-N 3.42Å; S592-N595 PolarHBondContact O-N 3.29Å; S592-N595 VanDerWaalsContact OG-CB 3.27Å; S592-N595 WeakPolarHBondContact OG-CB 3.06Å; S592-N595 PolarHBondContact OG-N 3.12Å; S592-N595 VanDerWaalsContact OG-N 3.14Å; S592-N595 PolarHBondContact OG-OD1 3.15Å; S592-S596 WeakPolarHBondContact O-CB 3.13Å; S592-S596 PolarHBondContact O-N 3.08Å; S592-S596 PolarHBondContact O-OG 2.89Å
593	L	81.9	Confident	77.2	Confident	100 Å²	100	62.9 Å²	62.9	52%	0.524	32%	0.323	S	S	.	.	H	α-helix	trans	-56.3	-47.4	179.2	-174.8	66.9	0	0	0	111.8	F563 S596 F597	F563-L593 HydrophobicContact CD1-CD1 4.39Å; F563-L593 HydrophobicContact CD2-CB 4.41Å; F563-L593 HydrophobicContact CD2-CD1 4.38Å; F563-L593 HydrophobicContact CE2-CB 4.17Å; F563-L593 HydrophobicContact CG-CD1 4.28Å; L593-S596 PolarHBondContact O-N 2.6Å; L593-F597 HydrophobicContact CD1-CD2 4.48Å; L593-F597 HydrophobicContact CD1-CE2 3.83Å; L593-F597 HydrophobicContact CG-CD2 4.28Å; L593-F597 HydrophobicContact CG-CE2 3.89Å; L593-F597 WeakPolarHBondContact O-CD2 3.43Å; L593-F597 PolarHBondContact O-N 3.47Å
594	G	83.1	Confident	78.6	Confident	47 Å²	47	55.2 Å²	55.2	49%	0.485	30%	0.296	S	S	.	.	H	α-helix	trans	-63.8	-40.6	175.8	0	0	0	0	0	113.3	S592 S596 F597 W598	S592-G594 VanDerWaalsContact C-N 3.34Å; S592-G594 PolarHBondContact O-N 3.42Å; G594-S596 VanDerWaalsContact C-N 3.32Å; G594-S596 PolarHBondContact O-N 2.85Å; G594-F597 PolarHBondContact O-N 3.5Å; G594-W598 WeakPolarHBondContact O-CB 3.42Å; G594-W598 PolarHBondContact O-N 2.96Å
595	N	84.7	Confident	80.1	Confident	65 Å²	65	58.2 Å²	58.2	35%	0.348	31%	0.307	S	S	.	.	H	α-helix	trans	-66.6	-33.2	177.1	-74.4	4.7	0	0	0	112.5	Q590 S592 F597 W598 F599 I611	Q590-N595 WeakPolarHBondContact O-CB 3.19Å; Q590-N595 PolarHBondContact O-ND2 2.91Å; S592-N595 PolarHBondContact O-N 3.29Å; S592-N595 VanDerWaalsContact OG-CB 3.27Å; S592-N595 WeakPolarHBondContact OG-CB 3.06Å; S592-N595 PolarHBondContact OG-N 3.12Å; S592-N595 VanDerWaalsContact OG-N 3.14Å; S592-N595 PolarHBondContact OG-OD1 3.15Å; N595-F597 VanDerWaalsContact C-N 3.35Å; N595-W598 PolarHBondContact O-N 3.06Å; N595-F599 WeakPolarHBondContact O-CB 3.49Å; N595-F599 PolarHBondContact O-N 2.92Å; N595-I611 HydrophobicContact CB-CD1 3.6Å
596	S	86.5	Confident	81.4	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-71.3	-25.9	174.1	-68.7	0	0	0	0	113.6	S559 F563 S592 L593 G594 P600	S559-S596 WeakPolarHBondContact CA-O 3.05Å; S559-S596 WeakPolarHBondContact CB-O 3.39Å; S559-S596 WeakPolarHBondContact O-CB 3.32Å; S559-S596 PolarHBondContact OG-O 2.77Å; F563-S596 WeakPolarHBondContact CA-OG 3.27Å; F563-S596 WeakPolarHBondContact CB-OG 3.34Å; S592-S596 WeakPolarHBondContact O-CB 3.13Å; S592-S596 PolarHBondContact O-N 3.08Å; S592-S596 PolarHBondContact O-OG 2.89Å; L593-S596 PolarHBondContact O-N 2.6Å; G594-S596 VanDerWaalsContact C-N 3.32Å; G594-S596 PolarHBondContact O-N 2.85Å; S596-P600 WeakPolarHBondContact O-CD 3.32Å; S596-P600 WeakPolarHBondContact O-CG 3.08Å
597	F	88.5	Confident	82.5	Confident	62 Å²	62	59.2 Å²	59.2	27%	0.272	30%	0.303	S	S	.	.	H	α-helix	trans	-78.1	-39.2	167.2	-76.2	-63.5	0	0	0	111.8	Y555 L556 S559 L593 G594 N595 P600 V601	Y555-F597 HydrophobicContact CE1-CD1 4.3Å; Y555-F597 WeakPolarHBondContact CE2-O 2.93Å; Y555-F597 AromaticContact CZ-CD1 3.96Å; Y555-F597 PolarHBondContact OH-O 2.85Å; L556-F597 HydrophobicContact CD2-CD1 4.37Å; L556-F597 HydrophobicContact CD2-CE1 3.67Å; L556-F597 HydrophobicContact CD2-CZ 4.48Å; S559-F597 WeakPolarHBondContact OG-CD1 3.24Å; L593-F597 HydrophobicContact CD1-CD2 4.48Å; L593-F597 HydrophobicContact CD1-CE2 3.83Å; L593-F597 HydrophobicContact CG-CD2 4.28Å; L593-F597 HydrophobicContact CG-CE2 3.89Å; L593-F597 WeakPolarHBondContact O-CD2 3.43Å; L593-F597 PolarHBondContact O-N 3.47Å; G594-F597 PolarHBondContact O-N 3.5Å; N595-F597 VanDerWaalsContact C-N 3.35Å; F597-P600 WeakPolarHBondContact O-CD 3.43Å; F597-V601 WeakPolarHBondContact O-CG2 3.29Å
598	W	87.5	Confident	83.1	Confident	158 Å²	158	56.9 Å²	56.9	60%	0.598	30%	0.303	S	S	*	.	H	α-helix	trans	-67.5	-37.1	-179.6	-169.7	-113.3	0	0	0	113.7	G594 N595 V601 G602	G594-W598 WeakPolarHBondContact O-CB 3.42Å; G594-W598 PolarHBondContact O-N 2.96Å; N595-W598 PolarHBondContact O-N 3.06Å; W598-V601 HydrophobicContact CZ3-CG1 4.48Å; W598-V601 PolarHBondContact O-N 3.08Å; W598-G602 PolarHBondContact O-N 3.17Å
599	F	87.1	Confident	83.7	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-60.3	-48.6	-177.6	173.6	-83.1	0	0	0	113.3	L562 Y591 N595 V601 G602 G603 S609 I611 P613 S622 W626	L562-F599 HydrophobicContact CD1-CD1 3.54Å; L562-F599 HydrophobicContact CD1-CE1 3.9Å; Y591-F599 HydrophobicContact CE1-CB 4.22Å; Y591-F599 HydrophobicContact CE1-CD2 4.3Å; Y591-F599 HydrophobicContact CE1-CG 4.09Å; N595-F599 WeakPolarHBondContact O-CB 3.49Å; N595-F599 PolarHBondContact O-N 2.92Å; F599-V601 VanDerWaalsContact C-N 3.34Å; F599-V601 PolarHBondContact O-N 2.98Å; F599-G602 PolarHBondContact O-N 3.15Å; F599-G603 PolarHBondContact O-N 3.23Å; F599-S609 WeakPolarHBondContact CD2-OG 3.39Å; F599-S609 WeakPolarHBondContact CE2-OG 3.45Å; F599-I611 HydrophobicContact CD2-CB 4.2Å; F599-I611 HydrophobicContact CD2-CG2 4.44Å; F599-I611 WeakPolarHBondContact CD2-O 3.49Å; F599-I611 VanDerWaalsContact CE2-O 3.28Å; F599-I611 WeakPolarHBondContact CE2-O 3.48Å; F599-P613 HydrophobicContact CZ-CG 4.27Å; F599-S622 VanDerWaalsContact CE1-OG 3.29Å; F599-S622 WeakPolarHBondContact CE1-OG 3.32Å; F599-S622 VanDerWaalsContact CZ-OG 3.31Å; F599-S622 WeakPolarHBondContact CZ-OG 3.45Å; F599-W626 HydrophobicContact CZ-CZ2 4.02Å
600	P	88.3	Confident	83.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61	-35.2	173.9	-29.7	39.5	0	0	0	114.5	Y555 V558 L562 S596 F597 G602 G603 F604 W625	Y555-P600 HydrophobicContact CD2-CB 3.88Å; Y555-P600 HydrophobicContact CE2-CB 4.01Å; V558-P600 HydrophobicContact CG1-CG 4.25Å; L562-P600 HydrophobicContact CD1-CG 3.87Å; S596-P600 WeakPolarHBondContact O-CD 3.32Å; S596-P600 WeakPolarHBondContact O-CG 3.08Å; F597-P600 WeakPolarHBondContact O-CD 3.43Å; P600-G602 PolarHBondContact O-N 3.17Å; P600-G603 PolarHBondContact O-N 2.93Å; P600-G603 VanDerWaalsContact O-N 3.16Å; P600-F604 PolarHBondContact O-N 3.37Å; P600-W625 HydrophobicContact CB-CZ2 3.88Å; P600-W625 PolarHBondContact O-NE1 2.81Å
601	V	88.6	Confident	83.6	Confident	33 Å²	33	59.5 Å²	59.5	20%	0.2	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-44.3	176.1	176.3	0	0	0	0	111	Y555 F597 W598 F599 G603 F604 M605	Y555-V601 HydrophobicContact CE2-CG2 3.64Å; F597-V601 WeakPolarHBondContact O-CG2 3.29Å; W598-V601 HydrophobicContact CZ3-CG1 4.48Å; W598-V601 PolarHBondContact O-N 3.08Å; F599-V601 VanDerWaalsContact C-N 3.34Å; F599-V601 PolarHBondContact O-N 2.98Å; V601-G603 PolarHBondContact O-N 3.5Å; V601-F604 PolarHBondContact O-N 3.42Å; V601-M605 HydrophobicContact CG1-CG 4.1Å; V601-M605 HydrophobicContact CG1-SD 3.76Å; V601-M605 PolarHBondContact O-N 2.98Å
602	G	85.3	Confident	83.6	Confident	8 Å²	8	62.5 Å²	62.5	8%	0.082	35%	0.351	C	S	.	.	H	α-helix	trans	-60.4	-30.9	176	0	0	0	0	0	114	W598 F599 P600 Q606 Q607 G608	W598-G602 PolarHBondContact O-N 3.17Å; F599-G602 PolarHBondContact O-N 3.15Å; P600-G602 PolarHBondContact O-N 3.17Å; G602-Q606 PolarHBondContact O-N 3.29Å; G602-Q607 PolarHBondContact O-N 3.39Å; G602-G608 VanDerWaalsContact CA-O 3.3Å; G602-G608 WeakPolarHBondContact CA-O 3.37Å; G602-G608 PolarHBondContact O-N 3.18Å; G602-G608 VanDerWaalsContact O-N 3.11Å
603	G	83.3	Confident	83.6	Confident	11 Å²	11	60.9 Å²	60.9	11%	0.113	34%	0.34	C	S	.	.	H	α-helix	trans	-78.5	-21.9	172.4	0	0	0	0	0	114.6	F599 P600 V601 T629	F599-G603 PolarHBondContact O-N 3.23Å; P600-G603 PolarHBondContact O-N 2.93Å; P600-G603 VanDerWaalsContact O-N 3.16Å; V601-G603 PolarHBondContact O-N 3.5Å; G603-T629 WeakPolarHBondContact O-CB 3.21Å; G603-T629 PolarHBondContact O-OG1 3.33Å
604	F	85.6	Confident	83.5	Confident	78 Å²	78	61.4 Å²	61.4	34%	0.342	34%	0.335	S	S	.	.	H	α-helix	trans	-86.2	-35.7	175	-169.2	-105.5	0	0	0	112.1	M551 P600 V601 Q606 T629 I632 I633	M551-F604 HydrophobicContact CE-CD2 4.2Å; M551-F604 HydrophobicContact CE-CE2 3.53Å; M551-F604 HydrophobicContact CE-CZ 4.29Å; P600-F604 PolarHBondContact O-N 3.37Å; V601-F604 PolarHBondContact O-N 3.42Å; F604-Q606 VanDerWaalsContact C-N 3.31Å; F604-Q606 PolarHBondContact O-N 3.15Å; F604-T629 HydrophobicContact CB-CG2 4.32Å; F604-T629 HydrophobicContact CD2-CG2 3.94Å; F604-I632 HydrophobicContact CE2-CG2 4.37Å; F604-I633 WeakPolarHBondContact O-CD1 3.38Å
605	M	85.6	Confident	83.6	Confident	106 Å²	106	59.3 Å²	59.3	52%	0.522	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	1.7	177.1	-61.6	-173.1	75.7	0	0	114	V601 Q607	V601-M605 HydrophobicContact CG1-CG 4.1Å; V601-M605 HydrophobicContact CG1-SD 3.76Å; V601-M605 PolarHBondContact O-N 2.98Å; M605-Q607 PolarHBondContact O-N 3.39Å
606	Q	82.3	Confident	83.6	Confident	140 Å²	140	62.8 Å²	62.8	65%	0.654	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	10.7	-177.7	-55.3	-174.9	-6.7	0	0	116	G602 F604 I633	G602-Q606 PolarHBondContact O-N 3.29Å; F604-Q606 VanDerWaalsContact C-N 3.31Å; F604-Q606 PolarHBondContact O-N 3.15Å; Q606-I633 HydrophobicContact CG-CD1 3.89Å
607	Q	81.8	Confident	83.6	Confident	160 Å²	160	64.8 Å²	64.8	75%	0.748	35%	0.345	S	S	*	.	S	Bend	trans	-87.2	-9.3	-179.8	-68.6	174.6	11.2	0	0	113.2	G602 M605	G602-Q607 PolarHBondContact O-N 3.39Å; M605-Q607 PolarHBondContact O-N 3.39Å
608	G	77.5	Confident	83.5	Confident	46 Å²	46	61.9 Å²	61.9	47%	0.474	33%	0.332	S	S	.	.			trans	75.7	-173.1	-173.3	0	0	0	0	0	112.2	G602	G602-G608 VanDerWaalsContact CA-O 3.3Å; G602-G608 WeakPolarHBondContact CA-O 3.37Å; G602-G608 PolarHBondContact O-N 3.18Å; G602-G608 VanDerWaalsContact O-N 3.11Å
609	S	80.2	Confident	83.6	Confident	42 Å²	42	61.1 Å²	61.1	29%	0.294	33%	0.329	S	S	.	.			trans	-142.5	157.2	174.9	72.6	0	0	0	0	110.9	F599 I611	F599-S609 WeakPolarHBondContact CD2-OG 3.39Å; F599-S609 WeakPolarHBondContact CE2-OG 3.45Å; S609-I611 PolarHBondContact O-N 3.02Å; S609-I611 PolarHBondContact OG-O 2.94Å
610	T	76.6	Confident	83.7	Confident	134 Å²	134	64.6 Å²	64.6	82%	0.822	35%	0.353	S	S	*	.	S	Bend	trans	-76	-4.6	178.1	51	0	0	0	0	113.4
611	I	79.4	Confident	83.7	Confident	13 Å²	13	66.4 Å²	66.4	7%	0.067	36%	0.364	C	S	.	.			trans	-104.9	120.4	-175.8	-56.7	172.7	0	0	0	107.7	Q590 Y591 N595 F599 S609	Q590-I611 HydrophobicContact CB-CG2 3.99Å; Y591-I611 HydrophobicContact CE1-CG2 4.01Å; Y591-I611 HydrophobicContact CE2-CG2 4.02Å; N595-I611 HydrophobicContact CB-CD1 3.6Å; F599-I611 HydrophobicContact CD2-CB 4.2Å; F599-I611 HydrophobicContact CD2-CG2 4.44Å; F599-I611 WeakPolarHBondContact CD2-O 3.49Å; F599-I611 VanDerWaalsContact CE2-O 3.28Å; F599-I611 WeakPolarHBondContact CE2-O 3.48Å; S609-I611 PolarHBondContact O-N 3.02Å; S609-I611 PolarHBondContact OG-O 2.94Å
612	A	79	Confident	83.7	Confident	62 Å²	62	64.8 Å²	64.8	51%	0.512	35%	0.354	S	S	.	.			trans	-111.6	116.3	-176.4	0	0	0	0	0	110.5	R614	A612-R614 PolarHBondContact O-N 3.29Å
613	P	83.8	Confident	83.8	Confident	11 Å²	11	66 Å²	66	7%	0.071	37%	0.366	C	S	.	.			trans	-62.2	133.2	177.2	25.2	-33.6	0	0	0	110.4	F599 T618 R619	F599-P613 HydrophobicContact CZ-CG 4.27Å; P613-T618 WeakPolarHBondContact CB-OG1 3.49Å; P613-R619 HydrophobicContact CB-CG 3.95Å; P613-R619 HydrophobicContact CG-CG 3.98Å; P613-R619 PolarHBondContact O-NE 3.34Å; P613-R619 PolarHBondContact O-NH2 2.78Å
614	R	78.8	Confident	84.2	Confident	112 Å²	112	70.6 Å²	70.6	42%	0.423	39%	0.392	S	S	.	.			trans	-103.8	-40.8	-176.6	-61.4	-174.4	177	-167.5	2.8	112.2	E572 Y574 A612	E572-R614 PolarHBondContact OE1-N 2.76Å; E572-R614 PolarHBondContact OE2-N 2.82Å; Y574-R614 VanDerWaalsContact CB-NH1 3.28Å; Y574-R614 VanDerWaalsContact CD2-NH1 3.32Å; A612-R614 PolarHBondContact O-N 3.29Å
615	A	85.2	Confident	84.5	Confident	3 Å²	3	67.2 Å²	67.2	3%	0.025	38%	0.377	C	S	.	.	S	Bend	trans	-72.5	154.2	178.9	0	0	0	0	0	111.6	T569 E572 S617 T618 R619	T569-A615 HydrophobicContact CG2-CB 3.62Å; E572-A615 HydrophobicContact CG-CB 3.88Å; E572-A615 PolarHBondContact OE1-N 3.07Å; A615-S617 VanDerWaalsContact C-N 3.32Å; A615-S617 PolarHBondContact O-N 3.28Å; A615-T618 PolarHBondContact O-OG1 3.09Å; A615-R619 WeakPolarHBondContact O-CB 3.41Å; A615-R619 WeakPolarHBondContact O-CG 3.39Å; A615-R619 PolarHBondContact O-N 2.73Å; A615-R619 VanDerWaalsContact O-N 3.13Å
616	L	84.8	Confident	84.7	Confident	137 Å²	137	68.2 Å²	68.2	72%	0.717	38%	0.375	S	S	*	.	H	α-helix	trans	-64.9	-38.4	176.5	-173.9	62.5	0	0	0	111.6	R619 C620	L616-R619 PolarHBondContact O-N 3.28Å; L616-C620 PolarHBondContact O-N 3.13Å; L616-C620 PolarHBondContact O-SG 2.72Å
617	S	87.1	Confident	85.1	Confident	43 Å²	43	64 Å²	64	30%	0.301	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-50.7	179.9	50	0	0	0	0	113	T569 A615 C620 V621	T569-S617 PolarHBondContact OG1-OG 3.38Å; A615-S617 VanDerWaalsContact C-N 3.32Å; A615-S617 PolarHBondContact O-N 3.28Å; S617-C620 PolarHBondContact O-N 2.83Å; S617-V621 WeakPolarHBondContact O-CG2 3.28Å; S617-V621 PolarHBondContact O-N 3.35Å; S617-V621 VanDerWaalsContact O-N 3.16Å
618	T	85.8	Confident	85.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-66.2	-36	176.6	51.4	0	0	0	0	112.1	V565 A566 E572 P613 A615 V621 S622	V565-T618 HydrophobicContact CG1-CG2 3.96Å; A566-T618 HydrophobicContact CB-CG2 3.99Å; E572-T618 HydrophobicContact CG-CG2 3.83Å; E572-T618 WeakPolarHBondContact OE1-CB 3.37Å; E572-T618 PolarHBondContact OE1-OG1 2.72Å; P613-T618 WeakPolarHBondContact CB-OG1 3.49Å; A615-T618 PolarHBondContact O-OG1 3.09Å; T618-V621 PolarHBondContact O-N 3.32Å; T618-S622 WeakPolarHBondContact O-CB 3.04Å; T618-S622 PolarHBondContact O-N 2.83Å; T618-S622 PolarHBondContact O-OG 2.8Å
619	R	88.9	Confident	86.1	Confident	143 Å²	143	58 Å²	58	54%	0.54	32%	0.324	S	S	.	.	H	α-helix	trans	-63.1	-42.7	172.9	-76.7	174.4	177.9	-167.4	-1.2	112.5	P613 A615 L616 S622 G623	P613-R619 HydrophobicContact CB-CG 3.95Å; P613-R619 HydrophobicContact CG-CG 3.98Å; P613-R619 PolarHBondContact O-NE 3.34Å; P613-R619 PolarHBondContact O-NH2 2.78Å; A615-R619 WeakPolarHBondContact O-CB 3.41Å; A615-R619 WeakPolarHBondContact O-CG 3.39Å; A615-R619 PolarHBondContact O-N 2.73Å; A615-R619 VanDerWaalsContact O-N 3.13Å; L616-R619 PolarHBondContact O-N 3.28Å; R619-S622 PolarHBondContact O-N 3.34Å; R619-G623 PolarHBondContact O-N 2.9Å
620	C	89.3	Confident	86.5	Confident	75 Å²	75	61.1 Å²	61.1	51%	0.507	34%	0.336	S	S	.	.	H	α-helix	trans	-62.5	-47.6	176.2	-69.9	0	0	0	0	111.7	L616 S617 S622 G623 V624	L616-C620 PolarHBondContact O-N 3.13Å; L616-C620 PolarHBondContact O-SG 2.72Å; S617-C620 PolarHBondContact O-N 2.83Å; C620-S622 VanDerWaalsContact C-N 3.32Å; C620-S622 PolarHBondContact O-N 3.38Å; C620-G623 PolarHBondContact O-N 3.28Å; C620-V624 WeakPolarHBondContact O-CG2 3.32Å; C620-V624 PolarHBondContact O-N 2.93Å
621	V	89.6	Confident	87.3	Confident	37 Å²	37	60 Å²	60	22%	0.224	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-43.2	175.9	177	0	0	0	0	111.2	V558 V561 L562 S617 T618 V624 W625	V558-V621 HydrophobicContact CG1-CG1 4.37Å; V561-V621 HydrophobicContact CG1-CG1 4.12Å; V561-V621 HydrophobicContact CG1-CG2 4.12Å; L562-V621 HydrophobicContact CD2-CB 3.92Å; L562-V621 HydrophobicContact CD2-CG1 3.62Å; L562-V621 HydrophobicContact CG-CG1 3.83Å; S617-V621 WeakPolarHBondContact O-CG2 3.28Å; S617-V621 PolarHBondContact O-N 3.35Å; S617-V621 VanDerWaalsContact O-N 3.16Å; T618-V621 PolarHBondContact O-N 3.32Å; V621-V624 PolarHBondContact O-N 2.82Å; V621-W625 PolarHBondContact O-N 2.95Å
622	S	87.4	Confident	87.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-40.2	177.8	-55.7	0	0	0	0	112.8	F599 T618 R619 C620 W625 W626	F599-S622 VanDerWaalsContact CE1-OG 3.29Å; F599-S622 WeakPolarHBondContact CE1-OG 3.32Å; F599-S622 VanDerWaalsContact CZ-OG 3.31Å; F599-S622 WeakPolarHBondContact CZ-OG 3.45Å; T618-S622 WeakPolarHBondContact O-CB 3.04Å; T618-S622 PolarHBondContact O-N 2.83Å; T618-S622 PolarHBondContact O-OG 2.8Å; R619-S622 PolarHBondContact O-N 3.34Å; C620-S622 VanDerWaalsContact C-N 3.32Å; C620-S622 PolarHBondContact O-N 3.38Å; S622-W625 PolarHBondContact O-N 3.22Å; S622-W626 VanDerWaalsContact O-CG 3.23Å; S622-W626 PolarHBondContact O-N 2.76Å
623	G	88.8	Confident	88.3	Confident	33 Å²	33	59.5 Å²	59.5	34%	0.34	31%	0.312	S	S	.	.	H	α-helix	trans	-66.9	-40.4	178	0	0	0	0	0	112.8	R619 C620 W626 A627	R619-G623 PolarHBondContact O-N 2.9Å; C620-G623 PolarHBondContact O-N 3.28Å; G623-W626 PolarHBondContact O-N 2.66Å; G623-A627 PolarHBondContact O-N 3.19Å
624	V	91.6	Very high	88.6	Confident	107 Å²	107	62 Å²	62	65%	0.648	33%	0.33	S	S	*	.	H	α-helix	trans	-63.7	-42.2	172.4	174	0	0	0	0	110.8	C620 V621 A627 F628	C620-V624 WeakPolarHBondContact O-CG2 3.32Å; C620-V624 PolarHBondContact O-N 2.93Å; V621-V624 PolarHBondContact O-N 2.82Å; V624-A627 PolarHBondContact O-N 2.98Å; V624-F628 WeakPolarHBondContact O-CB 3.11Å; V624-F628 PolarHBondContact O-N 3.35Å
625	W	91.1	Very high	89.2	Confident	7 Å²	7	58.9 Å²	58.9	3%	0.027	33%	0.326	C	S	.	.	H	α-helix	trans	-60.8	-45.8	174.5	179.6	-111.8	0	0	0	112.3	A554 V558 P600 V621 S622 A627 F628 T629	A554-W625 HydrophobicContact CB-CZ3 4.49Å; V558-W625 HydrophobicContact CB-CD2 4.45Å; V558-W625 HydrophobicContact CB-CE3 4.04Å; V558-W625 HydrophobicContact CB-CZ3 4.35Å; V558-W625 HydrophobicContact CG1-CB 4.11Å; V558-W625 HydrophobicContact CG1-CD2 3.98Å; V558-W625 HydrophobicContact CG1-CE3 4.02Å; V558-W625 HydrophobicContact CG1-CG 4.04Å; V558-W625 HydrophobicContact CG2-CD2 4.47Å; V558-W625 HydrophobicContact CG2-CE3 3.68Å; V558-W625 HydrophobicContact CG2-CZ3 4.05Å; P600-W625 HydrophobicContact CB-CZ2 3.88Å; P600-W625 PolarHBondContact O-NE1 2.81Å; V621-W625 PolarHBondContact O-N 2.95Å; S622-W625 PolarHBondContact O-N 3.22Å; W625-A627 PolarHBondContact O-N 3.45Å; W625-F628 AromaticContact CE3-CD1 3.79Å; W625-F628 HydrophobicContact CE3-CD1 3.79Å; W625-F628 HydrophobicContact CE3-CE1 4.39Å; W625-F628 HydrophobicContact CH2-CD1 4.35Å; W625-F628 HydrophobicContact CH2-CE1 4.31Å; W625-F628 AromaticContact CZ3-CD1 3.6Å; W625-F628 HydrophobicContact CZ3-CD1 3.6Å; W625-F628 AromaticContact CZ3-CE1 3.74Å; W625-F628 HydrophobicContact CZ3-CE1 3.74Å; W625-F628 WeakPolarHBondContact O-CB 3.37Å; W625-F628 PolarHBondContact O-N 2.85Å; W625-T629 HydrophobicContact CD2-CG2 3.89Å; W625-T629 VanDerWaalsContact CE2-CG2 3.43Å; W625-T629 HydrophobicContact CE3-CG2 4.42Å; W625-T629 HydrophobicContact CG-CG2 4.37Å; W625-T629 HydrophobicContact CH2-CG2 4.24Å; W625-T629 HydrophobicContact CZ2-CG2 3.63Å; W625-T629 WeakPolarHBondContact O-CG2 3.45Å; W625-T629 PolarHBondContact O-N 3.16Å; W625-T629 PolarHBondContact O-OG1 3.43Å
626	W	89.6	Confident	89.4	Confident	127 Å²	127	61.1 Å²	61.1	48%	0.481	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-37.2	177.9	-64.9	-25.3	0	0	0	113.2	F599 S622 G623 T629 L630	F599-W626 HydrophobicContact CZ-CZ2 4.02Å; S622-W626 VanDerWaalsContact O-CG 3.23Å; S622-W626 PolarHBondContact O-N 2.76Å; G623-W626 PolarHBondContact O-N 2.66Å; W626-T629 PolarHBondContact O-OG1 2.85Å; W626-L630 VanDerWaalsContact O-CB 3.27Å; W626-L630 WeakPolarHBondContact O-CB 3.32Å; W626-L630 PolarHBondContact O-N 3.1Å
627	A	90.6	Very high	89.6	Confident	53 Å²	53	58.3 Å²	58.3	44%	0.438	32%	0.323	S	S	.	.	H	α-helix	trans	-63.8	-42.4	172.8	0	0	0	0	0	111.4	G623 V624 W625 I631	G623-A627 PolarHBondContact O-N 3.19Å; V624-A627 PolarHBondContact O-N 2.98Å; W625-A627 PolarHBondContact O-N 3.45Å; A627-I631 WeakPolarHBondContact O-CD1 3.4Å; A627-I631 VanDerWaalsContact O-CG1 3.3Å; A627-I631 WeakPolarHBondContact O-CG1 3.28Å; A627-I631 PolarHBondContact O-N 3.45Å; A627-I631 VanDerWaalsContact O-N 3.16Å
628	F	91.1	Very high	89.6	Confident	73 Å²	73	59.1 Å²	59.1	32%	0.32	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-48.9	176.2	175.9	-102.7	0	0	0	112.5	M551 A554 V624 W625 L630 I631 I632	M551-F628 HydrophobicContact CE-CE1 3.69Å; M551-F628 HydrophobicContact CE-CZ 4.14Å; M551-F628 HydrophobicContact SD-CE1 3.69Å; M551-F628 HydrophobicContact SD-CZ 3.48Å; M551-F628 WeakPolarHBondContact SD-CZ 3.39Å; A554-F628 HydrophobicContact CB-CE1 4.3Å; A554-F628 HydrophobicContact CB-CZ 4.33Å; V624-F628 WeakPolarHBondContact O-CB 3.11Å; V624-F628 PolarHBondContact O-N 3.35Å; W625-F628 AromaticContact CE3-CD1 3.79Å; W625-F628 HydrophobicContact CE3-CD1 3.79Å; W625-F628 HydrophobicContact CE3-CE1 4.39Å; W625-F628 HydrophobicContact CH2-CD1 4.35Å; W625-F628 HydrophobicContact CH2-CE1 4.31Å; W625-F628 AromaticContact CZ3-CD1 3.6Å; W625-F628 HydrophobicContact CZ3-CD1 3.6Å; W625-F628 AromaticContact CZ3-CE1 3.74Å; W625-F628 HydrophobicContact CZ3-CE1 3.74Å; W625-F628 WeakPolarHBondContact O-CB 3.37Å; W625-F628 PolarHBondContact O-N 2.85Å; F628-L630 VanDerWaalsContact C-N 3.33Å; F628-L630 PolarHBondContact O-N 3.31Å; F628-I631 PolarHBondContact O-N 3.15Å; F628-I632 HydrophobicContact CD1-CG1 4.49Å; F628-I632 HydrophobicContact CD2-CG1 4.34Å; F628-I632 HydrophobicContact CE1-CG1 4.16Å; F628-I632 HydrophobicContact CE2-CD1 4.17Å; F628-I632 HydrophobicContact CE2-CG1 4Å; F628-I632 HydrophobicContact CZ-CD1 4.21Å; F628-I632 HydrophobicContact CZ-CG1 3.91Å; F628-I632 WeakPolarHBondContact O-CG1 2.99Å; F628-I632 PolarHBondContact O-N 3.33Å
629	T	89.9	Confident	89.6	Confident	6 Å²	6	62.4 Å²	62.4	4%	0.037	35%	0.349	C	S	.	.	H	α-helix	trans	-65.4	-36.6	179.6	61.7	0	0	0	0	112.2	G603 F604 W625 W626 I632 I633	G603-T629 WeakPolarHBondContact O-CB 3.21Å; G603-T629 PolarHBondContact O-OG1 3.33Å; F604-T629 HydrophobicContact CB-CG2 4.32Å; F604-T629 HydrophobicContact CD2-CG2 3.94Å; W625-T629 HydrophobicContact CD2-CG2 3.89Å; W625-T629 VanDerWaalsContact CE2-CG2 3.43Å; W625-T629 HydrophobicContact CE3-CG2 4.42Å; W625-T629 HydrophobicContact CG-CG2 4.37Å; W625-T629 HydrophobicContact CH2-CG2 4.24Å; W625-T629 HydrophobicContact CZ2-CG2 3.63Å; W625-T629 WeakPolarHBondContact O-CG2 3.45Å; W625-T629 PolarHBondContact O-N 3.16Å; W625-T629 PolarHBondContact O-OG1 3.43Å; W626-T629 PolarHBondContact O-OG1 2.85Å; T629-I632 PolarHBondContact O-N 2.96Å; T629-I633 WeakPolarHBondContact O-CB 3.26Å; T629-I633 WeakPolarHBondContact O-CD1 3.29Å; T629-I633 WeakPolarHBondContact O-CG1 3.39Å; T629-I633 PolarHBondContact O-N 3.26Å
630	L	89.3	Confident	89.3	Confident	107 Å²	107	57.7 Å²	57.7	56%	0.56	33%	0.334	S	S	*	.	H	α-helix	trans	-58.2	-51.2	173.5	-172.7	160	0	0	0	111.1	W626 F628 I632 I633 S634	W626-L630 VanDerWaalsContact O-CB 3.27Å; W626-L630 WeakPolarHBondContact O-CB 3.32Å; W626-L630 PolarHBondContact O-N 3.1Å; F628-L630 VanDerWaalsContact C-N 3.33Å; F628-L630 PolarHBondContact O-N 3.31Å; L630-I632 PolarHBondContact O-N 3.03Å; L630-I633 PolarHBondContact O-N 3.23Å; L630-S634 WeakPolarHBondContact O-CB 3.39Å; L630-S634 PolarHBondContact O-N 2.98Å; L630-S634 PolarHBondContact O-OG 3.17Å
631	I	91.7	Very high	88.6	Confident	111 Å²	111	56.7 Å²	56.7	57%	0.569	33%	0.331	S	S	*	.	H	α-helix	trans	-59	-46.7	179.2	-68.6	165	0	0	0	111.2	A627 F628 S634 S635	A627-I631 WeakPolarHBondContact O-CD1 3.4Å; A627-I631 VanDerWaalsContact O-CG1 3.3Å; A627-I631 WeakPolarHBondContact O-CG1 3.28Å; A627-I631 PolarHBondContact O-N 3.45Å; A627-I631 VanDerWaalsContact O-N 3.16Å; F628-I631 PolarHBondContact O-N 3.15Å; I631-S634 PolarHBondContact O-N 3.13Å; I631-S635 WeakPolarHBondContact O-CB 3.38Å; I631-S635 PolarHBondContact O-N 2.82Å
632	I	91.1	Very high	88	Confident	29 Å²	29	57.4 Å²	57.4	15%	0.149	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-45.6	-178.4	-66.8	-67.9	0	0	0	111.5	F543 M551 F604 F628 T629 L630 S635 Y636	F543-I632 HydrophobicContact CE2-CG2 3.94Å; F543-I632 HydrophobicContact CZ-CG2 4.23Å; M551-I632 HydrophobicContact CE-CB 4.39Å; M551-I632 HydrophobicContact CE-CG1 4.2Å; M551-I632 HydrophobicContact CE-CG2 3.84Å; M551-I632 HydrophobicContact SD-CB 4.35Å; M551-I632 HydrophobicContact SD-CD1 3.74Å; M551-I632 HydrophobicContact SD-CG1 3.71Å; M551-I632 HydrophobicContact SD-CG2 3.83Å; F604-I632 HydrophobicContact CE2-CG2 4.37Å; F628-I632 HydrophobicContact CD1-CG1 4.49Å; F628-I632 HydrophobicContact CD2-CG1 4.34Å; F628-I632 HydrophobicContact CE1-CG1 4.16Å; F628-I632 HydrophobicContact CE2-CD1 4.17Å; F628-I632 HydrophobicContact CE2-CG1 4Å; F628-I632 HydrophobicContact CZ-CD1 4.21Å; F628-I632 HydrophobicContact CZ-CG1 3.91Å; F628-I632 WeakPolarHBondContact O-CG1 2.99Å; F628-I632 PolarHBondContact O-N 3.33Å; T629-I632 PolarHBondContact O-N 2.96Å; L630-I632 PolarHBondContact O-N 3.03Å; I632-S635 PolarHBondContact O-N 3.38Å; I632-Y636 WeakPolarHBondContact O-CB 3.41Å; I632-Y636 PolarHBondContact O-N 3.18Å
633	I	89.7	Confident	87.4	Confident	35 Å²	35	62 Å²	62	18%	0.179	36%	0.362	C	S	.	.	H	α-helix	trans	-67.8	-41.2	-179.4	-61.4	160.4	0	0	0	110.4	F604 Q606 T629 L630 S635 Y636 T637	F604-I633 WeakPolarHBondContact O-CD1 3.38Å; Q606-I633 HydrophobicContact CG-CD1 3.89Å; T629-I633 WeakPolarHBondContact O-CB 3.26Å; T629-I633 WeakPolarHBondContact O-CD1 3.29Å; T629-I633 WeakPolarHBondContact O-CG1 3.39Å; T629-I633 PolarHBondContact O-N 3.26Å; L630-I633 PolarHBondContact O-N 3.23Å; I633-S635 PolarHBondContact O-N 3.4Å; I633-Y636 PolarHBondContact O-N 3.21Å; I633-T637 HydrophobicContact CG2-CG2 4.43Å; I633-T637 WeakPolarHBondContact O-CG2 3.48Å; I633-T637 PolarHBondContact O-N 2.98Å; I633-T637 PolarHBondContact O-OG1 3.33Å
634	S	89.1	Confident	86.6	Confident	63 Å²	63	63.4 Å²	63.4	44%	0.441	36%	0.361	S	S	.	.	H	α-helix	trans	-58.6	-46.2	173.6	-63.4	0	0	0	0	111.7	L630 I631 T637 A638	L630-S634 WeakPolarHBondContact O-CB 3.39Å; L630-S634 PolarHBondContact O-N 2.98Å; L630-S634 PolarHBondContact O-OG 3.17Å; I631-S634 PolarHBondContact O-N 3.13Å; S634-T637 PolarHBondContact O-N 2.9Å; S634-T637 PolarHBondContact O-OG1 3.04Å; S634-A638 WeakPolarHBondContact O-CB 3.39Å; S634-A638 PolarHBondContact O-N 3.05Å
635	S	91.1	Very high	85.4	Confident	48 Å²	48	63.3 Å²	63.3	34%	0.336	36%	0.361	S	S	.	.	H	α-helix	trans	-62.8	-42.4	176.6	-179	0	0	0	0	112.8	I631 I632 I633 A638 N639	I631-S635 WeakPolarHBondContact O-CB 3.38Å; I631-S635 PolarHBondContact O-N 2.82Å; I632-S635 PolarHBondContact O-N 3.38Å; I633-S635 PolarHBondContact O-N 3.4Å; S635-A638 PolarHBondContact O-N 2.99Å; S635-N639 WeakPolarHBondContact O-CB 3.38Å; S635-N639 PolarHBondContact O-N 3.22Å
636	Y	90.4	Very high	83.8	Confident	49 Å²	49	66.8 Å²	66.8	19%	0.192	38%	0.383	C	S	.	.	H	α-helix	trans	-59.9	-49.1	175.8	176	-100.7	0	0	0	111.6	F539 P542 F543 W548 I632 I633 A638 N639 L640	F539-Y636 WeakPolarHBondContact O-CE2 3.36Å; F539-Y636 PolarHBondContact O-OH 3.39Å; P542-Y636 HydrophobicContact CB-CD2 4.04Å; P542-Y636 HydrophobicContact CB-CE2 4.02Å; P542-Y636 HydrophobicContact CG-CE2 4.01Å; F543-Y636 HydrophobicContact CD2-CD2 4.07Å; F543-Y636 HydrophobicContact CE2-CD2 4.02Å; F543-Y636 HydrophobicContact CE2-CG 4.3Å; W548-Y636 HydrophobicContact CH2-CE2 4.49Å; W548-Y636 HydrophobicContact CZ2-CE2 4.24Å; I632-Y636 WeakPolarHBondContact O-CB 3.41Å; I632-Y636 PolarHBondContact O-N 3.18Å; I633-Y636 PolarHBondContact O-N 3.21Å; Y636-A638 VanDerWaalsContact C-N 3.33Å; Y636-A638 PolarHBondContact O-N 2.94Å; Y636-N639 PolarHBondContact O-N 3.36Å; Y636-L640 HydrophobicContact CE1-CD2 3.95Å; Y636-L640 VanDerWaalsContact O-CB 3.26Å; Y636-L640 WeakPolarHBondContact O-CB 3.36Å; Y636-L640 PolarHBondContact O-N 2.79Å
637	T	88.1	Confident	82.3	Confident	79 Å²	79	68.1 Å²	68.1	49%	0.485	39%	0.394	S	S	.	.	H	α-helix	trans	-64.1	-36.1	179.9	57.1	0	0	0	0	112.7	I633 S634 A641	I633-T637 HydrophobicContact CG2-CG2 4.43Å; I633-T637 WeakPolarHBondContact O-CG2 3.48Å; I633-T637 PolarHBondContact O-N 2.98Å; I633-T637 PolarHBondContact O-OG1 3.33Å; S634-T637 PolarHBondContact O-N 2.9Å; S634-T637 PolarHBondContact O-OG1 3.04Å; T637-A641 WeakPolarHBondContact O-CB 3.35Å; T637-A641 PolarHBondContact O-N 3.01Å; T637-A641 VanDerWaalsContact O-N 3.1Å
638	A	87	Confident	80.7	Confident	59 Å²	59	75.7 Å²	75.7	49%	0.488	41%	0.412	S	S	.	.	H	α-helix	trans	-67.1	-47.3	175	0	0	0	0	0	112.3	S634 S635 Y636 A641 A642	S634-A638 WeakPolarHBondContact O-CB 3.39Å; S634-A638 PolarHBondContact O-N 3.05Å; S635-A638 PolarHBondContact O-N 2.99Å; Y636-A638 VanDerWaalsContact C-N 3.33Å; Y636-A638 PolarHBondContact O-N 2.94Å; A638-A641 PolarHBondContact O-N 2.94Å; A638-A642 PolarHBondContact O-N 3.28Å
639	N	86.5	Confident	79	Confident	70 Å²	70	77.9 Å²	77.9	37%	0.374	42%	0.424	S	S	.	.	H	α-helix	trans	-66.5	-41.3	179.2	-74.2	3	0	0	0	112	P542 S635 Y636 A642 F643	P542-N639 HydrophobicContact CB-CB 3.93Å; P542-N639 PolarHBondContact O-ND2 2.96Å; P542-N639 VanDerWaalsContact O-ND2 3.12Å; S635-N639 WeakPolarHBondContact O-CB 3.38Å; S635-N639 PolarHBondContact O-N 3.22Å; Y636-N639 PolarHBondContact O-N 3.36Å; N639-A642 PolarHBondContact O-N 3.22Å; N639-F643 WeakPolarHBondContact O-CB 3.4Å; N639-F643 PolarHBondContact O-N 3.5Å
640	L	82.4	Confident	77.4	Confident	43 Å²	43	85.8 Å²	85.8	23%	0.225	46%	0.461	C	S	.	.	H	α-helix	trans	-61.8	-43.1	176.2	179	63.9	0	0	0	111.4	P542 Y636 F643 L644	P542-L640 HydrophobicContact CB-CB 4.4Å; P542-L640 HydrophobicContact CG-CB 3.91Å; P542-L640 HydrophobicContact CG-CD1 3.8Å; P542-L640 HydrophobicContact CG-CG 4.45Å; Y636-L640 HydrophobicContact CE1-CD2 3.95Å; Y636-L640 VanDerWaalsContact O-CB 3.26Å; Y636-L640 WeakPolarHBondContact O-CB 3.36Å; Y636-L640 PolarHBondContact O-N 2.79Å; L640-F643 PolarHBondContact O-N 3.28Å; L640-L644 HydrophobicContact CD1-CD1 4.04Å; L640-L644 HydrophobicContact CD1-CG 4.26Å; L640-L644 HydrophobicContact CG-CD1 3.98Å; L640-L644 WeakPolarHBondContact O-CB 3.41Å; L640-L644 VanDerWaalsContact O-CG 3.28Å; L640-L644 WeakPolarHBondContact O-CG 3.45Å; L640-L644 PolarHBondContact O-N 3.22Å
641	A	75.7	Confident	76.2	Confident	54 Å²	54	84.8 Å²	84.8	45%	0.446	45%	0.454	S	S	.	.	H	α-helix	trans	-62.7	-43.5	175.2	0	0	0	0	0	112	T637 A638 L644 T645	T637-A641 WeakPolarHBondContact O-CB 3.35Å; T637-A641 PolarHBondContact O-N 3.01Å; T637-A641 VanDerWaalsContact O-N 3.1Å; A638-A641 PolarHBondContact O-N 2.94Å; A641-L644 PolarHBondContact O-N 2.87Å; A641-T645 WeakPolarHBondContact O-CG2 3.48Å; A641-T645 PolarHBondContact O-N 2.86Å; A641-T645 VanDerWaalsContact O-N 3.16Å; A641-T645 PolarHBondContact O-OG1 2.96Å
642	A	76.9	Confident	75.1	Confident	53 Å²	53	83 Å²	83	44%	0.438	45%	0.45	S	S	.	.	H	α-helix	trans	-62.1	-44.5	175.8	0	0	0	0	0	112.2	A638 N639 T645 V646	A638-A642 PolarHBondContact O-N 3.28Å; N639-A642 PolarHBondContact O-N 3.22Å; A642-T645 PolarHBondContact O-N 2.92Å; A642-T645 PolarHBondContact O-OG1 2.82Å; A642-V646 PolarHBondContact O-N 3.34Å
643	F	73.8	Confident	74.6	Confident	96 Å²	96	81.9 Å²	81.9	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-63.1	-43.4	178.9	-169.4	-99.7	0	0	0	112.5	D541 N639 L640 T645 V646	D541-F643 HydrophobicContact CB-CZ 4.19Å; N639-F643 WeakPolarHBondContact O-CB 3.4Å; N639-F643 PolarHBondContact O-N 3.5Å; L640-F643 PolarHBondContact O-N 3.28Å; F643-T645 VanDerWaalsContact C-N 3.27Å; F643-T645 PolarHBondContact O-N 3.35Å; F643-V646 PolarHBondContact O-N 3.36Å
644	L	71.6	Confident	74.2	Confident	63 Å²	63	87.2 Å²	87.2	33%	0.33	47%	0.468	S	S	.	.	H	α-helix	trans	-67.3	-25	177.4	-71.9	169	0	0	0	113.6	L640 A641 L827 N831	L640-L644 HydrophobicContact CD1-CD1 4.04Å; L640-L644 HydrophobicContact CD1-CG 4.26Å; L640-L644 HydrophobicContact CG-CD1 3.98Å; L640-L644 WeakPolarHBondContact O-CB 3.41Å; L640-L644 VanDerWaalsContact O-CG 3.28Å; L640-L644 WeakPolarHBondContact O-CG 3.45Å; L640-L644 PolarHBondContact O-N 3.22Å; A641-L644 PolarHBondContact O-N 2.87Å; L644-L827 HydrophobicContact CD1-CD2 3.97Å; L644-L827 HydrophobicContact CD2-CD2 4.41Å; L644-L827 HydrophobicContact CD2-CG 4.49Å; L644-N831 HydrophobicContact CD2-CB 4.41Å
645	T	67.3	Low	74	Confident	105 Å²	105	86.2 Å²	86.2	64%	0.644	46%	0.461	S	S	*	.	H	α-helix	trans	-89.3	-15.8	178.5	52	0	0	0	0	114.3	A641 A642 F643	A641-T645 WeakPolarHBondContact O-CG2 3.48Å; A641-T645 PolarHBondContact O-N 2.86Å; A641-T645 VanDerWaalsContact O-N 3.16Å; A641-T645 PolarHBondContact O-OG1 2.96Å; A642-T645 PolarHBondContact O-N 2.92Å; A642-T645 PolarHBondContact O-OG1 2.82Å; F643-T645 VanDerWaalsContact C-N 3.27Å; F643-T645 PolarHBondContact O-N 3.35Å
646	V	58.2	Low	73.9	Confident	80 Å²	80	84.9 Å²	84.9	49%	0.485	45%	0.451	S	S	.	.			trans	-133.9	83.7	-174.9	-167.7	0	0	0	0	111.9	A642 F643 R648	A642-V646 PolarHBondContact O-N 3.34Å; F643-V646 PolarHBondContact O-N 3.36Å; V646-R648 HydrophobicContact CG1-CG 3.8Å; V646-R648 PolarHBondContact O-N 3.41Å; V646-R648 VanDerWaalsContact O-N 3.16Å
647	Q	57.8	Low	73.8	Confident	155 Å²	155	85.6 Å²	85.6	72%	0.724	46%	0.458	S	S	*	.			trans	-72.9	99.9	158.5	-69.7	-177.9	-10.8	0	0	108.8
648	R	55.6	Low	73.8	Confident	212 Å²	212	85.3 Å²	85.3	80%	0.8	45%	0.454	S	S	*	.			trans	-73.9	131.1	169.7	-64.9	-170.5	178	177.5	-0.4	108.9	V646 E650	V646-R648 HydrophobicContact CG1-CG 3.8Å; V646-R648 PolarHBondContact O-N 3.41Å; V646-R648 VanDerWaalsContact O-N 3.16Å; R648-E650 PolarHBondContact O-N 3.07Å
649	M	55.4	Low	73.9	Confident	118 Å²	118	82.6 Å²	82.6	58%	0.581	43%	0.431	S	S	*	.			trans	-75.3	107.1	162.5	-63.9	-164.3	-58.1	0	0	107.1	M651	M649-M651 PolarHBondContact O-N 2.73Å
650	E	56.7	Low	74.1	Confident	172 Å²	172	79.8 Å²	79.8	80%	0.804	42%	0.418	S	S	*	.			trans	-73.2	108.7	170.8	-67.6	179.7	166.3	0	0	108.1	R648	R648-E650 PolarHBondContact O-N 3.07Å
651	M	64.4	Low	74.4	Confident	86 Å²	86	83 Å²	83	42%	0.424	44%	0.435	S	S	.	.			trans	-84.4	129.1	169.3	-60.3	-143.4	-56.6	0	0	108.3	M649 I653	M649-M651 PolarHBondContact O-N 2.73Å; M651-I653 PolarHBondContact O-N 3Å
652	P	69.4	Low	75	Confident	75 Å²	75	82.3 Å²	82.3	49%	0.487	42%	0.423	S	S	.	.	S	Bend	trans	-74.2	-9.7	-176.3	30.8	-36.9	0	0	0	113.6	Y526 H529	Y526-P652 HydrophobicContact CE1-CG 4.43Å; H529-P652 WeakPolarHBondContact NE2-CG 3.43Å
653	I	79.4	Confident	75.5	Confident	5 Å²	5	84.8 Å²	84.8	3%	0.026	43%	0.432	C	S	.	.			trans	-144.8	128.8	-177.9	-61.7	-176.7	0	0	0	106.3	M651 S655 D658 L659 I665 I740	M651-I653 PolarHBondContact O-N 3Å; I653-S655 WeakPolarHBondContact CG2-O 3.45Å; I653-D658 HydrophobicContact CG2-CB 4.05Å; I653-L659 HydrophobicContact CD1-CB 4.19Å; I653-L659 HydrophobicContact CD1-CD1 3.51Å; I653-L659 HydrophobicContact CD1-CG 4.45Å; I653-L659 HydrophobicContact CG2-CB 4.24Å; I653-I665 HydrophobicContact CD1-CD1 3.64Å; I653-I665 HydrophobicContact CG1-CD1 4.23Å; I653-I740 HydrophobicContact CB-CD1 4.27Å; I653-I740 HydrophobicContact CB-CG2 4.39Å; I653-I740 HydrophobicContact CG2-CG2 3.86Å; I653-I740 WeakPolarHBondContact O-CG2 3.44Å
654	E	80.8	Confident	76.2	Confident	147 Å²	147	84.2 Å²	84.2	69%	0.687	45%	0.445	S	S	*	.	S	Bend	trans	-109.3	-33.5	172.6	-64.5	-168.2	166.2	0	0	111.7	D658	E654-D658 PolarHBondContact N-OD2 3.21Å
655	S	85.9	Confident	77	Confident	41 Å²	41	82 Å²	82	29%	0.287	43%	0.433	S	S	.	.	S	Bend	trans	-121.2	174.4	-176.2	77.2	0	0	0	0	113.4	I653 D658	I653-S655 WeakPolarHBondContact CG2-O 3.45Å; S655-D658 WeakPolarHBondContact CB-OD2 3.32Å; S655-D658 PolarHBondContact N-OD2 2.91Å; S655-D658 PolarHBondContact OG-N 2.92Å; S655-D658 PolarHBondContact OG-OD2 3.12Å
656	V	88.2	Confident	78.3	Confident	20 Å²	20	79 Å²	79	12%	0.121	41%	0.412	C	S	.	.	H	α-helix	trans	-83.4	-28.7	177.9	-176.5	0	0	0	0	111.7	I524 D658 L659 A660 Y687 M690 L744	I524-V656 HydrophobicContact CD1-CB 4.3Å; I524-V656 HydrophobicContact CD1-CG1 4.45Å; I524-V656 HydrophobicContact CD1-CG2 3.46Å; I524-V656 VanDerWaalsContact CD1-CG2 3.46Å; I524-V656 HydrophobicContact CG1-CG2 4.48Å; V656-D658 VanDerWaalsContact C-N 3.32Å; V656-L659 WeakPolarHBondContact O-CB 3.3Å; V656-L659 PolarHBondContact O-N 3.33Å; V656-A660 PolarHBondContact O-N 3.4Å; V656-Y687 HydrophobicContact CG1-CE1 4.45Å; V656-M690 HydrophobicContact CG1-CE 3.86Å; V656-M690 HydrophobicContact CG1-SD 3.52Å; V656-M690 VanDerWaalsContact CG1-SD 3.52Å; V656-L744 HydrophobicContact CB-CD2 3.97Å; V656-L744 HydrophobicContact CG1-CD2 3.93Å; V656-L744 HydrophobicContact CG2-CD1 4.17Å; V656-L744 HydrophobicContact CG2-CD2 3.5Å; V656-L744 VanDerWaalsContact CG2-CD2 3.5Å; V656-L744 HydrophobicContact CG2-CG 3.91Å
657	D	89.1	Confident	80	Confident	65 Å²	65	75.2 Å²	75.2	35%	0.348	39%	0.389	S	S	.	.	H	α-helix	trans	-63.5	-40.4	173	-61.9	-69.5	0	0	0	110.6	L659 A660 D661 T686	D657-L659 VanDerWaalsContact C-N 3.28Å; D657-L659 PolarHBondContact O-N 3.36Å; D657-A660 PolarHBondContact O-N 2.94Å; D657-A660 VanDerWaalsContact O-N 3.08Å; D657-D661 WeakPolarHBondContact O-CB 3.47Å; D657-D661 PolarHBondContact O-N 3.29Å; D657-T686 WeakPolarHBondContact OD1-CB 3.46Å; D657-T686 WeakPolarHBondContact OD1-CG2 3.48Å; D657-T686 PolarHBondContact OD1-OG1 3.19Å
658	D	88.4	Confident	81.7	Confident	73 Å²	73	67.9 Å²	67.9	39%	0.39	36%	0.355	S	S	.	.	H	α-helix	trans	-56	-41.9	171.9	-57.1	-43.4	0	0	0	111.9	I653 E654 S655 V656 Q662	I653-D658 HydrophobicContact CG2-CB 4.05Å; E654-D658 PolarHBondContact N-OD2 3.21Å; S655-D658 WeakPolarHBondContact CB-OD2 3.32Å; S655-D658 PolarHBondContact N-OD2 2.91Å; S655-D658 PolarHBondContact OG-N 2.92Å; S655-D658 PolarHBondContact OG-OD2 3.12Å; V656-D658 VanDerWaalsContact C-N 3.32Å; D658-Q662 WeakPolarHBondContact O-CG 3.48Å; D658-Q662 PolarHBondContact O-N 3.13Å
659	L	89.2	Confident	83.5	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-68.6	-33.6	178.5	-178.4	69.4	0	0	0	112	I524 I653 V656 D657 Q662 I665 Y667 M690 A719	I524-L659 HydrophobicContact CD1-CD2 3.83Å; I524-L659 HydrophobicContact CG1-CD2 4.38Å; I653-L659 HydrophobicContact CD1-CB 4.19Å; I653-L659 HydrophobicContact CD1-CD1 3.51Å; I653-L659 HydrophobicContact CD1-CG 4.45Å; I653-L659 HydrophobicContact CG2-CB 4.24Å; V656-L659 WeakPolarHBondContact O-CB 3.3Å; V656-L659 PolarHBondContact O-N 3.33Å; D657-L659 VanDerWaalsContact C-N 3.28Å; D657-L659 PolarHBondContact O-N 3.36Å; L659-Q662 PolarHBondContact O-NE2 3.3Å; L659-I665 HydrophobicContact CD1-CG2 4.11Å; L659-Y667 HydrophobicContact CD1-CD1 3.69Å; L659-Y667 HydrophobicContact CD1-CE1 4.38Å; L659-Y667 HydrophobicContact CD1-CG 4.32Å; L659-Y667 HydrophobicContact CD2-CD1 4.11Å; L659-Y667 HydrophobicContact CD2-CG 4.06Å; L659-Y667 HydrophobicContact CG-CD1 3.65Å; L659-Y667 HydrophobicContact CG-CE1 4.05Å; L659-Y667 HydrophobicContact CG-CG 4.13Å; L659-Y667 VanDerWaalsContact O-CE1 3.26Å; L659-Y667 WeakPolarHBondContact O-CE1 3.46Å; L659-M690 HydrophobicContact CD2-CE 4.07Å; L659-A719 HydrophobicContact CD1-CB 4.26Å
660	A	89.9	Confident	85.2	Confident	12 Å²	12	54.3 Å²	54.3	10%	0.099	30%	0.3	C	S	.	.	H	α-helix	trans	-81.9	-29.9	-178.5	0	0	0	0	0	113.8	V656 D657 T686 M690	V656-A660 PolarHBondContact O-N 3.4Å; D657-A660 PolarHBondContact O-N 2.94Å; D657-A660 VanDerWaalsContact O-N 3.08Å; A660-T686 HydrophobicContact CB-CG2 3.43Å; A660-T686 VanDerWaalsContact CB-CG2 3.43Å; A660-M690 HydrophobicContact CB-CG 3.64Å; A660-M690 HydrophobicContact CB-SD 4.18Å
661	D	89.8	Confident	86.6	Confident	109 Å²	109	51.9 Å²	51.9	58%	0.583	29%	0.288	S	S	*	.	H	α-helix	trans	-80.3	-21.5	178.3	-73.6	-5.6	0	0	0	112.4	D657 R689	D657-D661 WeakPolarHBondContact O-CB 3.47Å; D657-D661 PolarHBondContact O-N 3.29Å; D661-R689 IonicContact OD1-CZ 2.86Å; D661-R689 IonicContact OD1-NH1 2.73Å; D661-R689 PolarHBondContact OD1-NH1 2.83Å; D661-R689 IonicContact OD1-NH2 2.62Å; D661-R689 PolarHBondContact OD1-NH2 3.32Å
662	Q	87.6	Confident	87.4	Confident	41 Å²	41	48.7 Å²	48.7	19%	0.192	28%	0.277	C	S	.	.			trans	-97.8	162.1	175.7	71.6	78.4	50.5	0	0	113.2	D658 L659 I665	D658-Q662 WeakPolarHBondContact O-CG 3.48Å; D658-Q662 PolarHBondContact O-N 3.13Å; L659-Q662 PolarHBondContact O-NE2 3.3Å; Q662-I665 PolarHBondContact NE2-O 3.32Å
663	T	86.9	Confident	88.1	Confident	105 Å²	105	45.7 Å²	45.7	64%	0.644	26%	0.26	S	S	*	.			trans	-132	4.8	179.8	55.7	0	0	0	0	114.7	F693	T663-F693 HydrophobicContact CG2-CE2 4.29Å
664	A	88.1	Confident	88.5	Confident	84 Å²	84	46.2 Å²	46.2	69%	0.694	26%	0.264	S	S	*	.	S	Bend	trans	-84.4	-28.7	-176.3	0	0	0	0	0	113.5
665	I	90.1	Very high	88.9	Confident	15 Å²	15	39.7 Å²	39.7	8%	0.077	23%	0.234	C	C	.	.	S	Bend	trans	-101.5	117.9	171.3	-66.8	163.3	0	0	0	106.7	Y526 I653 L659 Q662 A719	Y526-I665 HydrophobicContact CE2-CG2 3.99Å; I653-I665 HydrophobicContact CD1-CD1 3.64Å; I653-I665 HydrophobicContact CG1-CD1 4.23Å; L659-I665 HydrophobicContact CD1-CG2 4.11Å; Q662-I665 PolarHBondContact NE2-O 3.32Å; I665-A719 HydrophobicContact CG2-CB 4.09Å
666	E	92.8	Very high	89.2	Confident	42 Å²	42	39.2 Å²	39.2	20%	0.196	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	151.6	173.8	-65.9	-172	163	0	0	110	K697 R712 N717 Y718 A719	E666-K697 WeakPolarHBondContact OE1-CE 3.44Å; E666-K697 IonicContact OE1-NZ 2.73Å; E666-K697 PolarHBondContact OE1-NZ 3.12Å; E666-R712 IonicContact OE2-CZ 2.76Å; E666-R712 IonicContact OE2-NH2 3.93Å; E666-R712 PolarHBondContact OE2-NH2 3.44Å; E666-N717 PolarHBondContact N-O 2.92Å; E666-Y718 HydrophobicContact CB-CD2 3.86Å; E666-Y718 CarbonylContact O-C 3.51Å; E666-Y718 VanDerWaalsContact O-CA 3.27Å; E666-Y718 WeakPolarHBondContact O-CA 3.22Å; E666-A719 PolarHBondContact O-N 2.85Å
667	Y	93.8	Very high	89.2	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.008	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	151.7	174.9	53.1	-93.6	0	0	0	111.6	L659 M690 F693 M694 V701 A719 L721	L659-Y667 HydrophobicContact CD1-CD1 3.69Å; L659-Y667 HydrophobicContact CD1-CE1 4.38Å; L659-Y667 HydrophobicContact CD1-CG 4.32Å; L659-Y667 HydrophobicContact CD2-CD1 4.11Å; L659-Y667 HydrophobicContact CD2-CG 4.06Å; L659-Y667 HydrophobicContact CG-CD1 3.65Å; L659-Y667 HydrophobicContact CG-CE1 4.05Å; L659-Y667 HydrophobicContact CG-CG 4.13Å; L659-Y667 VanDerWaalsContact O-CE1 3.26Å; L659-Y667 WeakPolarHBondContact O-CE1 3.46Å; Y667-M690 HydrophobicContact CD2-CE 3.85Å; Y667-M690 HydrophobicContact CE2-CB 3.8Å; Y667-M690 HydrophobicContact CE2-CE 3.72Å; Y667-M690 HydrophobicContact CE2-CG 3.88Å; Y667-F693 HydrophobicContact CD1-CD1 4.37Å; Y667-F693 HydrophobicContact CD1-CE1 4.03Å; Y667-F693 HydrophobicContact CD2-CD1 4.23Å; Y667-F693 HydrophobicContact CD2-CE1 4.46Å; Y667-F693 AromaticContact CE1-CD1 3.78Å; Y667-F693 HydrophobicContact CE1-CD1 3.78Å; Y667-F693 AromaticContact CE1-CE1 3.75Å; Y667-F693 HydrophobicContact CE1-CE1 3.75Å; Y667-F693 HydrophobicContact CE1-CG 4.47Å; Y667-F693 HydrophobicContact CE1-CZ 4.42Å; Y667-F693 AromaticContact CE2-CD1 3.6Å; Y667-F693 HydrophobicContact CE2-CD1 3.6Å; Y667-F693 HydrophobicContact CE2-CE1 4.19Å; Y667-F693 HydrophobicContact CE2-CG 4.42Å; Y667-F693 HydrophobicContact CG-CE1 4.4Å; Y667-F693 AromaticContact CZ-CD1 3.37Å; Y667-F693 AromaticContact CZ-CE1 3.85Å; Y667-F693 AromaticContact CZ-CG 3.94Å; Y667-M694 HydrophobicContact CD2-CG 3.89Å; Y667-M694 HydrophobicContact CD2-SD 4.12Å; Y667-M694 HydrophobicContact CE2-CG 3.92Å; Y667-M694 HydrophobicContact CE2-SD 4.47Å; Y667-V701 VanDerWaalsContact O-CB 3.31Å; Y667-V701 WeakPolarHBondContact O-CB 3.42Å; Y667-V701 WeakPolarHBondContact O-CG2 3.37Å; Y667-A719 WeakPolarHBondContact CA-O 3.44Å; Y667-A719 WeakPolarHBondContact CB-O 3.38Å; Y667-L721 HydrophobicContact CD2-CD1 4.24Å
668	G	94.6	Very high	89.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	176.3	-174.7	0	0	0	0	0	113.4	Y718 A719 Y720 L721	G668-Y718 WeakPolarHBondContact CA-OH 3.34Å; G668-Y718 PolarHBondContact N-OH 3.24Å; G668-Y718 PolarHBondContact O-OH 3.15Å; G668-A719 PolarHBondContact N-O 2.98Å; G668-Y720 WeakPolarHBondContact O-CD2 3.45Å; G668-L721 PolarHBondContact O-N 3.35Å
669	T	94.1	Very high	89.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.211	C	C	.	.			trans	-130.5	172.1	-174.1	54.8	0	0	0	0	111.1	T675 F679 M694 F702 V703 L721	T669-T675 HydrophobicContact CG2-CG2 3.54Å; T669-F679 HydrophobicContact CG2-CD2 4.22Å; T669-F679 HydrophobicContact CG2-CE2 4.29Å; T669-M694 HydrophobicContact CG2-SD 4.36Å; T669-F702 WeakPolarHBondContact O-CA 3.2Å; T669-F702 WeakPolarHBondContact OG1-CD1 3.46Å; T669-F702 WeakPolarHBondContact OG1-CE1 3.2Å; T669-V703 PolarHBondContact O-N 2.86Å; T669-V703 VanDerWaalsContact O-N 3.15Å; T669-L721 HydrophobicContact CG2-CB 3.59Å; T669-L721 HydrophobicContact CG2-CD1 4.19Å
670	M	90.1	Very high	89.5	Confident	45 Å²	45	41.7 Å²	41.7	22%	0.222	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-67.2	130.6	168	-178.6	-175.4	-102.3	0	0	110.7	G672 G673 V703 T706	M670-G672 PolarHBondContact O-N 3.33Å; M670-G673 PolarHBondContact O-N 2.89Å; M670-V703 WeakPolarHBondContact CA-O 3.38Å; M670-T706 WeakPolarHBondContact CE-OG1 3.41Å
671	H	86.8	Confident	89.5	Confident	122 Å²	122	45.3 Å²	45.3	57%	0.565	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	127.3	176.6	-176.3	-82.4	0	0	0	111.4	G673 F702 V703	H671-G673 PolarHBondContact O-N 3.36Å; H671-F702 HydrophobicContact CB-CB 4.23Å; H671-V703 PolarHBondContact N-O 2.96Å
672	G	80.1	Confident	89.6	Confident	19 Å²	19	41 Å²	41	20%	0.196	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	7.3	-176.6	0	0	0	0	0	114.9	V475 M670 M676	V475-G672 WeakPolarHBondContact CG2-O 3.31Å; M670-G672 PolarHBondContact O-N 3.33Å; G672-M676 PolarHBondContact N-SD 2.2Å
673	G	84.7	Confident	89.7	Confident	11 Å²	11	50.3 Å²	50.3	11%	0.113	27%	0.266	C	S	.	.	S	Bend	trans	-79.4	158.2	175.2	0	0	0	0	0	113.4	M670 H671 T675 M676 T677	M670-G673 PolarHBondContact O-N 2.89Å; H671-G673 PolarHBondContact O-N 3.36Å; G673-T675 PolarHBondContact O-N 3.32Å; G673-M676 WeakPolarHBondContact O-CB 3.45Å; G673-M676 PolarHBondContact O-N 3.42Å; G673-T677 PolarHBondContact O-N 3.18Å
674	S	87.1	Confident	90	Very high	16 Å²	16	51.2 Å²	51.2	11%	0.112	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-32.2	176.4	56.9	0	0	0	0	113.1	T502 F678	T502-S674 PolarHBondContact OG1-OG 3.44Å; S674-F678 WeakPolarHBondContact O-CB 3.37Å; S674-F678 PolarHBondContact O-N 2.86Å
675	T	90.8	Very high	90.2	Very high	11 Å²	11	53.1 Å²	53.1	7%	0.067	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-36.4	173.8	-53.9	0	0	0	0	112.8	I522 T669 G673 F678 F679 L721	I522-T675 HydrophobicContact CD1-CG2 3.82Å; I522-T675 HydrophobicContact CG1-CG2 3.88Å; I522-T675 HydrophobicContact CG2-CG2 3.78Å; T669-T675 HydrophobicContact CG2-CG2 3.54Å; G673-T675 PolarHBondContact O-N 3.32Å; T675-F678 PolarHBondContact O-N 3.33Å; T675-F679 HydrophobicContact CG2-CD2 4.18Å; T675-F679 HydrophobicContact CG2-CE2 3.89Å; T675-F679 VanDerWaalsContact O-CD2 3.22Å; T675-F679 WeakPolarHBondContact O-CD2 3.3Å; T675-F679 PolarHBondContact O-N 3.37Å; T675-L721 HydrophobicContact CG2-CB 4.47Å
676	M	90.3	Very high	90.4	Very high	31 Å²	31	52.9 Å²	52.9	15%	0.153	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-50.7	176.6	-176.1	-177.8	175.1	0	0	110.4	G672 G673 F678 F679 M680 W691 F702	G672-M676 PolarHBondContact N-SD 2.2Å; G673-M676 WeakPolarHBondContact O-CB 3.45Å; G673-M676 PolarHBondContact O-N 3.42Å; M676-F678 VanDerWaalsContact C-N 3.28Å; M676-F678 PolarHBondContact O-N 3.33Å; M676-F679 PolarHBondContact O-N 3.09Å; M676-M680 PolarHBondContact O-N 3.06Å; M676-W691 HydrophobicContact CE-CH2 3.86Å; M676-W691 HydrophobicContact CE-CZ3 4.37Å; M676-W691 HydrophobicContact CG-CH2 4.04Å; M676-W691 HydrophobicContact CG-CZ3 3.76Å; M676-F702 HydrophobicContact CE-CD1 4.37Å; M676-F702 HydrophobicContact CE-CE1 4.08Å; M676-F702 HydrophobicContact CE-CE2 4.35Å; M676-F702 HydrophobicContact CE-CZ 4.06Å; M676-F702 HydrophobicContact CG-CD1 4.33Å; M676-F702 HydrophobicContact CG-CE1 3.86Å; M676-F702 HydrophobicContact SD-CD1 4.19Å; M676-F702 HydrophobicContact SD-CE1 4.17Å
677	T	88.6	Confident	90.4	Very high	41 Å²	41	52.7 Å²	52.7	25%	0.252	25%	0.25	S	S	.	.	H	α-helix	trans	-61.2	-35	176.4	-48.5	0	0	0	0	112.4	G673 F679 M680 N681	G673-T677 PolarHBondContact O-N 3.18Å; T677-F679 PolarHBondContact O-N 2.65Å; T677-M680 PolarHBondContact O-N 3.06Å; T677-N681 WeakPolarHBondContact O-CB 3.48Å; T677-N681 PolarHBondContact O-N 3.37Å
678	F	91.4	Very high	90.4	Very high	55 Å²	55	56 Å²	56	24%	0.241	27%	0.266	C	S	.	.	H	α-helix	trans	-59.4	-45.7	174.9	170.2	-91.7	0	0	0	112.7	I522 S674 T675 M676 S682 Y687 D745	I522-F678 HydrophobicContact CD1-CB 4.41Å; I522-F678 HydrophobicContact CD1-CD1 3.37Å; I522-F678 HydrophobicContact CD1-CE1 3.66Å; I522-F678 HydrophobicContact CD1-CG 3.86Å; I522-F678 HydrophobicContact CD1-CZ 4.33Å; S674-F678 WeakPolarHBondContact O-CB 3.37Å; S674-F678 PolarHBondContact O-N 2.86Å; T675-F678 PolarHBondContact O-N 3.33Å; M676-F678 VanDerWaalsContact C-N 3.28Å; M676-F678 PolarHBondContact O-N 3.33Å; F678-S682 WeakPolarHBondContact O-CB 3.45Å; F678-S682 PolarHBondContact O-N 2.85Å; F678-Y687 HydrophobicContact CE1-CD2 4Å; F678-Y687 HydrophobicContact CE1-CE2 4.16Å; F678-Y687 HydrophobicContact CZ-CD2 4.09Å; F678-Y687 AromaticContact CZ-CE2 4Å; F678-Y687 HydrophobicContact CZ-CE2 4Å; F678-D745 HydrophobicContact CE2-CB 4.26Å; F678-D745 HydrophobicContact CZ-CB 4.26Å
679	F	92.6	Very high	90.4	Very high	1 Å²	1	60.6 Å²	60.6	0%	0.004	28%	0.283	C	S	.	.	H	α-helix	trans	-69.9	-39.1	177.1	-77.3	-72.5	0	0	0	111.7	I522 T669 T675 M676 T677 S682 Y687 M690 W691 M694 L721 L744	I522-F679 HydrophobicContact CD1-CE2 4.34Å; T669-F679 HydrophobicContact CG2-CD2 4.22Å; T669-F679 HydrophobicContact CG2-CE2 4.29Å; T675-F679 HydrophobicContact CG2-CD2 4.18Å; T675-F679 HydrophobicContact CG2-CE2 3.89Å; T675-F679 VanDerWaalsContact O-CD2 3.22Å; T675-F679 WeakPolarHBondContact O-CD2 3.3Å; T675-F679 PolarHBondContact O-N 3.37Å; M676-F679 PolarHBondContact O-N 3.09Å; T677-F679 PolarHBondContact O-N 2.65Å; F679-S682 WeakPolarHBondContact O-CB 3.46Å; F679-S682 PolarHBondContact O-N 3.33Å; F679-Y687 HydrophobicContact CD1-CG 4.27Å; F679-Y687 AromaticContact CE1-CD1 3.9Å; F679-Y687 HydrophobicContact CE1-CD1 3.9Å; F679-Y687 AromaticContact CE1-CG 3.98Å; F679-Y687 HydrophobicContact CE1-CG 3.98Å; F679-M690 HydrophobicContact CD1-CB 4.47Å; F679-M690 HydrophobicContact CE1-CE 4.35Å; F679-M690 HydrophobicContact CE1-SD 4.06Å; F679-M690 HydrophobicContact CZ-CE 4.46Å; F679-W691 HydrophobicContact CB-CB 4.3Å; F679-W691 HydrophobicContact CB-CE3 3.88Å; F679-M694 HydrophobicContact CB-CE 3.83Å; F679-M694 HydrophobicContact CD1-CE 4.19Å; F679-M694 HydrophobicContact CD2-CE 3.94Å; F679-M694 HydrophobicContact CG-CE 3.73Å; F679-L721 HydrophobicContact CE2-CD1 4Å; F679-L721 HydrophobicContact CE2-CD2 4.44Å; F679-L721 HydrophobicContact CZ-CD1 4.13Å; F679-L721 HydrophobicContact CZ-CD2 4.25Å; F679-L744 HydrophobicContact CZ-CD1 4.39Å
680	M	90.3	Very high	90.4	Very high	113 Å²	113	60.6 Å²	60.6	56%	0.557	28%	0.283	S	S	*	.	H	α-helix	trans	-59.4	-45.9	176.6	-176.3	172.4	172.3	0	0	113.2	M676 T677 S682 W691	M676-M680 PolarHBondContact O-N 3.06Å; T677-M680 PolarHBondContact O-N 3.06Å; M680-S682 VanDerWaalsContact C-N 3.32Å; M680-W691 HydrophobicContact CB-CD2 3.98Å; M680-W691 HydrophobicContact CB-CE3 4.11Å; M680-W691 HydrophobicContact CB-CH2 3.76Å; M680-W691 HydrophobicContact CB-CZ2 3.61Å; M680-W691 HydrophobicContact CB-CZ3 4Å; M680-W691 HydrophobicContact CG-CH2 4.12Å; M680-W691 HydrophobicContact CG-CZ2 3.57Å; M680-W691 HydrophobicContact SD-CH2 4.17Å; M680-W691 HydrophobicContact SD-CZ2 3.84Å
681	N	89.6	Confident	90.6	Very high	89 Å²	89	59.9 Å²	59.9	48%	0.476	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	6.1	-177.7	-69	-10.2	0	0	0	113.2	E506 T677	E506-N681 PolarHBondContact OE1-ND2 3.39Å; T677-N681 WeakPolarHBondContact O-CB 3.48Å; T677-N681 PolarHBondContact O-N 3.37Å
682	S	90.6	Very high	90.9	Very high	17 Å²	17	58.8 Å²	58.8	12%	0.119	28%	0.276	C	S	.	.			trans	-71.6	142.5	-173.4	-155.8	0	0	0	0	112.9	F678 F679 M680 Y687 Q688	F678-S682 WeakPolarHBondContact O-CB 3.45Å; F678-S682 PolarHBondContact O-N 2.85Å; F679-S682 WeakPolarHBondContact O-CB 3.46Å; F679-S682 PolarHBondContact O-N 3.33Å; M680-S682 VanDerWaalsContact C-N 3.32Å; S682-Y687 WeakPolarHBondContact OG-CB 3.24Å; S682-Y687 WeakPolarHBondContact OG-CD2 3.44Å; S682-Q688 VanDerWaalsContact O-CG 3.24Å; S682-Q688 WeakPolarHBondContact O-CG 3.1Å; S682-Q688 PolarHBondContact O-NE2 3.5Å
683	R	91.1	Very high	91.6	Very high	237 Å²	237	59.5 Å²	59.5	89%	0.894	27%	0.274	S	S	*	.			trans	-101.3	-1.2	172.6	-63	-173.5	-178.9	-172.9	-0.3	113.6
684	Y	92.8	Very high	92.1	Very high	124 Å²	124	59.1 Å²	59.1	49%	0.486	27%	0.269	S	S	.	.	S	Bend	trans	-87.5	130.4	-179	-171.2	-113.6	0	0	0	111.1	T686 Y687 Q688	Y684-T686 PolarHBondContact O-N 3.39Å; Y684-Y687 AromaticContact CD1-CD1 3.99Å; Y684-Y687 HydrophobicContact CD1-CD1 3.99Å; Y684-Y687 AromaticContact CD1-CD2 3.87Å; Y684-Y687 HydrophobicContact CD1-CD2 3.87Å; Y684-Y687 HydrophobicContact CD1-CE1 4.03Å; Y684-Y687 AromaticContact CD1-CE2 3.94Å; Y684-Y687 HydrophobicContact CD1-CE2 3.94Å; Y684-Y687 AromaticContact CD1-CG 3.89Å; Y684-Y687 HydrophobicContact CD1-CG 3.89Å; Y684-Y687 HydrophobicContact CE1-CE1 4.44Å; Y684-Y687 HydrophobicContact CG-CD2 4.21Å; Y684-Y687 HydrophobicContact CG-CE2 4.38Å; Y684-Y687 PolarHBondContact O-N 3.01Å; Y684-Q688 PolarHBondContact O-N 3.36Å
685	Q	92.9	Very high	92.4	Very high	124 Å²	124	63.3 Å²	63.3	58%	0.579	29%	0.291	S	S	*	.	H	α-helix	trans	-57.8	-42.4	-169	-167.5	67.1	16.7	0	0	113.3	Q688 R689	Q685-Q688 PolarHBondContact O-N 3.26Å; Q685-R689 WeakPolarHBondContact O-CG 3.45Å; Q685-R689 PolarHBondContact O-N 3.16Å
686	T	92.6	Very high	92.5	Very high	10 Å²	10	67.1 Å²	67.1	6%	0.061	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-44.3	175.9	-59.7	0	0	0	0	111.4	D657 A660 Y684 Q688 R689 M690	D657-T686 WeakPolarHBondContact OD1-CB 3.46Å; D657-T686 WeakPolarHBondContact OD1-CG2 3.48Å; D657-T686 PolarHBondContact OD1-OG1 3.19Å; A660-T686 HydrophobicContact CB-CG2 3.43Å; A660-T686 VanDerWaalsContact CB-CG2 3.43Å; Y684-T686 PolarHBondContact O-N 3.39Å; T686-Q688 PolarHBondContact O-N 3.26Å; T686-R689 WeakPolarHBondContact O-CB 3.27Å; T686-R689 PolarHBondContact O-N 3.32Å; T686-M690 HydrophobicContact CG2-SD 4.36Å; T686-M690 WeakPolarHBondContact O-CG 3.36Å; T686-M690 PolarHBondContact O-N 3.46Å
687	Y	94.3	Very high	92.5	Very high	38 Å²	38	68.9 Å²	68.9	15%	0.149	33%	0.325	C	S	.	.	H	α-helix	trans	-69.1	-32.7	-178.5	-59.2	-16.6	0	0	0	112.5	V656 F678 F679 S682 Y684 M690 W691 L744	V656-Y687 HydrophobicContact CG1-CE1 4.45Å; F678-Y687 HydrophobicContact CE1-CD2 4Å; F678-Y687 HydrophobicContact CE1-CE2 4.16Å; F678-Y687 HydrophobicContact CZ-CD2 4.09Å; F678-Y687 AromaticContact CZ-CE2 4Å; F678-Y687 HydrophobicContact CZ-CE2 4Å; F679-Y687 HydrophobicContact CD1-CG 4.27Å; F679-Y687 AromaticContact CE1-CD1 3.9Å; F679-Y687 HydrophobicContact CE1-CD1 3.9Å; F679-Y687 AromaticContact CE1-CG 3.98Å; F679-Y687 HydrophobicContact CE1-CG 3.98Å; S682-Y687 WeakPolarHBondContact OG-CB 3.24Å; S682-Y687 WeakPolarHBondContact OG-CD2 3.44Å; Y684-Y687 AromaticContact CD1-CD1 3.99Å; Y684-Y687 HydrophobicContact CD1-CD1 3.99Å; Y684-Y687 AromaticContact CD1-CD2 3.87Å; Y684-Y687 HydrophobicContact CD1-CD2 3.87Å; Y684-Y687 HydrophobicContact CD1-CE1 4.03Å; Y684-Y687 AromaticContact CD1-CE2 3.94Å; Y684-Y687 HydrophobicContact CD1-CE2 3.94Å; Y684-Y687 AromaticContact CD1-CG 3.89Å; Y684-Y687 HydrophobicContact CD1-CG 3.89Å; Y684-Y687 HydrophobicContact CE1-CE1 4.44Å; Y684-Y687 HydrophobicContact CG-CD2 4.21Å; Y684-Y687 HydrophobicContact CG-CE2 4.38Å; Y684-Y687 PolarHBondContact O-N 3.01Å; Y687-M690 HydrophobicContact CD1-SD 4.22Å; Y687-M690 PolarHBondContact O-N 3.07Å; Y687-W691 WeakPolarHBondContact O-CB 3.31Å; Y687-W691 PolarHBondContact O-N 3.31Å; Y687-L744 HydrophobicContact CE1-CD2 3.53Å; Y687-L744 WeakPolarHBondContact OH-CD2 3.33Å; Y687-L744 PolarHBondContact OH-O 3.35Å
688	Q	93.8	Very high	92.5	Very high	72 Å²	72	75.4 Å²	75.4	34%	0.336	35%	0.352	S	S	.	.	H	α-helix	trans	-66.7	-41.2	170.7	-70.6	-175.7	-13.4	0	0	112.4	S682 Y684 Q685 T686 M690 W691 N692	S682-Q688 VanDerWaalsContact O-CG 3.24Å; S682-Q688 WeakPolarHBondContact O-CG 3.1Å; S682-Q688 PolarHBondContact O-NE2 3.5Å; Y684-Q688 PolarHBondContact O-N 3.36Å; Q685-Q688 PolarHBondContact O-N 3.26Å; T686-Q688 PolarHBondContact O-N 3.26Å; Q688-M690 VanDerWaalsContact C-N 3.34Å; Q688-W691 PolarHBondContact O-N 3.18Å; Q688-N692 WeakPolarHBondContact O-CB 2.69Å; Q688-N692 PolarHBondContact O-N 3.28Å; Q688-N692 PolarHBondContact O-ND2 2.83Å
689	R	93.1	Very high	92.4	Very high	97 Å²	97	77.4 Å²	77.4	37%	0.366	37%	0.371	S	S	.	.	H	α-helix	trans	-60.4	-44.6	172.5	-69.4	-173.7	-60.8	144.8	-0.2	111.2	D661 Q685 T686 N692 F693	D661-R689 IonicContact OD1-CZ 2.86Å; D661-R689 IonicContact OD1-NH1 2.73Å; D661-R689 PolarHBondContact OD1-NH1 2.83Å; D661-R689 IonicContact OD1-NH2 2.62Å; D661-R689 PolarHBondContact OD1-NH2 3.32Å; Q685-R689 WeakPolarHBondContact O-CG 3.45Å; Q685-R689 PolarHBondContact O-N 3.16Å; T686-R689 WeakPolarHBondContact O-CB 3.27Å; T686-R689 PolarHBondContact O-N 3.32Å; R689-N692 PolarHBondContact O-N 2.67Å; R689-F693 PolarHBondContact O-N 3.26Å
690	M	94.4	Very high	92.4	Very high	0 Å²	0	80.5 Å²	80.5	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-61.3	-43.7	174.9	-69	179	79.4	0	0	112.5	V656 L659 A660 Y667 F679 T686 Y687 Q688 F693 M694 L721	V656-M690 HydrophobicContact CG1-CE 3.86Å; V656-M690 HydrophobicContact CG1-SD 3.52Å; V656-M690 VanDerWaalsContact CG1-SD 3.52Å; L659-M690 HydrophobicContact CD2-CE 4.07Å; A660-M690 HydrophobicContact CB-CG 3.64Å; A660-M690 HydrophobicContact CB-SD 4.18Å; Y667-M690 HydrophobicContact CD2-CE 3.85Å; Y667-M690 HydrophobicContact CE2-CB 3.8Å; Y667-M690 HydrophobicContact CE2-CE 3.72Å; Y667-M690 HydrophobicContact CE2-CG 3.88Å; F679-M690 HydrophobicContact CD1-CB 4.47Å; F679-M690 HydrophobicContact CE1-CE 4.35Å; F679-M690 HydrophobicContact CE1-SD 4.06Å; F679-M690 HydrophobicContact CZ-CE 4.46Å; T686-M690 HydrophobicContact CG2-SD 4.36Å; T686-M690 WeakPolarHBondContact O-CG 3.36Å; T686-M690 PolarHBondContact O-N 3.46Å; Y687-M690 HydrophobicContact CD1-SD 4.22Å; Y687-M690 PolarHBondContact O-N 3.07Å; Q688-M690 VanDerWaalsContact C-N 3.34Å; M690-F693 PolarHBondContact O-N 3.38Å; M690-M694 HydrophobicContact CB-CE 4.37Å; M690-M694 VanDerWaalsContact O-CG 3.31Å; M690-M694 WeakPolarHBondContact O-CG 3.26Å; M690-M694 PolarHBondContact O-N 3.27Å; M690-L721 HydrophobicContact CE-CD1 3.92Å
691	W	94.9	Very high	92.5	Very high	30 Å²	30	75.1 Å²	75.1	11%	0.114	37%	0.366	C	S	.	.	H	α-helix	trans	-61	-47.6	175.8	176.9	-109.7	0	0	0	112	M676 F679 M680 Y687 Q688 F693 M694 N695 F702	M676-W691 HydrophobicContact CE-CH2 3.86Å; M676-W691 HydrophobicContact CE-CZ3 4.37Å; M676-W691 HydrophobicContact CG-CH2 4.04Å; M676-W691 HydrophobicContact CG-CZ3 3.76Å; F679-W691 HydrophobicContact CB-CB 4.3Å; F679-W691 HydrophobicContact CB-CE3 3.88Å; M680-W691 HydrophobicContact CB-CD2 3.98Å; M680-W691 HydrophobicContact CB-CE3 4.11Å; M680-W691 HydrophobicContact CB-CH2 3.76Å; M680-W691 HydrophobicContact CB-CZ2 3.61Å; M680-W691 HydrophobicContact CB-CZ3 4Å; M680-W691 HydrophobicContact CG-CH2 4.12Å; M680-W691 HydrophobicContact CG-CZ2 3.57Å; M680-W691 HydrophobicContact SD-CH2 4.17Å; M680-W691 HydrophobicContact SD-CZ2 3.84Å; Y687-W691 WeakPolarHBondContact O-CB 3.31Å; Y687-W691 PolarHBondContact O-N 3.31Å; Q688-W691 PolarHBondContact O-N 3.18Å; W691-F693 VanDerWaalsContact C-N 3.29Å; W691-F693 PolarHBondContact O-N 2.99Å; W691-M694 HydrophobicContact CE3-CE 4.28Å; W691-M694 PolarHBondContact O-N 3.48Å; W691-N695 HydrophobicContact CZ2-CB 4.45Å; W691-N695 VanDerWaalsContact O-CB 3.3Å; W691-N695 WeakPolarHBondContact O-CB 2.96Å; W691-N695 PolarHBondContact O-N 2.94Å; W691-F702 HydrophobicContact CH2-CZ 4.25Å; W691-F702 HydrophobicContact CZ3-CE1 4.16Å; W691-F702 AromaticContact CZ3-CZ 3.86Å; W691-F702 HydrophobicContact CZ3-CZ 3.86Å
692	N	93.6	Very high	92.7	Very high	99 Å²	99	72.1 Å²	72.1	53%	0.529	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-38.1	178.6	-69	-18	0	0	0	111.6	Q688 R689 S696	Q688-N692 WeakPolarHBondContact O-CB 2.69Å; Q688-N692 PolarHBondContact O-N 3.28Å; Q688-N692 PolarHBondContact O-ND2 2.83Å; R689-N692 PolarHBondContact O-N 2.67Å; N692-S696 VanDerWaalsContact O-CB 3.25Å; N692-S696 WeakPolarHBondContact O-CB 3.48Å; N692-S696 PolarHBondContact O-N 2.89Å; N692-S696 VanDerWaalsContact O-N 3.09Å; N692-S696 PolarHBondContact O-OG 3.08Å
693	F	93.9	Very high	92.8	Very high	34 Å²	34	71.3 Å²	71.3	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-62.6	-52.6	171	175.9	-93.4	0	0	0	111.7	T663 Y667 R689 M690 W691 N695 S696 K697	T663-F693 HydrophobicContact CG2-CE2 4.29Å; Y667-F693 HydrophobicContact CD1-CD1 4.37Å; Y667-F693 HydrophobicContact CD1-CE1 4.03Å; Y667-F693 HydrophobicContact CD2-CD1 4.23Å; Y667-F693 HydrophobicContact CD2-CE1 4.46Å; Y667-F693 AromaticContact CE1-CD1 3.78Å; Y667-F693 HydrophobicContact CE1-CD1 3.78Å; Y667-F693 AromaticContact CE1-CE1 3.75Å; Y667-F693 HydrophobicContact CE1-CE1 3.75Å; Y667-F693 HydrophobicContact CE1-CG 4.47Å; Y667-F693 HydrophobicContact CE1-CZ 4.42Å; Y667-F693 AromaticContact CE2-CD1 3.6Å; Y667-F693 HydrophobicContact CE2-CD1 3.6Å; Y667-F693 HydrophobicContact CE2-CE1 4.19Å; Y667-F693 HydrophobicContact CE2-CG 4.42Å; Y667-F693 HydrophobicContact CG-CE1 4.4Å; Y667-F693 AromaticContact CZ-CD1 3.37Å; Y667-F693 AromaticContact CZ-CE1 3.85Å; Y667-F693 AromaticContact CZ-CG 3.94Å; R689-F693 PolarHBondContact O-N 3.26Å; M690-F693 PolarHBondContact O-N 3.38Å; W691-F693 VanDerWaalsContact C-N 3.29Å; W691-F693 PolarHBondContact O-N 2.99Å; F693-N695 VanDerWaalsContact C-N 3.31Å; F693-N695 PolarHBondContact O-N 2.68Å; F693-S696 PolarHBondContact O-N 3.02Å; F693-S696 PolarHBondContact O-OG 3.26Å; F693-K697 HydrophobicContact CZ-CD 4.4Å; F693-K697 VanDerWaalsContact O-CB 3.27Å; F693-K697 WeakPolarHBondContact O-CB 3.27Å; F693-K697 PolarHBondContact O-N 3.07Å
694	M	94.8	Very high	92.7	Very high	2 Å²	2	68.7 Å²	68.7	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-38.1	-178.2	-70.6	-174.4	-72.5	0	0	112.8	Y667 T669 F679 M690 W691 V701 F702 L721	Y667-M694 HydrophobicContact CD2-CG 3.89Å; Y667-M694 HydrophobicContact CD2-SD 4.12Å; Y667-M694 HydrophobicContact CE2-CG 3.92Å; Y667-M694 HydrophobicContact CE2-SD 4.47Å; T669-M694 HydrophobicContact CG2-SD 4.36Å; F679-M694 HydrophobicContact CB-CE 3.83Å; F679-M694 HydrophobicContact CD1-CE 4.19Å; F679-M694 HydrophobicContact CD2-CE 3.94Å; F679-M694 HydrophobicContact CG-CE 3.73Å; M690-M694 HydrophobicContact CB-CE 4.37Å; M690-M694 VanDerWaalsContact O-CG 3.31Å; M690-M694 WeakPolarHBondContact O-CG 3.26Å; M690-M694 PolarHBondContact O-N 3.27Å; W691-M694 HydrophobicContact CE3-CE 4.28Å; W691-M694 PolarHBondContact O-N 3.48Å; M694-V701 HydrophobicContact CB-CG2 3.77Å; M694-V701 HydrophobicContact CG-CG2 3.92Å; M694-V701 WeakPolarHBondContact O-CG2 3.02Å; M694-F702 HydrophobicContact CB-CE1 4.29Å; M694-F702 HydrophobicContact CB-CE2 4.41Å; M694-F702 HydrophobicContact CB-CZ 3.79Å; M694-F702 WeakPolarHBondContact O-CE2 3.25Å; M694-F702 HydrophobicContact SD-CE1 4.49Å; M694-L721 HydrophobicContact SD-CD1 4.31Å
695	N	93.2	Very high	92.5	Very high	105 Å²	105	64.8 Å²	64.8	56%	0.561	33%	0.329	S	S	*	.	H	α-helix	trans	-79.1	-28.5	-178.6	-167.7	43.4	0	0	0	113.5	W691 F693	W691-N695 HydrophobicContact CZ2-CB 4.45Å; W691-N695 VanDerWaalsContact O-CB 3.3Å; W691-N695 WeakPolarHBondContact O-CB 2.96Å; W691-N695 PolarHBondContact O-N 2.94Å; F693-N695 VanDerWaalsContact C-N 3.31Å; F693-N695 PolarHBondContact O-N 2.68Å
696	S	93.1	Very high	92.3	Very high	91 Å²	91	59.5 Å²	59.5	64%	0.636	31%	0.305	S	S	*	.	H	α-helix	trans	-91.2	-19	-179.5	61.6	0	0	0	0	114.5	N692 F693 Q698	N692-S696 VanDerWaalsContact O-CB 3.25Å; N692-S696 WeakPolarHBondContact O-CB 3.48Å; N692-S696 PolarHBondContact O-N 2.89Å; N692-S696 VanDerWaalsContact O-N 3.09Å; N692-S696 PolarHBondContact O-OG 3.08Å; F693-S696 PolarHBondContact O-N 3.02Å; F693-S696 PolarHBondContact O-OG 3.26Å; S696-Q698 PolarHBondContact O-N 2.93Å
697	K	91.3	Very high	92.2	Very high	68 Å²	68	63.4 Å²	63.4	30%	0.296	32%	0.323	S	S	.	.			trans	-72.9	127.2	-175.3	-175	70.2	177.2	-167.1	0	112.2	E666 F693 V701	E666-K697 WeakPolarHBondContact OE1-CE 3.44Å; E666-K697 IonicContact OE1-NZ 2.73Å; E666-K697 PolarHBondContact OE1-NZ 3.12Å; F693-K697 HydrophobicContact CZ-CD 4.4Å; F693-K697 VanDerWaalsContact O-CB 3.27Å; F693-K697 WeakPolarHBondContact O-CB 3.27Å; F693-K697 PolarHBondContact O-N 3.07Å; K697-V701 HydrophobicContact CB-CG1 4.11Å; K697-V701 HydrophobicContact CG-CG1 3.74Å
698	Q	88.2	Confident	92.1	Very high	177 Å²	177	65.8 Å²	65.8	83%	0.827	34%	0.335	S	S	*	.	S	Bend	trans	-116.2	139.8	164.6	-63.4	-165	9.9	0	0	110.6	S696	S696-Q698 PolarHBondContact O-N 2.93Å
699	P	88.4	Confident	92	Very high	97 Å²	97	62.4 Å²	62.4	63%	0.63	32%	0.319	S	S	*	.	S	Bend	cis	-64.4	159.8	-6.1	31.1	-37	0	0	0	112.3	V701	P699-V701 PolarHBondContact O-N 2.92Å
700	S	92.6	Very high	92	Very high	66 Å²	66	58.5 Å²	58.5	46%	0.462	31%	0.306	S	S	.	.			trans	-52.2	134.8	-175.6	-178.8	0	0	0	0	112.2	F702 R712	S700-F702 PolarHBondContact OG-N 2.93Å; S700-F702 VanDerWaalsContact OG-N 3.17Å; S700-R712 PolarHBondContact O-NH1 3.18Å; S700-R712 PolarHBondContact O-NH2 3.4Å
701	V	94	Very high	92	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.323	C	S	.	.			trans	-85.1	-15.5	171.7	-63.2	0	0	0	0	112.7	Y667 M694 K697 P699 Y718	Y667-V701 VanDerWaalsContact O-CB 3.31Å; Y667-V701 WeakPolarHBondContact O-CB 3.42Å; Y667-V701 WeakPolarHBondContact O-CG2 3.37Å; M694-V701 HydrophobicContact CB-CG2 3.77Å; M694-V701 HydrophobicContact CG-CG2 3.92Å; M694-V701 WeakPolarHBondContact O-CG2 3.02Å; K697-V701 HydrophobicContact CB-CG1 4.11Å; K697-V701 HydrophobicContact CG-CG1 3.74Å; P699-V701 PolarHBondContact O-N 2.92Å; V701-Y718 HydrophobicContact CB-CE2 4.34Å; V701-Y718 PolarHBondContact O-OH 2.92Å
702	F	94.1	Very high	91.9	Very high	26 Å²	26	61.7 Å²	61.7	11%	0.114	33%	0.327	C	S	.	.			trans	-76.6	144.2	177.9	-55.9	-76.5	0	0	0	111.6	T669 H671 M676 W691 M694 S700	T669-F702 WeakPolarHBondContact O-CA 3.2Å; T669-F702 WeakPolarHBondContact OG1-CD1 3.46Å; T669-F702 WeakPolarHBondContact OG1-CE1 3.2Å; H671-F702 HydrophobicContact CB-CB 4.23Å; M676-F702 HydrophobicContact CE-CD1 4.37Å; M676-F702 HydrophobicContact CE-CE1 4.08Å; M676-F702 HydrophobicContact CE-CE2 4.35Å; M676-F702 HydrophobicContact CE-CZ 4.06Å; M676-F702 HydrophobicContact CG-CD1 4.33Å; M676-F702 HydrophobicContact CG-CE1 3.86Å; M676-F702 HydrophobicContact SD-CD1 4.19Å; M676-F702 HydrophobicContact SD-CE1 4.17Å; W691-F702 HydrophobicContact CH2-CZ 4.25Å; W691-F702 HydrophobicContact CZ3-CE1 4.16Å; W691-F702 AromaticContact CZ3-CZ 3.86Å; W691-F702 HydrophobicContact CZ3-CZ 3.86Å; M694-F702 HydrophobicContact CB-CE1 4.29Å; M694-F702 HydrophobicContact CB-CE2 4.41Å; M694-F702 HydrophobicContact CB-CZ 3.79Å; M694-F702 WeakPolarHBondContact O-CE2 3.25Å; M694-F702 HydrophobicContact SD-CE1 4.49Å; S700-F702 PolarHBondContact OG-N 2.93Å; S700-F702 VanDerWaalsContact OG-N 3.17Å
703	V	92.4	Very high	91.9	Very high	1 Å²	1	57 Å²	57	1%	0.006	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-116.3	156.2	178	-63.7	0	0	0	0	111.1	T669 M670 H671 E708 Y720	T669-V703 PolarHBondContact O-N 2.86Å; T669-V703 VanDerWaalsContact O-N 3.15Å; M670-V703 WeakPolarHBondContact CA-O 3.38Å; H671-V703 PolarHBondContact N-O 2.96Å; V703-E708 HydrophobicContact CB-CB 4.32Å; V703-E708 HydrophobicContact CB-CG 4.08Å; V703-E708 HydrophobicContact CG1-CG 4.06Å; V703-Y720 HydrophobicContact CG2-CD2 4.36Å; V703-Y720 HydrophobicContact CG2-CE2 3.47Å; V703-Y720 VanDerWaalsContact CG2-CE2 3.47Å
704	K	88.4	Confident	91.8	Very high	181 Å²	181	57.8 Å²	57.8	79%	0.787	31%	0.307	S	S	*	.	S	Bend	trans	-87.2	-32.6	-179.4	-62.8	-179	-179	179.8	0	112.8	E708	K704-E708 WeakPolarHBondContact CB-OE2 3.47Å; K704-E708 PolarHBondContact N-OE2 3.45Å
705	S	88.1	Confident	91.7	Very high	42 Å²	42	64.2 Å²	64.2	29%	0.294	34%	0.342	S	S	.	.	S	Bend	trans	-129.1	160	179.1	71	0	0	0	0	112.8	E707 E708 G709	S705-E707 VanDerWaalsContact C-N 3.3Å; S705-E707 PolarHBondContact O-N 2.93Å; S705-E708 PolarHBondContact O-N 3.38Å; S705-E708 WeakPolarHBondContact OG-CB 3.38Å; S705-E708 PolarHBondContact OG-N 3.21Å; S705-G709 PolarHBondContact O-N 3.02Å; S705-G709 VanDerWaalsContact O-N 3.15Å
706	T	89.6	Confident	91.4	Very high	13 Å²	13	61.4 Å²	61.4	8%	0.08	33%	0.33	C	S	.	.	H	α-helix	trans	-65.7	-36.8	177.6	-60.6	0	0	0	0	111	M670 G709 I710 Y720 L722 Y730	M670-T706 WeakPolarHBondContact CE-OG1 3.41Å; T706-G709 PolarHBondContact O-N 3.29Å; T706-I710 HydrophobicContact CG2-CD1 3.97Å; T706-I710 WeakPolarHBondContact O-CD1 3.36Å; T706-I710 VanDerWaalsContact O-CG1 3.29Å; T706-I710 WeakPolarHBondContact O-CG1 3.2Å; T706-I710 PolarHBondContact O-N 3.16Å; T706-Y720 HydrophobicContact CG2-CE1 4.37Å; T706-L722 HydrophobicContact CG2-CD1 4.41Å; T706-Y730 HydrophobicContact CG2-CD2 4.42Å; T706-Y730 HydrophobicContact CG2-CE2 3.75Å
707	E	90	Very high	91.2	Very high	93 Å²	93	60.6 Å²	60.6	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-65.1	-40.5	176.9	-63.2	69.4	-153.4	0	0	111.9	S705 I710 A711 Y730	S705-E707 VanDerWaalsContact C-N 3.3Å; S705-E707 PolarHBondContact O-N 2.93Å; E707-I710 PolarHBondContact O-N 2.99Å; E707-A711 WeakPolarHBondContact O-CB 3.43Å; E707-A711 PolarHBondContact O-N 3.4Å; E707-Y730 PolarHBondContact OE1-OH 3.06Å
708	E	92.2	Very high	91.3	Very high	88 Å²	88	57.4 Å²	57.4	41%	0.411	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-43.9	173.4	-178.3	-175.4	-168.3	0	0	111	V703 K704 S705 A711 R712	V703-E708 HydrophobicContact CB-CB 4.32Å; V703-E708 HydrophobicContact CB-CG 4.08Å; V703-E708 HydrophobicContact CG1-CG 4.06Å; K704-E708 WeakPolarHBondContact CB-OE2 3.47Å; K704-E708 PolarHBondContact N-OE2 3.45Å; S705-E708 PolarHBondContact O-N 3.38Å; S705-E708 WeakPolarHBondContact OG-CB 3.38Å; S705-E708 PolarHBondContact OG-N 3.21Å; E708-A711 PolarHBondContact O-N 2.88Å; E708-R712 WeakPolarHBondContact O-CB 3.1Å; E708-R712 PolarHBondContact O-N 3.37Å
709	G	92.5	Very high	91.6	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.1	-49.6	174	0	0	0	0	0	112.8	S705 T706 A711 R712 V713	S705-G709 PolarHBondContact O-N 3.02Å; S705-G709 VanDerWaalsContact O-N 3.15Å; T706-G709 PolarHBondContact O-N 3.29Å; G709-A711 PolarHBondContact O-N 3.45Å; G709-R712 PolarHBondContact O-N 3.5Å; G709-V713 WeakPolarHBondContact O-CG2 3.07Å; G709-V713 PolarHBondContact O-N 3.29Å
710	I	93	Very high	91.9	Very high	16 Å²	16	44.5 Å²	44.5	8%	0.082	24%	0.236	C	C	.	.	H	α-helix	trans	-63.1	-43.3	178.6	-66	159.1	0	0	0	111.3	M525 T706 E707 R712 V713 L714 Y730 L737	M525-I710 HydrophobicContact CE-CG1 4.42Å; M525-I710 HydrophobicContact SD-CG1 3.89Å; T706-I710 HydrophobicContact CG2-CD1 3.97Å; T706-I710 WeakPolarHBondContact O-CD1 3.36Å; T706-I710 VanDerWaalsContact O-CG1 3.29Å; T706-I710 WeakPolarHBondContact O-CG1 3.2Å; T706-I710 PolarHBondContact O-N 3.16Å; E707-I710 PolarHBondContact O-N 2.99Å; I710-R712 VanDerWaalsContact C-N 3.31Å; I710-R712 PolarHBondContact O-N 2.96Å; I710-V713 PolarHBondContact O-N 2.99Å; I710-L714 HydrophobicContact CG2-CD1 4.08Å; I710-L714 WeakPolarHBondContact O-CG 3.48Å; I710-L714 PolarHBondContact O-N 3.2Å; I710-L714 VanDerWaalsContact O-N 3.16Å; I710-Y730 HydrophobicContact CD1-CD1 3.57Å; I710-Y730 HydrophobicContact CD1-CD2 3.5Å; I710-Y730 HydrophobicContact CD1-CE1 3.74Å; I710-Y730 HydrophobicContact CD1-CE2 3.68Å; I710-Y730 HydrophobicContact CD1-CG 3.45Å; I710-Y730 VanDerWaalsContact CD1-CG 3.45Å; I710-L737 HydrophobicContact CG2-CD1 4.03Å
711	A	93.1	Very high	92	Very high	43 Å²	43	41.4 Å²	41.4	36%	0.355	22%	0.215	S	C	.	.	H	α-helix	trans	-61.9	-38.3	176.2	0	0	0	0	0	111.9	E707 E708 G709 N715	E707-A711 WeakPolarHBondContact O-CB 3.43Å; E707-A711 PolarHBondContact O-N 3.4Å; E708-A711 PolarHBondContact O-N 2.88Å; G709-A711 PolarHBondContact O-N 3.45Å; A711-N715 WeakPolarHBondContact O-CB 3.44Å; A711-N715 VanDerWaalsContact O-CG 3.31Å; A711-N715 PolarHBondContact O-N 3.3Å; A711-N715 PolarHBondContact O-ND2 3.36Å
712	R	94.2	Very high	92	Very high	54 Å²	54	41.9 Å²	41.9	20%	0.204	22%	0.217	C	C	.	.	H	α-helix	trans	-64.1	-46.3	174.9	-167.4	175.4	176.3	157.9	-1.7	111.6	E666 S700 E708 G709 I710 L714 N715 S716 Y718	E666-R712 IonicContact OE2-CZ 2.76Å; E666-R712 IonicContact OE2-NH2 3.93Å; E666-R712 PolarHBondContact OE2-NH2 3.44Å; S700-R712 PolarHBondContact O-NH1 3.18Å; S700-R712 PolarHBondContact O-NH2 3.4Å; E708-R712 WeakPolarHBondContact O-CB 3.1Å; E708-R712 PolarHBondContact O-N 3.37Å; G709-R712 PolarHBondContact O-N 3.5Å; I710-R712 VanDerWaalsContact C-N 3.31Å; I710-R712 PolarHBondContact O-N 2.96Å; R712-L714 VanDerWaalsContact C-N 3.31Å; R712-L714 PolarHBondContact O-N 2.95Å; R712-N715 PolarHBondContact O-N 3.13Å; R712-S716 PolarHBondContact O-N 3.29Å; R712-S716 PolarHBondContact O-OG 3.4Å; R712-S716 VanDerWaalsContact O-OG 3.13Å; R712-Y718 HydrophobicContact CB-CD1 3.89Å; R712-Y718 HydrophobicContact CB-CE1 4.22Å; R712-Y718 HydrophobicContact CG-CD1 3.63Å; R712-Y718 HydrophobicContact CG-CD2 4.38Å; R712-Y718 HydrophobicContact CG-CE1 4.14Å; R712-Y718 HydrophobicContact CG-CG 3.76Å
713	V	93.6	Very high	92	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.3	-40.1	177.5	172.9	0	0	0	0	112.7	R527 G709 I710 Y718 Y720 L737	R527-V713 HydrophobicContact CB-CG1 4.33Å; R527-V713 WeakPolarHBondContact CD-O 3.36Å; G709-V713 WeakPolarHBondContact O-CG2 3.07Å; G709-V713 PolarHBondContact O-N 3.29Å; I710-V713 PolarHBondContact O-N 2.99Å; V713-Y718 HydrophobicContact CG2-CD1 3.77Å; V713-Y718 HydrophobicContact CG2-CE1 4.23Å; V713-Y720 VanDerWaalsContact CG2-CB 3.42Å; V713-L737 HydrophobicContact CG1-CD2 3.91Å
714	L	91.6	Very high	92.1	Very high	51 Å²	51	42.3 Å²	42.3	27%	0.267	22%	0.221	S	C	.	.	H	α-helix	trans	-71.6	-39.5	-179.1	-66.9	164.9	0	0	0	112	I710 R712 N734 N736 L737	I710-L714 HydrophobicContact CG2-CD1 4.08Å; I710-L714 WeakPolarHBondContact O-CG 3.48Å; I710-L714 PolarHBondContact O-N 3.2Å; I710-L714 VanDerWaalsContact O-N 3.16Å; R712-L714 VanDerWaalsContact C-N 3.31Å; R712-L714 PolarHBondContact O-N 2.95Å; L714-N734 VanDerWaalsContact CD1-ND2 3.32Å; L714-N734 WeakPolarHBondContact CD1-ND2 3.45Å; L714-N736 HydrophobicContact CD2-CB 3.81Å; L714-L737 HydrophobicContact CD2-CD2 3.7Å; L714-L737 HydrophobicContact CD2-CG 4.26Å; L714-L737 HydrophobicContact CG-CD2 4.1Å
715	N	91.6	Very high	92.2	Very high	137 Å²	137	33.9 Å²	33.9	73%	0.733	19%	0.185	S	C	*	.	H	α-helix	trans	-88.7	-25.7	-170.5	-68.6	-33	0	0	0	114.3	A711 R712	A711-N715 WeakPolarHBondContact O-CB 3.44Å; A711-N715 VanDerWaalsContact O-CG 3.31Å; A711-N715 PolarHBondContact O-N 3.3Å; A711-N715 PolarHBondContact O-ND2 3.36Å; R712-N715 PolarHBondContact O-N 3.13Å
716	S	88.3	Confident	92.4	Very high	45 Å²	45	32.2 Å²	32.2	32%	0.315	17%	0.172	S	C	.	.	S	Bend	trans	-131.5	176.3	-176.7	73.4	0	0	0	0	113.7	R712 Y718	R712-S716 PolarHBondContact O-N 3.29Å; R712-S716 PolarHBondContact O-OG 3.4Å; R712-S716 VanDerWaalsContact O-OG 3.13Å; S716-Y718 PolarHBondContact O-N 3.37Å; S716-Y718 WeakPolarHBondContact OG-CB 3.35Å
717	N	88.9	Confident	92.5	Very high	75 Å²	75	31.6 Å²	31.6	40%	0.401	17%	0.169	S	C	.	.	S	Bend	trans	-79.1	68.5	170.3	-79.4	-15.6	0	0	0	109.8	R527 E666	R527-N717 PolarHBondContact NH2-OD1 3.01Å; E666-N717 PolarHBondContact N-O 2.92Å
718	Y	93.3	Very high	92.6	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	134.9	-177.5	175.8	-99.7	0	0	0	110.9	Y526 E666 G668 V701 R712 V713 S716 Y720	Y526-Y718 WeakPolarHBondContact CD2-O 3.28Å; E666-Y718 HydrophobicContact CB-CD2 3.86Å; E666-Y718 CarbonylContact O-C 3.51Å; E666-Y718 VanDerWaalsContact O-CA 3.27Å; E666-Y718 WeakPolarHBondContact O-CA 3.22Å; G668-Y718 WeakPolarHBondContact CA-OH 3.34Å; G668-Y718 PolarHBondContact N-OH 3.24Å; G668-Y718 PolarHBondContact O-OH 3.15Å; V701-Y718 HydrophobicContact CB-CE2 4.34Å; V701-Y718 PolarHBondContact O-OH 2.92Å; R712-Y718 HydrophobicContact CB-CD1 3.89Å; R712-Y718 HydrophobicContact CB-CE1 4.22Å; R712-Y718 HydrophobicContact CG-CD1 3.63Å; R712-Y718 HydrophobicContact CG-CD2 4.38Å; R712-Y718 HydrophobicContact CG-CE1 4.14Å; R712-Y718 HydrophobicContact CG-CG 3.76Å; V713-Y718 HydrophobicContact CG2-CD1 3.77Å; V713-Y718 HydrophobicContact CG2-CE1 4.23Å; S716-Y718 PolarHBondContact O-N 3.37Å; S716-Y718 WeakPolarHBondContact OG-CB 3.35Å; Y718-Y720 HydrophobicContact CE1-CD2 4.06Å; Y718-Y720 HydrophobicContact CE1-CG 4.31Å
719	A	93.6	Very high	92.5	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.008	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128	174.5	0	0	0	0	0	110.2	I524 Y526 L659 I665 E666 Y667 G668	I524-A719 HydrophobicContact CG2-CB 4.02Å; Y526-A719 HydrophobicContact CD2-CB 3.92Å; L659-A719 HydrophobicContact CD1-CB 4.26Å; I665-A719 HydrophobicContact CG2-CB 4.09Å; E666-A719 PolarHBondContact O-N 2.85Å; Y667-A719 WeakPolarHBondContact CA-O 3.44Å; Y667-A719 WeakPolarHBondContact CB-O 3.38Å; G668-A719 PolarHBondContact N-O 2.98Å
720	Y	95.4	Very high	92.4	Very high	3 Å²	3	28 Å²	28	1%	0.012	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.5	-176.1	-172.9	-136.8	0	0	0	110.9	M525 G668 V703 T706 V713 Y718 L722	M525-Y720 PolarHBondContact N-O 3.33Å; M525-Y720 PolarHBondContact O-N 3.3Å; G668-Y720 WeakPolarHBondContact O-CD2 3.45Å; V703-Y720 HydrophobicContact CG2-CD2 4.36Å; V703-Y720 HydrophobicContact CG2-CE2 3.47Å; V703-Y720 VanDerWaalsContact CG2-CE2 3.47Å; T706-Y720 HydrophobicContact CG2-CE1 4.37Å; V713-Y720 VanDerWaalsContact CG2-CB 3.42Å; Y718-Y720 HydrophobicContact CE1-CD2 4.06Å; Y718-Y720 HydrophobicContact CE1-CG 4.31Å; Y720-L722 HydrophobicContact CD1-CB 4.1Å; Y720-L722 HydrophobicContact CD1-CD1 3.97Å; Y720-L722 HydrophobicContact CD1-CD2 4.14Å; Y720-L722 HydrophobicContact CD1-CG 4.29Å; Y720-L722 HydrophobicContact CE1-CB 3.88Å; Y720-L722 HydrophobicContact CE1-CD1 3.87Å; Y720-L722 HydrophobicContact CE1-CG 4.35Å
721	L	95.1	Very high	92.2	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	107.9	178.4	-74	155.9	0	0	0	109	I522 I524 Y667 G668 T669 T675 F679 M690 M694 L744	I522-L721 HydrophobicContact CG2-CB 4.34Å; I522-L721 HydrophobicContact CG2-CD2 4.11Å; I524-L721 HydrophobicContact CG1-CD2 3.65Å; Y667-L721 HydrophobicContact CD2-CD1 4.24Å; G668-L721 PolarHBondContact O-N 3.35Å; T669-L721 HydrophobicContact CG2-CB 3.59Å; T669-L721 HydrophobicContact CG2-CD1 4.19Å; T675-L721 HydrophobicContact CG2-CB 4.47Å; F679-L721 HydrophobicContact CE2-CD1 4Å; F679-L721 HydrophobicContact CE2-CD2 4.44Å; F679-L721 HydrophobicContact CZ-CD1 4.13Å; F679-L721 HydrophobicContact CZ-CD2 4.25Å; M690-L721 HydrophobicContact CE-CD1 3.92Å; M694-L721 HydrophobicContact SD-CD1 4.31Å; L721-L744 HydrophobicContact CD2-CD1 3.83Å
722	L	93.6	Very high	91.9	Very high	10 Å²	10	30.1 Å²	30.1	5%	0.052	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	164.8	-177.4	81.9	171.6	0	0	0	112.3	S523 M525 T706 Y720 M726 N727	S523-L722 PolarHBondContact N-O 3.22Å; S523-L722 PolarHBondContact O-N 3.28Å; S523-L722 VanDerWaalsContact O-N 3.1Å; S523-L722 VanDerWaalsContact O-O 3.06Å; S523-L722 PolarHBondContact OG-O 2.98Å; M525-L722 HydrophobicContact CB-CD2 3.48Å; M525-L722 VanDerWaalsContact CB-CD2 3.48Å; M525-L722 HydrophobicContact CE-CD1 3.89Å; M525-L722 HydrophobicContact CE-CD2 4.14Å; T706-L722 HydrophobicContact CG2-CD1 4.41Å; Y720-L722 HydrophobicContact CD1-CB 4.1Å; Y720-L722 HydrophobicContact CD1-CD1 3.97Å; Y720-L722 HydrophobicContact CD1-CD2 4.14Å; Y720-L722 HydrophobicContact CD1-CG 4.29Å; Y720-L722 HydrophobicContact CE1-CB 3.88Å; Y720-L722 HydrophobicContact CE1-CD1 3.87Å; Y720-L722 HydrophobicContact CE1-CG 4.35Å; L722-M726 HydrophobicContact CD1-CB 3.63Å; L722-M726 HydrophobicContact CG-CB 4.22Å; L722-N727 HydrophobicContact CD2-CB 4.05Å; L722-N727 HydrophobicContact CG-CB 4.39Å
723	E	93.4	Very high	91.5	Very high	19 Å²	19	32 Å²	32	9%	0.089	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	139.7	178.8	-69.5	178.8	147	0	0	112.1	T502 L520 T725 M726 N727 Y749	T502-E723 WeakPolarHBondContact CG2-OE1 3.37Å; T502-E723 PolarHBondContact OG1-OE1 2.66Å; L520-E723 HydrophobicContact CD1-CB 3.99Å; L520-E723 HydrophobicContact CD1-CG 3.75Å; E723-T725 VanDerWaalsContact C-N 3.29Å; E723-T725 PolarHBondContact O-N 3.41Å; E723-M726 WeakPolarHBondContact O-CB 3.33Å; E723-M726 PolarHBondContact O-N 2.88Å; E723-N727 PolarHBondContact O-N 3.35Å; E723-N727 VanDerWaalsContact O-N 3.12Å; E723-Y749 VanDerWaalsContact OE2-CE1 3.24Å; E723-Y749 WeakPolarHBondContact OE2-CE1 3.4Å; E723-Y749 PolarHBondContact OE2-OH 2.91Å
724	S	93.8	Very high	91.2	Very high	17 Å²	17	34.2 Å²	34.2	12%	0.119	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-30	-169.3	56.9	0	0	0	0	114.5	G521 M726 N727 E728	G521-S724 PolarHBondContact N-OG 3.02Å; G521-S724 WeakPolarHBondContact O-CB 3.22Å; G521-S724 PolarHBondContact O-N 3.41Å; G521-S724 PolarHBondContact O-OG 3.37Å; S724-M726 VanDerWaalsContact C-N 3.33Å; S724-N727 PolarHBondContact O-N 2.95Å; S724-E728 WeakPolarHBondContact O-CB 3.48Å; S724-E728 PolarHBondContact O-N 3.32Å
725	T	92.4	Very high	90.9	Very high	3 Å²	3	35 Å²	35	2%	0.018	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-41.8	172.8	49.1	0	0	0	0	111.6	Y428 M518 L520 E723 Y729 Y749 W784	Y428-T725 WeakPolarHBondContact OH-CB 3.33Å; Y428-T725 PolarHBondContact OH-OG1 3.49Å; M518-T725 HydrophobicContact CG-CG2 4.26Å; M518-T725 HydrophobicContact SD-CG2 3.55Å; M518-T725 VanDerWaalsContact SD-CG2 3.55Å; L520-T725 HydrophobicContact CB-CG2 3.87Å; L520-T725 HydrophobicContact CD2-CG2 4.36Å; E723-T725 VanDerWaalsContact C-N 3.29Å; E723-T725 PolarHBondContact O-N 3.41Å; T725-Y729 WeakPolarHBondContact O-CB 3.36Å; T725-Y729 PolarHBondContact O-N 3.41Å; T725-Y729 VanDerWaalsContact O-N 3.08Å; T725-Y749 HydrophobicContact CG2-CE2 4.45Å; T725-Y749 PolarHBondContact OG1-OH 3.1Å; T725-W784 PolarHBondContact O-NE1 3.43Å
726	M	91.6	Very high	90.7	Very high	7 Å²	7	33.1 Å²	33.1	3%	0.034	17%	0.167	C	C	.	.	H	α-helix	trans	-67.9	-44.9	173.3	-65.3	-61.3	-165	0	0	111.9	E425 Y428 L722 E723 S724 E728 Y729 Y730	E425-M726 HydrophobicContact CG-CE 3.52Å; E425-M726 WeakPolarHBondContact OE1-CE 3.37Å; E425-M726 WeakPolarHBondContact OE2-CE 3.41Å; Y428-M726 HydrophobicContact CD2-CE 3.93Å; Y428-M726 HydrophobicContact CE2-CE 3.41Å; Y428-M726 VanDerWaalsContact CE2-CE 3.41Å; Y428-M726 HydrophobicContact CE2-SD 3.84Å; L722-M726 HydrophobicContact CD1-CB 3.63Å; L722-M726 HydrophobicContact CG-CB 4.22Å; E723-M726 WeakPolarHBondContact O-CB 3.33Å; E723-M726 PolarHBondContact O-N 2.88Å; S724-M726 VanDerWaalsContact C-N 3.33Å; M726-E728 VanDerWaalsContact C-N 3.32Å; M726-E728 PolarHBondContact O-N 3.18Å; M726-Y729 WeakPolarHBondContact O-CB 3.49Å; M726-Y729 PolarHBondContact O-N 2.98Å; M726-Y730 HydrophobicContact CB-CD2 4.48Å; M726-Y730 VanDerWaalsContact O-CD2 3.27Å; M726-Y730 WeakPolarHBondContact O-CD2 3.37Å; M726-Y730 PolarHBondContact O-N 3.37Å; M726-Y730 HydrophobicContact SD-CE2 4.35Å
727	N	92.1	Very high	90.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.5	-45	178.8	-163.4	-6.8	0	0	0	110.9	S523 I524 M525 L722 E723 S724 Y729 R731	S523-N727 WeakPolarHBondContact OG-CB 3.46Å; S523-N727 PolarHBondContact OG-ND2 2.92Å; I524-N727 PolarHBondContact O-ND2 3.03Å; M525-N727 HydrophobicContact CE-CB 4.28Å; M525-N727 WeakPolarHBondContact CE-OD1 3.26Å; L722-N727 HydrophobicContact CD2-CB 4.05Å; L722-N727 HydrophobicContact CG-CB 4.39Å; E723-N727 PolarHBondContact O-N 3.35Å; E723-N727 VanDerWaalsContact O-N 3.12Å; S724-N727 PolarHBondContact O-N 2.95Å; N727-Y729 PolarHBondContact O-N 2.89Å; N727-R731 WeakPolarHBondContact O-CB 3.41Å; N727-R731 PolarHBondContact O-N 3.04Å
728	E	90.9	Very high	90.7	Very high	59 Å²	59	28.9 Å²	28.9	28%	0.276	14%	0.142	S	C	.	.	H	α-helix	trans	-56.5	-50.1	172.8	-171.2	-178.7	-178.6	0	0	111.8	S724 M726 Y730 Q732 K780	S724-E728 WeakPolarHBondContact O-CB 3.48Å; S724-E728 PolarHBondContact O-N 3.32Å; M726-E728 VanDerWaalsContact C-N 3.32Å; M726-E728 PolarHBondContact O-N 3.18Å; E728-Y730 PolarHBondContact O-N 2.9Å; E728-Q732 WeakPolarHBondContact O-CG 3.49Å; E728-Q732 PolarHBondContact O-N 3.49Å; E728-Q732 VanDerWaalsContact O-N 3.16Å; E728-K780 IonicContact OE2-NZ 3.84Å; E728-K780 PolarHBondContact OE2-NZ 2.89Å
729	Y	91.3	Very high	90.5	Very high	18 Å²	18	31.6 Å²	31.6	7%	0.071	16%	0.155	C	C	.	.	H	α-helix	trans	-58.3	-48.2	-178.6	179	-103.2	0	0	0	113.4	N426 P427 T725 M726 N727 R733	N426-Y729 HydrophobicContact CB-CE1 3.93Å; P427-Y729 HydrophobicContact CB-CD2 3.97Å; P427-Y729 HydrophobicContact CB-CE2 3.39Å; P427-Y729 HydrophobicContact CG-CD2 3.5Å; P427-Y729 HydrophobicContact CG-CE2 3.5Å; P427-Y729 VanDerWaalsContact CG-CE2 3.5Å; P427-Y729 HydrophobicContact CG-CG 4.21Å; T725-Y729 WeakPolarHBondContact O-CB 3.36Å; T725-Y729 PolarHBondContact O-N 3.41Å; T725-Y729 VanDerWaalsContact O-N 3.08Å; M726-Y729 WeakPolarHBondContact O-CB 3.49Å; M726-Y729 PolarHBondContact O-N 2.98Å; N727-Y729 PolarHBondContact O-N 2.89Å; Y729-R733 VanDerWaalsContact CD2-NH1 3.27Å; Y729-R733 PolarHBondContact O-NH1 2.9Å; Y729-R733 VanDerWaalsContact O-NH1 3.14Å; Y729-R733 PolarHBondContact OH-NE 2.93Å
730	Y	90.6	Very high	90.2	Very high	29 Å²	29	31.8 Å²	31.8	11%	0.114	16%	0.156	C	C	.	.	H	α-helix	trans	-78.1	-36.1	-176.8	-76	-67.4	0	0	0	112.6	T706 E707 I710 M726 E728 Q732 R733 N734	T706-Y730 HydrophobicContact CG2-CD2 4.42Å; T706-Y730 HydrophobicContact CG2-CE2 3.75Å; E707-Y730 PolarHBondContact OE1-OH 3.06Å; I710-Y730 HydrophobicContact CD1-CD1 3.57Å; I710-Y730 HydrophobicContact CD1-CD2 3.5Å; I710-Y730 HydrophobicContact CD1-CE1 3.74Å; I710-Y730 HydrophobicContact CD1-CE2 3.68Å; I710-Y730 HydrophobicContact CD1-CG 3.45Å; I710-Y730 VanDerWaalsContact CD1-CG 3.45Å; M726-Y730 HydrophobicContact CB-CD2 4.48Å; M726-Y730 VanDerWaalsContact O-CD2 3.27Å; M726-Y730 WeakPolarHBondContact O-CD2 3.37Å; M726-Y730 PolarHBondContact O-N 3.37Å; M726-Y730 HydrophobicContact SD-CE2 4.35Å; E728-Y730 PolarHBondContact O-N 2.9Å; Y730-Q732 VanDerWaalsContact C-N 3.31Å; Y730-Q732 PolarHBondContact O-N 3.3Å; Y730-R733 PolarHBondContact O-N 2.95Å; Y730-N734 PolarHBondContact O-N 3.46Å
731	R	88.8	Confident	89.8	Confident	64 Å²	64	33.3 Å²	33.3	24%	0.242	17%	0.173	C	C	.	.	H	α-helix	trans	-60.9	-37.7	173.7	-178.3	172.6	70.6	128.1	1.5	112.5	N727 R733 E792	N727-R731 WeakPolarHBondContact O-CB 3.41Å; N727-R731 PolarHBondContact O-N 3.04Å; R731-R733 PolarHBondContact O-N 3.35Å; R731-E792 IonicContact CZ-OE2 3.71Å; R731-E792 VanDerWaalsContact NH1-CD 3.34Å; R731-E792 IonicContact NH1-OE1 3.03Å; R731-E792 PolarHBondContact NH1-OE1 3.07Å; R731-E792 IonicContact NH1-OE2 2.7Å; R731-E792 PolarHBondContact NH1-OE2 3.34Å; R731-E792 IonicContact NH2-OE2 3.3Å
732	Q	85.4	Confident	89.4	Confident	39 Å²	39	36 Å²	36	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-27.6	174.8	-73.6	-168	44.7	0	0	113	E728 Y730 W784 G787 K788 C789	E728-Q732 WeakPolarHBondContact O-CG 3.49Å; E728-Q732 PolarHBondContact O-N 3.49Å; E728-Q732 VanDerWaalsContact O-N 3.16Å; Y730-Q732 VanDerWaalsContact C-N 3.31Å; Y730-Q732 PolarHBondContact O-N 3.3Å; Q732-W784 PolarHBondContact OE1-O 3.36Å; Q732-W784 VanDerWaalsContact OE1-O 3.07Å; Q732-G787 CarbonylContact O-C 3.54Å; Q732-G787 WeakPolarHBondContact O-CA 3.49Å; Q732-K788 PolarHBondContact O-N 3.46Å; Q732-C789 WeakPolarHBondContact O-CB 3.33Å; Q732-C789 PolarHBondContact O-N 3Å; Q732-C789 PolarHBondContact O-SG 3.26Å
733	R	87.4	Confident	89.3	Confident	93 Å²	93	39.8 Å²	39.8	35%	0.351	22%	0.221	S	C	.	.	H	α-helix	trans	-92.5	-33.6	-177.5	-73.6	164.1	175.8	65.6	4	113.2	Y729 Y730 R731 W783 W784	Y729-R733 VanDerWaalsContact CD2-NH1 3.27Å; Y729-R733 PolarHBondContact O-NH1 2.9Å; Y729-R733 VanDerWaalsContact O-NH1 3.14Å; Y729-R733 PolarHBondContact OH-NE 2.93Å; Y730-R733 PolarHBondContact O-N 2.95Å; R731-R733 PolarHBondContact O-N 3.35Å; R733-W783 PolarHBondContact NH2-O 3.37Å; R733-W784 PolarHBondContact NH1-O 3.04Å
734	N	86.6	Confident	89.2	Confident	48 Å²	48	40.1 Å²	40.1	26%	0.257	22%	0.223	S	C	.	.			trans	-125.8	106.8	-179.1	-175.9	-5.9	0	0	0	111.3	L714 Y730 N736 L737	L714-N734 VanDerWaalsContact CD1-ND2 3.32Å; L714-N734 WeakPolarHBondContact CD1-ND2 3.45Å; Y730-N734 PolarHBondContact O-N 3.46Å; N734-N736 PolarHBondContact O-N 3.37Å; N734-N736 VanDerWaalsContact O-N 3.15Å; N734-N736 WeakPolarHBondContact OD1-CB 3.48Å; N734-N736 PolarHBondContact OD1-N 3.34Å; N734-N736 VanDerWaalsContact OD1-N 3.17Å; N734-L737 HydrophobicContact CB-CD1 3.97Å; N734-L737 HydrophobicContact CB-CG 4.3Å; N734-L737 PolarHBondContact O-N 3.44Å; N734-L737 VanDerWaalsContact O-N 3.17Å
735	C	85.9	Confident	89.1	Confident	67 Å²	67	40.4 Å²	40.4	45%	0.453	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	1.5	-171.4	-30.7	0	0	0	0	113.5	L737 C789	C735-L737 VanDerWaalsContact C-N 3.29Å; C735-C789 WeakPolarHBondContact CA-SG 3.31Å; C735-C789 HydrophobicContact CB-CB 3.94Å; C735-C789 WeakPolarHBondContact CB-SG 3.25Å; C735-C789 PolarHBondContact N-SG 3.43Å; C735-C789 WeakPolarHBondContact SG-CA 3.22Å; C735-C789 WeakPolarHBondContact SG-CB 3.44Å; C735-C789 CovalentContact SG-SG 2.04Å; C735-C789 PolarHBondContact SG-SG 3.16Å
736	N	87.3	Confident	89	Confident	97 Å²	97	46.7 Å²	46.7	52%	0.519	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-0.2	170.7	-63.7	-15.1	0	0	0	112	R527 V528 L714 N734	R527-N736 CarbonylContact C-O 3.49Å; R527-N736 VanDerWaalsContact CA-O 3.29Å; R527-N736 WeakPolarHBondContact CA-O 3.45Å; V528-N736 PolarHBondContact N-O 2.98Å; L714-N736 HydrophobicContact CD2-CB 3.81Å; N734-N736 PolarHBondContact O-N 3.37Å; N734-N736 VanDerWaalsContact O-N 3.15Å; N734-N736 WeakPolarHBondContact OD1-CB 3.48Å; N734-N736 PolarHBondContact OD1-N 3.34Å; N734-N736 VanDerWaalsContact OD1-N 3.17Å
737	L	89.2	Confident	89	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.026	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	145.3	177.6	-58.7	173.4	0	0	0	111.1	M525 I710 V713 L714 N734 C735	M525-L737 HydrophobicContact CE-CD1 4.14Å; M525-L737 HydrophobicContact CG-CB 4.48Å; M525-L737 HydrophobicContact CG-CD2 4.13Å; M525-L737 HydrophobicContact SD-CD1 3.85Å; M525-L737 HydrophobicContact SD-CD2 4Å; M525-L737 HydrophobicContact SD-CG 4.4Å; I710-L737 HydrophobicContact CG2-CD1 4.03Å; V713-L737 HydrophobicContact CG1-CD2 3.91Å; L714-L737 HydrophobicContact CD2-CD2 3.7Å; L714-L737 HydrophobicContact CD2-CG 4.26Å; L714-L737 HydrophobicContact CG-CD2 4.1Å; N734-L737 HydrophobicContact CB-CD1 3.97Å; N734-L737 HydrophobicContact CB-CG 4.3Å; N734-L737 PolarHBondContact O-N 3.44Å; N734-L737 VanDerWaalsContact O-N 3.17Å; C735-L737 VanDerWaalsContact C-N 3.29Å
738	T	87.6	Confident	89	Confident	26 Å²	26	48.2 Å²	48.2	16%	0.16	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	147.3	178.7	20	0	0	0	0	109.9	Y526 V528	Y526-T738 PolarHBondContact N-O 3.13Å; Y526-T738 PolarHBondContact O-N 3.04Å; Y526-T738 VanDerWaalsContact O-O 3.08Å; Y526-T738 PolarHBondContact O-OG1 3.15Å; V528-T738 WeakPolarHBondContact CA-OG1 3.45Å; V528-T738 HydrophobicContact CB-CG2 4.49Å; V528-T738 HydrophobicContact CG2-CG2 3.55Å; V528-T738 PolarHBondContact N-OG1 3.26Å
739	Q	89.4	Confident	89.3	Confident	57 Å²	57	45.4 Å²	45.4	27%	0.266	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	133.7	166.1	179.3	179.5	-31	0	0	108.9	I524 G741	I524-Q739 VanDerWaalsContact O-CA 3.32Å; I524-Q739 WeakPolarHBondContact O-CA 3.38Å; Q739-G741 PolarHBondContact NE2-O 3.16Å
740	I	87.1	Confident	89.5	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.1	169.5	-62.1	178.2	0	0	0	108.6	I524 Y526 I653	I524-I740 HydrophobicContact CB-CB 4.15Å; I524-I740 HydrophobicContact CG2-CB 4.07Å; I524-I740 HydrophobicContact CG2-CD1 4.45Å; I524-I740 PolarHBondContact O-N 2.95Å; Y526-I740 HydrophobicContact CD1-CD1 3.7Å; Y526-I740 HydrophobicContact CG-CD1 3.87Å; I653-I740 HydrophobicContact CB-CD1 4.27Å; I653-I740 HydrophobicContact CB-CG2 4.39Å; I653-I740 HydrophobicContact CG2-CG2 3.86Å; I653-I740 WeakPolarHBondContact O-CG2 3.44Å
741	G	85.9	Confident	89.7	Confident	36 Å²	36	43.2 Å²	43.2	37%	0.371	25%	0.248	S	C	.	.	S	Bend	trans	66.8	-173.1	175.8	0	0	0	0	0	115.3	Q739	Q739-G741 PolarHBondContact NE2-O 3.16Å
742	G	87.8	Confident	90.1	Very high	57 Å²	57	40.1 Å²	40.1	59%	0.588	24%	0.237	S	C	*	.	S	Bend	trans	-82.2	-165.6	174.5	0	0	0	0	0	113.4
743	L	91.3	Very high	90.5	Very high	90 Å²	90	38.3 Å²	38.3	47%	0.471	23%	0.228	S	C	.	.			trans	-78.3	134.1	167.9	-56.4	179.5	0	0	0	109.4
744	L	91.1	Very high	90.5	Very high	25 Å²	25	34 Å²	34	13%	0.131	21%	0.212	C	C	.	.	S	Bend	trans	-75.7	-27.1	179.5	-86.4	162.1	0	0	0	113.8	I522 V656 F679 Y687 L721	I522-L744 HydrophobicContact CB-CB 4.05Å; I522-L744 HydrophobicContact CB-CD1 4.1Å; I522-L744 HydrophobicContact CG2-CD1 3.8Å; I522-L744 PolarHBondContact O-N 3.48Å; V656-L744 HydrophobicContact CB-CD2 3.97Å; V656-L744 HydrophobicContact CG1-CD2 3.93Å; V656-L744 HydrophobicContact CG2-CD1 4.17Å; V656-L744 HydrophobicContact CG2-CD2 3.5Å; V656-L744 VanDerWaalsContact CG2-CD2 3.5Å; V656-L744 HydrophobicContact CG2-CG 3.91Å; F679-L744 HydrophobicContact CZ-CD1 4.39Å; Y687-L744 HydrophobicContact CE1-CD2 3.53Å; Y687-L744 WeakPolarHBondContact OH-CD2 3.33Å; Y687-L744 PolarHBondContact OH-O 3.35Å; L721-L744 HydrophobicContact CD2-CD1 3.83Å
745	D	90.9	Very high	90.4	Very high	24 Å²	24	34.8 Å²	34.8	13%	0.128	22%	0.216	C	C	.	.	S	Bend	trans	-150	176.6	179.8	63.3	2.9	0	0	0	110.5	G521 I522 F678 K747	G521-D745 WeakPolarHBondContact CA-O 3.41Å; G521-D745 WeakPolarHBondContact CA-OD1 3.39Å; I522-D745 VanDerWaalsContact CD1-OD2 3.3Å; I522-D745 WeakPolarHBondContact CD1-OD2 3.24Å; I522-D745 PolarHBondContact N-OD1 2.86Å; F678-D745 HydrophobicContact CE2-CB 4.26Å; F678-D745 HydrophobicContact CZ-CB 4.26Å; D745-K747 VanDerWaalsContact OD2-CD 3.26Å; D745-K747 WeakPolarHBondContact OD2-CD 3.32Å; D745-K747 WeakPolarHBondContact OD2-CE 3.32Å; D745-K747 IonicContact OD2-NZ 3.94Å; D745-K747 PolarHBondContact OD2-NZ 2.97Å
746	T	90.6	Very high	89.9	Confident	135 Å²	135	34.2 Å²	34.2	83%	0.828	22%	0.222	S	C	*	.			trans	-121.8	115.6	172.9	55.1	0	0	0	0	109.2
747	K	91.1	Very high	89.5	Confident	31 Å²	31	30 Å²	30	14%	0.135	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	172.3	-177.9	-81.9	165	165.6	152.9	0	110	T502 T519 L520 D745	T502-K747 HydrophobicContact CG2-CB 4.09Å; T502-K747 HydrophobicContact CG2-CD 3.74Å; T502-K747 HydrophobicContact CG2-CG 4.03Å; T519-K747 WeakPolarHBondContact CA-O 3.48Å; L520-K747 HydrophobicContact CD1-CB 3.76Å; L520-K747 HydrophobicContact CD1-CD 4.5Å; L520-K747 HydrophobicContact CG-CB 4.15Å; L520-K747 PolarHBondContact N-O 3.41Å; L520-K747 PolarHBondContact O-N 2.94Å; L520-K747 VanDerWaalsContact O-O 3.08Å; D745-K747 VanDerWaalsContact OD2-CD 3.26Å; D745-K747 WeakPolarHBondContact OD2-CD 3.32Å; D745-K747 WeakPolarHBondContact OD2-CE 3.32Å; D745-K747 IonicContact OD2-NZ 3.94Å; D745-K747 PolarHBondContact OD2-NZ 2.97Å
748	G	93.8	Very high	88.9	Confident	8 Å²	8	33.3 Å²	33.3	8%	0.082	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	158.5	166	0	0	0	0	0	112.1	I503 M518	I503-G748 PolarHBondContact N-O 3.18Å; M518-G748 CarbonylContact O-C 3.57Å; M518-G748 WeakPolarHBondContact O-CA 3.35Å
749	Y	95.6	Very high	88.6	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	135.5	163.6	-58.1	-44.7	0	0	0	109.6	Y428 G500 L501 P516 F517 M518 L520 E723 T725	Y428-Y749 HydrophobicContact CE1-CD2 4.18Å; Y428-Y749 AromaticContact CE1-CE2 3.73Å; Y428-Y749 HydrophobicContact CE1-CE2 3.73Å; Y428-Y749 AromaticContact CZ-CE2 3.69Å; Y428-Y749 VanDerWaalsContact OH-CE2 3.29Å; Y428-Y749 WeakPolarHBondContact OH-CE2 3.48Å; Y428-Y749 PolarHBondContact OH-OH 2.82Å; G500-Y749 WeakPolarHBondContact O-CD1 3.47Å; G500-Y749 WeakPolarHBondContact O-CE1 3.33Å; L501-Y749 WeakPolarHBondContact O-CA 3.36Å; P516-Y749 CarbonylContact C-O 3.56Å; P516-Y749 WeakPolarHBondContact CA-O 3.46Å; F517-Y749 WeakPolarHBondContact CD1-O 3.4Å; F517-Y749 HydrophobicContact CE2-CD2 4.25Å; F517-Y749 HydrophobicContact CZ-CD2 4.24Å; F517-Y749 HydrophobicContact CZ-CG 4.22Å; F517-Y749 PolarHBondContact N-O 3.38Å; M518-Y749 HydrophobicContact CB-CD2 4.28Å; M518-Y749 PolarHBondContact O-N 2.89Å; L520-Y749 HydrophobicContact CD2-CD1 3.61Å; L520-Y749 HydrophobicContact CD2-CD2 3.51Å; L520-Y749 HydrophobicContact CD2-CE1 3.46Å; L520-Y749 VanDerWaalsContact CD2-CE1 3.46Å; L520-Y749 HydrophobicContact CD2-CE2 3.33Å; L520-Y749 HydrophobicContact CD2-CG 3.64Å; E723-Y749 VanDerWaalsContact OE2-CE1 3.24Å; E723-Y749 WeakPolarHBondContact OE2-CE1 3.4Å; E723-Y749 PolarHBondContact OE2-OH 2.91Å; T725-Y749 HydrophobicContact CG2-CE2 4.45Å; T725-Y749 PolarHBondContact OG1-OH 3.1Å
750	G	95.3	Very high	88.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	22%	0.216	C	C	.	.			trans	-125.8	163.6	171.7	0	0	0	0	0	110.6	L501	L501-G750 PolarHBondContact O-N 2.97Å
751	I	96.8	Very high	88.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	24%	0.238	C	C	.	.			trans	-77.6	124	168.6	-61.2	-178.4	0	0	0	107.2	M451 L455 L496 V498 F513 S514 F517 M753 F763 I767	M451-I751 HydrophobicContact CE-CD1 4.31Å; M451-I751 HydrophobicContact CE-CG1 4.48Å; L455-I751 HydrophobicContact CD1-CD1 3.67Å; L496-I751 HydrophobicContact CB-CG2 4.37Å; L496-I751 HydrophobicContact CD2-CG2 4.16Å; V498-I751 HydrophobicContact CG2-CD1 4.38Å; V498-I751 HydrophobicContact CG2-CG1 4.38Å; V498-I751 HydrophobicContact CG2-CG2 3.99Å; F513-I751 WeakPolarHBondContact CA-O 3.43Å; S514-I751 PolarHBondContact N-O 3.47Å; S514-I751 PolarHBondContact OG-N 2.96Å; F517-I751 HydrophobicContact CD1-CG1 4.38Å; I751-M753 HydrophobicContact CB-CE 4.27Å; I751-M753 HydrophobicContact CG2-CE 3.98Å; I751-M753 HydrophobicContact CG2-CG 4.44Å; I751-F763 HydrophobicContact CD1-CD1 4.07Å; I751-F763 HydrophobicContact CD1-CE1 4.48Å; I751-I767 HydrophobicContact CD1-CD1 3.99Å; I751-I767 HydrophobicContact CG1-CD1 4.31Å
752	G	95.3	Very high	88.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	139.9	175.6	0	0	0	0	0	111	L489 L496 A497	L489-G752 VanDerWaalsContact CD1-C 3.5Å; L496-G752 WeakPolarHBondContact CA-O 3.46Å; A497-G752 PolarHBondContact N-O 3.32Å; A497-G752 PolarHBondContact O-N 2.93Å
753	M	93.8	Very high	88.8	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.2	-179.7	-49	-170.7	-169.7	0	0	110.7	L496 I511 D512 I751 R760 F763	L496-M753 HydrophobicContact CD2-CB 4.49Å; L496-M753 HydrophobicContact CD2-CE 4.16Å; L496-M753 HydrophobicContact CD2-CG 3.7Å; L496-M753 HydrophobicContact CD2-SD 3.96Å; I511-M753 VanDerWaalsContact CB-O 3.31Å; I511-M753 WeakPolarHBondContact CB-O 3.45Å; D512-M753 HydrophobicContact CB-CB 4.41Å; D512-M753 PolarHBondContact N-O 3.46Å; D512-M753 PolarHBondContact O-N 2.83Å; I751-M753 HydrophobicContact CB-CE 4.27Å; I751-M753 HydrophobicContact CG2-CE 3.98Å; I751-M753 HydrophobicContact CG2-CG 4.44Å; M753-R760 VanDerWaalsContact SD-CA 3.56Å; M753-R760 HydrophobicContact SD-CB 3.97Å; M753-R760 HydrophobicContact SD-CG 4.36Å; M753-F763 HydrophobicContact CE-CB 3.53Å; M753-F763 HydrophobicContact CE-CD1 4.48Å; M753-F763 HydrophobicContact CE-CD2 4.24Å; M753-F763 HydrophobicContact CE-CG 3.85Å
754	P	89.1	Confident	88.9	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.019	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	144.5	170.4	-22.7	34.6	0	0	0	110.7	L489 D495 G756 S757	L489-P754 HydrophobicContact CD2-CG 4.38Å; D495-P754 WeakPolarHBondContact O-CD 3.44Å; P754-G756 PolarHBondContact O-N 2.95Å; P754-S757 VanDerWaalsContact O-CB 3.25Å; P754-S757 WeakPolarHBondContact O-CB 3.35Å; P754-S757 PolarHBondContact O-N 3.31Å; P754-S757 VanDerWaalsContact O-N 3.08Å
755	L	83.1	Confident	88.9	Confident	64 Å²	64	36.1 Å²	36.1	34%	0.335	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	132.4	179.1	-165.7	72.6	0	0	0	110.8	K211 D512	K211-L755 HydrophobicContact CD-CD2 4.09Å; D512-L755 WeakPolarHBondContact OD2-CA 3.41Å
756	G	75.6	Confident	89	Confident	55 Å²	55	35.1 Å²	35.1	57%	0.567	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	26.3	-172.7	0	0	0	0	0	113.9	D512 P754 V758	D512-G756 PolarHBondContact OD2-N 3.4Å; P754-G756 PolarHBondContact O-N 2.95Å; G756-V758 PolarHBondContact O-N 3.12Å
757	S	80.2	Confident	89.2	Confident	8 Å²	8	28.8 Å²	28.8	6%	0.056	16%	0.162	C	C	.	.			trans	-68.8	119.8	-178.3	-172.7	0	0	0	0	112.4	Y240 P754 Y759 R760	Y240-S757 PolarHBondContact OH-OG 2.89Å; P754-S757 VanDerWaalsContact O-CB 3.25Å; P754-S757 WeakPolarHBondContact O-CB 3.35Å; P754-S757 PolarHBondContact O-N 3.31Å; P754-S757 VanDerWaalsContact O-N 3.08Å; S757-Y759 PolarHBondContact O-N 3.32Å; S757-Y759 VanDerWaalsContact O-N 3.12Å; S757-Y759 PolarHBondContact OG-N 3.37Å; S757-R760 WeakPolarHBondContact O-CB 3.42Å; S757-R760 PolarHBondContact O-N 3.3Å; S757-R760 VanDerWaalsContact O-N 3.11Å
758	V	76.7	Confident	89.4	Confident	75 Å²	75	30.6 Å²	30.6	46%	0.455	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.4	175.3	-169.2	0	0	0	0	112.2	V409 G756	V409-V758 HydrophobicContact CB-CG1 4.46Å; V409-V758 HydrophobicContact CG1-CG1 3.99Å; V409-V758 HydrophobicContact CG2-CG1 3.58Å; G756-V758 PolarHBondContact O-N 3.12Å
759	Y	81.1	Confident	89.4	Confident	8 Å²	8	35.2 Å²	35.2	3%	0.031	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-14.4	-178.8	-51.4	-50.3	0	0	0	114.1	V409 L413 L418 S757 D761 E762 F763	V409-Y759 HydrophobicContact CG1-CD1 4.02Å; V409-Y759 HydrophobicContact CG1-CE1 4.49Å; L413-Y759 HydrophobicContact CD1-CD1 4.1Å; L413-Y759 HydrophobicContact CD2-CD1 3.65Å; L413-Y759 HydrophobicContact CD2-CE1 3.73Å; L413-Y759 HydrophobicContact CD2-CG 4.28Å; L413-Y759 HydrophobicContact CG-CD1 3.88Å; L413-Y759 HydrophobicContact CG-CE1 3.97Å; L418-Y759 HydrophobicContact CD2-CE2 4.1Å; S757-Y759 PolarHBondContact O-N 3.32Å; S757-Y759 VanDerWaalsContact O-N 3.12Å; S757-Y759 PolarHBondContact OG-N 3.37Å; Y759-D761 VanDerWaalsContact C-N 3.33Å; Y759-D761 PolarHBondContact O-N 3.07Å; Y759-E762 PolarHBondContact O-N 3.47Å; Y759-F763 WeakPolarHBondContact O-CD2 3.45Å; Y759-F763 PolarHBondContact O-N 3.31Å
760	R	86.9	Confident	89.4	Confident	82 Å²	82	35.4 Å²	35.4	31%	0.309	19%	0.191	S	C	.	.	H	α-helix	trans	-54.8	-47.7	-170.3	-173.1	-167	65.4	-156.3	-7.1	112.7	D512 M753 S757 F763 D764	D512-R760 IonicContact OD1-NH1 2.95Å; D512-R760 PolarHBondContact OD1-NH1 2.96Å; M753-R760 VanDerWaalsContact SD-CA 3.56Å; M753-R760 HydrophobicContact SD-CB 3.97Å; M753-R760 HydrophobicContact SD-CG 4.36Å; S757-R760 WeakPolarHBondContact O-CB 3.42Å; S757-R760 PolarHBondContact O-N 3.3Å; S757-R760 VanDerWaalsContact O-N 3.11Å; R760-F763 PolarHBondContact O-N 2.93Å; R760-D764 PolarHBondContact O-N 3.5Å
761	D	86.4	Confident	89.3	Confident	90 Å²	90	40.6 Å²	40.6	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-73.4	-32.8	-172.2	-59.8	-6.9	0	0	0	111.5	Y759 D764 L765	Y759-D761 VanDerWaalsContact C-N 3.33Å; Y759-D761 PolarHBondContact O-N 3.07Å; D761-D764 PolarHBondContact O-N 3.47Å; D761-L765 WeakPolarHBondContact O-CG 3.2Å; D761-L765 PolarHBondContact O-N 2.95Å; D761-L765 VanDerWaalsContact O-N 3.08Å
762	E	87.6	Confident	89.1	Confident	49 Å²	49	48.5 Å²	48.5	23%	0.229	25%	0.253	C	S	.	.	H	α-helix	trans	-66.2	-42.4	171.6	-67.3	-66.1	161.9	0	0	112.1	V409 L413 L459 Y759 L765 A766	V409-E762 HydrophobicContact CB-CG 4.19Å; V409-E762 HydrophobicContact CG1-CG 3.84Å; L413-E762 HydrophobicContact CD1-CB 4.22Å; L413-E762 HydrophobicContact CD1-CG 4.31Å; L459-E762 HydrophobicContact CD2-CB 4.27Å; Y759-E762 PolarHBondContact O-N 3.47Å; E762-L765 PolarHBondContact O-N 2.93Å; E762-A766 WeakPolarHBondContact O-CB 3.33Å; E762-A766 PolarHBondContact O-N 3.06Å
763	F	92.3	Very high	89.1	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.2	-35.7	175.2	-88.4	-91.8	0	0	0	112.3	L418 L455 L459 F461 L496 I751 M753 Y759 R760 A766 I767	L418-F763 HydrophobicContact CD1-CE2 4.46Å; L418-F763 HydrophobicContact CD1-CZ 4.35Å; L455-F763 HydrophobicContact CB-CE1 4.45Å; L455-F763 HydrophobicContact CD1-CD1 4.3Å; L455-F763 HydrophobicContact CD1-CE1 4.22Å; L455-F763 HydrophobicContact CD2-CD1 4.47Å; L459-F763 HydrophobicContact CD1-CD1 4.09Å; L459-F763 HydrophobicContact CD1-CD2 3.93Å; L459-F763 HydrophobicContact CD1-CE1 4.06Å; L459-F763 HydrophobicContact CD1-CE2 3.91Å; L459-F763 HydrophobicContact CD1-CG 4.03Å; L459-F763 HydrophobicContact CD1-CZ 3.97Å; F461-F763 HydrophobicContact CD1-CZ 4.29Å; F461-F763 HydrophobicContact CE1-CE1 4.05Å; F461-F763 HydrophobicContact CE1-CE2 4.5Å; F461-F763 AromaticContact CE1-CZ 3.59Å; F461-F763 HydrophobicContact CE1-CZ 3.59Å; F461-F763 HydrophobicContact CZ-CE1 4.08Å; F461-F763 AromaticContact CZ-CZ 3.76Å; F461-F763 HydrophobicContact CZ-CZ 3.76Å; L496-F763 HydrophobicContact CD1-CE1 3.95Å; L496-F763 HydrophobicContact CD1-CE2 4.06Å; L496-F763 HydrophobicContact CD1-CZ 3.48Å; L496-F763 VanDerWaalsContact CD1-CZ 3.48Å; L496-F763 HydrophobicContact CD2-CE2 4.49Å; I751-F763 HydrophobicContact CD1-CD1 4.07Å; I751-F763 HydrophobicContact CD1-CE1 4.48Å; M753-F763 HydrophobicContact CE-CB 3.53Å; M753-F763 HydrophobicContact CE-CD1 4.48Å; M753-F763 HydrophobicContact CE-CD2 4.24Å; M753-F763 HydrophobicContact CE-CG 3.85Å; Y759-F763 WeakPolarHBondContact O-CD2 3.45Å; Y759-F763 PolarHBondContact O-N 3.31Å; R760-F763 PolarHBondContact O-N 2.93Å; F763-A766 PolarHBondContact O-N 2.87Å; F763-I767 WeakPolarHBondContact O-CB 3.19Å; F763-I767 VanDerWaalsContact O-CG1 3.26Å; F763-I767 WeakPolarHBondContact O-CG1 3.32Å; F763-I767 PolarHBondContact O-N 3.33Å
764	D	93.1	Very high	89	Confident	13 Å²	13	57.1 Å²	57.1	7%	0.07	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-48.4	172	-91.9	12.7	0	0	0	110.9	S514 K515 R760 D761 I767 L768	S514-D764 VanDerWaalsContact C-OD1 3.3Å; S514-D764 WeakPolarHBondContact CA-OD1 3.36Å; S514-D764 WeakPolarHBondContact CB-OD1 3.46Å; K515-D764 WeakPolarHBondContact CD-OD2 3.03Å; K515-D764 WeakPolarHBondContact CE-OD2 3.27Å; K515-D764 HydrophobicContact CG-CB 4.25Å; K515-D764 WeakPolarHBondContact CG-OD2 3.28Å; K515-D764 PolarHBondContact N-OD1 2.92Å; K515-D764 IonicContact NZ-OD2 3.21Å; K515-D764 PolarHBondContact NZ-OD2 3.45Å; R760-D764 PolarHBondContact O-N 3.5Å; D761-D764 PolarHBondContact O-N 3.47Å; D764-I767 PolarHBondContact O-N 3.49Å; D764-L768 WeakPolarHBondContact O-CB 3.31Å; D764-L768 VanDerWaalsContact O-CG 3.25Å; D764-L768 WeakPolarHBondContact O-CG 3.29Å; D764-L768 PolarHBondContact O-N 2.98Å
765	L	92.3	Very high	89.3	Confident	114 Å²	114	61 Å²	61	60%	0.597	31%	0.313	S	S	*	.	H	α-helix	trans	-63.2	-41.1	176.4	-69.5	171.6	0	0	0	112.2	D761 E762 L768 K769	D761-L765 WeakPolarHBondContact O-CG 3.2Å; D761-L765 PolarHBondContact O-N 2.95Å; D761-L765 VanDerWaalsContact O-N 3.08Å; E762-L765 PolarHBondContact O-N 2.93Å; L765-L768 PolarHBondContact O-N 3.25Å; L765-K769 WeakPolarHBondContact O-CB 3.44Å; L765-K769 PolarHBondContact O-N 3.31Å
766	A	93.1	Very high	89.8	Confident	3 Å²	3	58.6 Å²	58.6	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-66.5	-39.8	177.7	0	0	0	0	0	112.8	L455 I458 L459 E762 F763 K769 L770	L455-A766 HydrophobicContact CD2-CB 3.68Å; I458-A766 HydrophobicContact CG2-CB 4.2Å; L459-A766 HydrophobicContact CD1-CB 3.91Å; L459-A766 HydrophobicContact CD2-CB 4.2Å; L459-A766 HydrophobicContact CG-CB 4.02Å; E762-A766 WeakPolarHBondContact O-CB 3.33Å; E762-A766 PolarHBondContact O-N 3.06Å; F763-A766 PolarHBondContact O-N 2.87Å; A766-K769 PolarHBondContact O-N 3.3Å; A766-L770 WeakPolarHBondContact O-CG 3.29Å; A766-L770 PolarHBondContact O-N 3.46Å
767	I	95.3	Very high	90.5	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-44.5	175.5	-69.7	168	0	0	0	110.7	L455 S514 F517 I751 F763 D764 K769 L770 Q771 L776	L455-I767 HydrophobicContact CD2-CG1 4.27Å; S514-I767 VanDerWaalsContact OG-CD1 3.24Å; S514-I767 WeakPolarHBondContact OG-CD1 3.35Å; F517-I767 HydrophobicContact CB-CG2 4.01Å; I751-I767 HydrophobicContact CD1-CD1 3.99Å; I751-I767 HydrophobicContact CG1-CD1 4.31Å; F763-I767 WeakPolarHBondContact O-CB 3.19Å; F763-I767 VanDerWaalsContact O-CG1 3.26Å; F763-I767 WeakPolarHBondContact O-CG1 3.32Å; F763-I767 PolarHBondContact O-N 3.33Å; D764-I767 PolarHBondContact O-N 3.49Å; I767-K769 VanDerWaalsContact C-N 3.31Å; I767-K769 PolarHBondContact O-N 2.91Å; I767-L770 PolarHBondContact O-N 3.46Å; I767-Q771 WeakPolarHBondContact O-CB 3.48Å; I767-Q771 PolarHBondContact O-N 3.02Å; I767-L776 HydrophobicContact CG2-CD1 4.37Å
768	L	94.2	Very high	91.2	Very high	70 Å²	70	62.7 Å²	62.7	37%	0.366	31%	0.306	S	S	.	.	H	α-helix	trans	-58.1	-44.6	175.8	-73.3	169.6	0	0	0	111	D764 L765 L770 Q771 E772	D764-L768 WeakPolarHBondContact O-CB 3.31Å; D764-L768 VanDerWaalsContact O-CG 3.25Å; D764-L768 WeakPolarHBondContact O-CG 3.29Å; D764-L768 PolarHBondContact O-N 2.98Å; L765-L768 PolarHBondContact O-N 3.25Å; L768-L770 PolarHBondContact O-N 2.9Å; L768-Q771 WeakPolarHBondContact O-CA 3.49Å; L768-Q771 WeakPolarHBondContact O-CB 3.27Å; L768-Q771 PolarHBondContact O-N 2.73Å; L768-Q771 VanDerWaalsContact O-N 3.1Å; L768-E772 WeakPolarHBondContact O-CG 3.44Å; L768-E772 PolarHBondContact O-N 3.16Å
769	K	94.1	Very high	92	Very high	105 Å²	105	60 Å²	60	46%	0.457	29%	0.288	S	S	.	.	H	α-helix	trans	-59.5	-46.4	174.2	-175.8	177.8	179.4	-178	0	112.6	L765 A766 I767 Q771 E772 D773	L765-K769 WeakPolarHBondContact O-CB 3.44Å; L765-K769 PolarHBondContact O-N 3.31Å; A766-K769 PolarHBondContact O-N 3.3Å; I767-K769 VanDerWaalsContact C-N 3.31Å; I767-K769 PolarHBondContact O-N 2.91Å; K769-Q771 PolarHBondContact O-N 2.93Å; K769-E772 PolarHBondContact O-N 3.42Å; K769-D773 WeakPolarHBondContact O-CB 3.47Å; K769-D773 PolarHBondContact O-N 3.29Å
770	L	94.6	Very high	92.6	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-25.2	175.8	-70.7	174.7	0	0	0	113.2	E454 L455 I458 A766 I767 L768 N774 R775 L776	E454-L770 HydrophobicContact CB-CD1 4.27Å; E454-L770 HydrophobicContact CB-CD2 3.94Å; L455-L770 HydrophobicContact CD2-CD1 3.63Å; L455-L770 HydrophobicContact CG-CD1 3.88Å; I458-L770 HydrophobicContact CD1-CD1 4.41Å; I458-L770 HydrophobicContact CD1-CD2 3.6Å; I458-L770 HydrophobicContact CD1-CG 3.8Å; A766-L770 WeakPolarHBondContact O-CG 3.29Å; A766-L770 PolarHBondContact O-N 3.46Å; I767-L770 PolarHBondContact O-N 3.46Å; L768-L770 PolarHBondContact O-N 2.9Å; L770-N774 PolarHBondContact O-N 3.43Å; L770-R775 HydrophobicContact CB-CB 4.39Å; L770-R775 HydrophobicContact CD2-CB 3.79Å; L770-R775 HydrophobicContact CD2-CG 3.89Å; L770-R775 PolarHBondContact O-N 3.48Å; L770-L776 HydrophobicContact CB-CD1 4.28Å; L770-L776 HydrophobicContact CB-CD2 4.23Å; L770-L776 HydrophobicContact CB-CG 3.92Å; L770-L776 HydrophobicContact CD1-CD2 4.4Å; L770-L776 PolarHBondContact O-N 3.38Å
771	Q	93.5	Very high	92.7	Very high	109 Å²	109	64.1 Å²	64.1	51%	0.509	31%	0.305	S	S	.	.	H	α-helix	trans	-80.1	-41.1	174.6	-169.1	174	-4.8	0	0	112.1	I767 L768 K769 N774 L776	I767-Q771 WeakPolarHBondContact O-CB 3.48Å; I767-Q771 PolarHBondContact O-N 3.02Å; L768-Q771 WeakPolarHBondContact O-CA 3.49Å; L768-Q771 WeakPolarHBondContact O-CB 3.27Å; L768-Q771 PolarHBondContact O-N 2.73Å; L768-Q771 VanDerWaalsContact O-N 3.1Å; K769-Q771 PolarHBondContact O-N 2.93Å; Q771-N774 WeakPolarHBondContact O-CA 3.3Å; Q771-N774 PolarHBondContact O-N 3.11Å; Q771-N774 VanDerWaalsContact O-N 3.13Å; Q771-L776 HydrophobicContact CB-CD1 4.16Å
772	E	94	Very high	93	Very high	166 Å²	166	66.6 Å²	66.6	78%	0.776	31%	0.312	S	S	*	.	H	α-helix	trans	-65.9	-45	174.5	-71.8	-179.3	171.7	0	0	112.1	L768 K769 N774	L768-E772 WeakPolarHBondContact O-CG 3.44Å; L768-E772 PolarHBondContact O-N 3.16Å; K769-E772 PolarHBondContact O-N 3.42Å; E772-N774 PolarHBondContact O-N 3.04Å; E772-N774 VanDerWaalsContact O-N 3.15Å
773	D	94	Very high	93.2	Very high	94 Å²	94	65.8 Å²	65.8	50%	0.503	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-2.2	172	-71.1	-28.3	0	0	0	112.5	K769 R775	K769-D773 WeakPolarHBondContact O-CB 3.47Å; K769-D773 PolarHBondContact O-N 3.29Å; D773-R775 HydrophobicContact CB-CG 3.86Å; D773-R775 PolarHBondContact O-N 3.42Å; D773-R775 VanDerWaalsContact O-N 3.09Å
774	N	92.9	Very high	93.1	Very high	87 Å²	87	65.9 Å²	65.9	47%	0.465	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	20.9	179.2	-156.7	34	0	0	0	114.3	L770 Q771 E772 E777 I778	L770-N774 PolarHBondContact O-N 3.43Å; Q771-N774 WeakPolarHBondContact O-CA 3.3Å; Q771-N774 PolarHBondContact O-N 3.11Å; Q771-N774 VanDerWaalsContact O-N 3.13Å; E772-N774 PolarHBondContact O-N 3.04Å; E772-N774 VanDerWaalsContact O-N 3.15Å; N774-E777 PolarHBondContact O-N 3.34Å; N774-E777 VanDerWaalsContact OD1-CB 3.24Å; N774-E777 WeakPolarHBondContact OD1-CB 3.3Å; N774-I778 WeakPolarHBondContact O-CG1 3.48Å; N774-I778 PolarHBondContact O-N 3.4Å
775	R	93.9	Very high	92.3	Very high	86 Å²	86	70 Å²	70	33%	0.325	33%	0.326	S	S	.	.	H	α-helix	trans	-63.8	-40.7	-179.8	-62.8	-65.5	-67.5	159.3	-3.2	111.7	E454 L770 D773 E777 I778 L779	E454-R775 IonicContact OE1-CZ 3.73Å; E454-R775 IonicContact OE1-NE 3.66Å; E454-R775 IonicContact OE1-NH2 3.65Å; E454-R775 PolarHBondContact OE1-NH2 2.89Å; E454-R775 IonicContact OE2-CZ 2.76Å; E454-R775 VanDerWaalsContact OE2-CZ 3.3Å; E454-R775 IonicContact OE2-NE 2.65Å; E454-R775 PolarHBondContact OE2-NE 3.04Å; E454-R775 IonicContact OE2-NH2 3.73Å; E454-R775 PolarHBondContact OE2-NH2 3.24Å; L770-R775 HydrophobicContact CB-CB 4.39Å; L770-R775 HydrophobicContact CD2-CB 3.79Å; L770-R775 HydrophobicContact CD2-CG 3.89Å; L770-R775 PolarHBondContact O-N 3.48Å; D773-R775 HydrophobicContact CB-CG 3.86Å; D773-R775 PolarHBondContact O-N 3.42Å; D773-R775 VanDerWaalsContact O-N 3.09Å; R775-E777 VanDerWaalsContact C-N 3.33Å; R775-E777 PolarHBondContact O-N 2.85Å; R775-I778 PolarHBondContact O-N 2.96Å; R775-L779 WeakPolarHBondContact O-CG 3.46Å; R775-L779 PolarHBondContact O-N 3.42Å
776	L	93.2	Very high	91	Very high	12 Å²	12	67.2 Å²	67.2	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-60.9	-39.4	179.6	-63.4	174.2	0	0	0	112.5	F447 M451 F517 I767 L770 Q771 L779 K780	F447-L776 HydrophobicContact CZ-CD2 4.48Å; M451-L776 HydrophobicContact CG-CD2 3.9Å; M451-L776 HydrophobicContact SD-CD2 3.9Å; F517-L776 HydrophobicContact CB-CD1 4.16Å; I767-L776 HydrophobicContact CG2-CD1 4.37Å; L770-L776 HydrophobicContact CB-CD1 4.28Å; L770-L776 HydrophobicContact CB-CD2 4.23Å; L770-L776 HydrophobicContact CB-CG 3.92Å; L770-L776 HydrophobicContact CD1-CD2 4.4Å; L770-L776 PolarHBondContact O-N 3.38Å; Q771-L776 HydrophobicContact CB-CD1 4.16Å; L776-L779 PolarHBondContact O-N 3.13Å; L776-K780 WeakPolarHBondContact O-CB 3.46Å; L776-K780 PolarHBondContact O-N 2.94Å
777	E	92.3	Very high	89.6	Confident	62 Å²	62	68.5 Å²	68.5	29%	0.29	34%	0.338	S	S	.	.	H	α-helix	trans	-71.3	-36	176.7	175.5	63.4	-176.4	0	0	112	N774 R775 K780 R781	N774-E777 PolarHBondContact O-N 3.34Å; N774-E777 VanDerWaalsContact OD1-CB 3.24Å; N774-E777 WeakPolarHBondContact OD1-CB 3.3Å; R775-E777 VanDerWaalsContact C-N 3.33Å; R775-E777 PolarHBondContact O-N 2.85Å; E777-K780 PolarHBondContact O-N 3.26Å; E777-R781 WeakPolarHBondContact O-CG 3.41Å; E777-R781 PolarHBondContact O-N 3.27Å; E777-R781 IonicContact OE1-CZ 3.66Å; E777-R781 IonicContact OE1-NE 3.32Å; E777-R781 PolarHBondContact OE1-NE 3.2Å; E777-R781 IonicContact OE1-NH2 2.69Å; E777-R781 PolarHBondContact OE1-NH2 2.89Å
778	I	93.9	Very high	88.2	Confident	88 Å²	88	78 Å²	78	45%	0.451	38%	0.38	S	S	.	.	H	α-helix	trans	-63.2	-47.1	173.3	-64.4	165.5	0	0	0	110	N774 R775 R781 F782	N774-I778 WeakPolarHBondContact O-CG1 3.48Å; N774-I778 PolarHBondContact O-N 3.4Å; R775-I778 PolarHBondContact O-N 2.96Å; I778-R781 PolarHBondContact O-N 3.07Å; I778-F782 WeakPolarHBondContact O-CB 3.3Å; I778-F782 PolarHBondContact O-N 3.44Å
779	L	94	Very high	87.2	Confident	17 Å²	17	75.9 Å²	75.9	9%	0.089	37%	0.37	C	S	.	.	H	α-helix	trans	-62.3	-41.8	175	-70.6	176.8	0	0	0	111.9	F447 D450 M451 E454 R775 L776 R781 F782 W783	F447-L779 HydrophobicContact CD2-CB 3.88Å; F447-L779 HydrophobicContact CE2-CB 3.65Å; D450-L779 HydrophobicContact CB-CD2 3.92Å; M451-L779 HydrophobicContact CB-CD1 4.23Å; E454-L779 HydrophobicContact CG-CD1 4.32Å; R775-L779 WeakPolarHBondContact O-CG 3.46Å; R775-L779 PolarHBondContact O-N 3.42Å; L776-L779 PolarHBondContact O-N 3.13Å; L779-R781 PolarHBondContact O-N 3.47Å; L779-F782 PolarHBondContact O-N 3.3Å; L779-W783 PolarHBondContact O-N 3.29Å
780	K	92.4	Very high	85.8	Confident	47 Å²	47	73.6 Å²	73.6	20%	0.204	37%	0.366	C	S	.	.	H	α-helix	trans	-59.5	-48.6	176.3	-171.6	-168.1	174.2	-163.8	0	110.1	F447 M518 E728 L776 E777 F782 W783 W784	F447-K780 HydrophobicContact CE2-CB 4.2Å; M518-K780 HydrophobicContact CE-CB 4.27Å; M518-K780 HydrophobicContact CE-CD 4.22Å; M518-K780 HydrophobicContact CE-CG 3.98Å; E728-K780 IonicContact OE2-NZ 3.84Å; E728-K780 PolarHBondContact OE2-NZ 2.89Å; L776-K780 WeakPolarHBondContact O-CB 3.46Å; L776-K780 PolarHBondContact O-N 2.94Å; E777-K780 PolarHBondContact O-N 3.26Å; K780-F782 PolarHBondContact O-N 3.13Å; K780-W783 PolarHBondContact O-N 3.06Å; K780-W784 HydrophobicContact CG-CD2 4.15Å; K780-W784 HydrophobicContact CG-CE3 3.92Å; K780-W784 HydrophobicContact CG-CZ3 4.35Å; K780-W784 WeakPolarHBondContact O-CB 3.48Å; K780-W784 VanDerWaalsContact O-CE3 3.24Å; K780-W784 PolarHBondContact O-N 3.4Å
781	R	90.5	Very high	84	Confident	131 Å²	131	79.2 Å²	79.2	49%	0.494	39%	0.391	S	S	.	.	H	α-helix	trans	-60.3	-45.7	177.3	-72.6	178.9	-166	-176.3	6.6	111.8	E777 I778 L779 W783 W784 E785	E777-R781 WeakPolarHBondContact O-CG 3.41Å; E777-R781 PolarHBondContact O-N 3.27Å; E777-R781 IonicContact OE1-CZ 3.66Å; E777-R781 IonicContact OE1-NE 3.32Å; E777-R781 PolarHBondContact OE1-NE 3.2Å; E777-R781 IonicContact OE1-NH2 2.69Å; E777-R781 PolarHBondContact OE1-NH2 2.89Å; I778-R781 PolarHBondContact O-N 3.07Å; L779-R781 PolarHBondContact O-N 3.47Å; R781-W783 PolarHBondContact O-N 3.38Å; R781-W784 PolarHBondContact O-N 2.92Å; R781-E785 HydrophobicContact CB-CG 4.32Å; R781-E785 WeakPolarHBondContact O-CA 3.37Å; R781-E785 WeakPolarHBondContact O-CB 3.42Å; R781-E785 WeakPolarHBondContact O-CG 3.08Å; R781-E785 PolarHBondContact O-N 2.85Å
782	F	91.8	Very high	81.8	Confident	141 Å²	141	80.4 Å²	80.4	62%	0.618	40%	0.396	S	S	*	.	H	α-helix	trans	-57	-45.1	178.8	-178.2	-97.1	0	0	0	113.1	I778 L779 K780	I778-F782 WeakPolarHBondContact O-CB 3.3Å; I778-F782 PolarHBondContact O-N 3.44Å; L779-F782 PolarHBondContact O-N 3.3Å; K780-F782 PolarHBondContact O-N 3.13Å
783	W	91.8	Very high	79.3	Confident	32 Å²	32	80.2 Å²	80.2	12%	0.121	40%	0.395	C	S	.	.	H	α-helix	trans	-82.2	-28.5	-176.8	-75.2	106.4	0	0	0	114.2	P427 M430 E445 G446 F447 D450 R733 L779 K780 R781	P427-W783 HydrophobicContact CB-CB 4.42Å; P427-W783 HydrophobicContact CB-CE3 4.47Å; M430-W783 HydrophobicContact CE-CE3 3.85Å; M430-W783 HydrophobicContact CE-CH2 4.29Å; M430-W783 HydrophobicContact CE-CZ3 3.38Å; E445-W783 HydrophobicContact CB-CH2 4.04Å; E445-W783 HydrophobicContact CG-CH2 4.23Å; G446-W783 VanDerWaalsContact CA-CZ2 3.46Å; G446-W783 VanDerWaalsContact N-CH2 3.32Å; G446-W783 VanDerWaalsContact N-CZ2 3.3Å; F447-W783 VanDerWaalsContact CA-CD1 3.48Å; F447-W783 HydrophobicContact CB-CB 4.24Å; F447-W783 HydrophobicContact CB-CG 4.01Å; D450-W783 WeakPolarHBondContact OD2-CZ2 3.5Å; D450-W783 PolarHBondContact OD2-NE1 3.17Å; R733-W783 PolarHBondContact NH2-O 3.37Å; L779-W783 PolarHBondContact O-N 3.29Å; K780-W783 PolarHBondContact O-N 3.06Å; R781-W783 PolarHBondContact O-N 3.38Å
784	W	89.5	Confident	76.6	Confident	2 Å²	2	76.9 Å²	76.9	1%	0.008	38%	0.377	C	S	.	.	H	α-helix	trans	-88.2	-45.6	177.8	-83.7	-112.7	0	0	0	113.1	P427 Y428 F447 M518 T725 Q732 R733 K780 R781 G786	P427-W784 HydrophobicContact CG-CD2 4.2Å; P427-W784 HydrophobicContact CG-CE3 3.99Å; P427-W784 HydrophobicContact CG-CH2 3.58Å; P427-W784 HydrophobicContact CG-CZ2 3.77Å; P427-W784 HydrophobicContact CG-CZ3 3.7Å; Y428-W784 HydrophobicContact CD1-CH2 4.26Å; Y428-W784 AromaticContact CE1-CH2 3.63Å; Y428-W784 HydrophobicContact CE1-CH2 3.63Å; Y428-W784 HydrophobicContact CE1-CZ2 4.11Å; Y428-W784 HydrophobicContact CE2-CH2 4.44Å; Y428-W784 HydrophobicContact CE2-CZ2 4.37Å; Y428-W784 AromaticContact CZ-CH2 3.74Å; Y428-W784 AromaticContact CZ-CZ2 3.74Å; Y428-W784 WeakPolarHBondContact OH-CZ2 3.43Å; F447-W784 HydrophobicContact CB-CH2 4.35Å; F447-W784 HydrophobicContact CB-CZ3 3.85Å; F447-W784 AromaticContact CD2-CZ3 3.84Å; F447-W784 HydrophobicContact CD2-CZ3 3.84Å; F447-W784 HydrophobicContact CG-CH2 4.36Å; F447-W784 AromaticContact CG-CZ3 3.89Å; F447-W784 HydrophobicContact CG-CZ3 3.89Å; M518-W784 HydrophobicContact CE-CH2 4.27Å; M518-W784 HydrophobicContact CE-CZ3 4.49Å; T725-W784 PolarHBondContact O-NE1 3.43Å; Q732-W784 PolarHBondContact OE1-O 3.36Å; Q732-W784 VanDerWaalsContact OE1-O 3.07Å; R733-W784 PolarHBondContact NH1-O 3.04Å; K780-W784 HydrophobicContact CG-CD2 4.15Å; K780-W784 HydrophobicContact CG-CE3 3.92Å; K780-W784 HydrophobicContact CG-CZ3 4.35Å; K780-W784 WeakPolarHBondContact O-CB 3.48Å; K780-W784 VanDerWaalsContact O-CE3 3.24Å; K780-W784 PolarHBondContact O-N 3.4Å; R781-W784 PolarHBondContact O-N 2.92Å; W784-G786 PolarHBondContact O-N 3.2Å
785	E	78.1	Confident	74.3	Confident	101 Å²	101	78.7 Å²	78.7	47%	0.472	38%	0.383	S	S	.	.			trans	-73	80.6	-176.7	-60.3	-160.6	104.6	0	0	112.5	R781 K791	R781-E785 HydrophobicContact CB-CG 4.32Å; R781-E785 WeakPolarHBondContact O-CA 3.37Å; R781-E785 WeakPolarHBondContact O-CB 3.42Å; R781-E785 WeakPolarHBondContact O-CG 3.08Å; R781-E785 PolarHBondContact O-N 2.85Å; E785-K791 IonicContact OE1-NZ 2.66Å; E785-K791 PolarHBondContact OE1-NZ 2.99Å
786	G	64.5	Low	71.7	Confident	55 Å²	55	86.3 Å²	86.3	57%	0.567	41%	0.411	S	S	*	.			trans	-143.6	13.1	171.3	0	0	0	0	0	113.3	W784	W784-G786 PolarHBondContact O-N 3.2Å
787	G	62.9	Low	69	Low	30 Å²	30	86.9 Å²	86.9	31%	0.309	42%	0.418	S	S	.	.			trans	-68.7	133	-171.6	0	0	0	0	0	114.4	Q732 C789	Q732-G787 CarbonylContact O-C 3.54Å; Q732-G787 WeakPolarHBondContact O-CA 3.49Å; G787-C789 PolarHBondContact O-N 3.39Å
788	K	65.8	Low	66.1	Low	200 Å²	200	88.5 Å²	88.5	87%	0.87	42%	0.424	S	S	*	.	S	Bend	trans	-73.6	-10.3	165.1	-64.9	-178.8	-177	175.4	0	112.1	Q732	Q732-K788 PolarHBondContact O-N 3.46Å
789	C	73.1	Confident	63.5	Low	25 Å²	25	87.3 Å²	87.3	17%	0.169	43%	0.433	C	S	.	.	S	Bend	trans	-78.9	125.4	179.5	-59.1	0	0	0	0	111.2	Q732 C735 G787 K791	Q732-C789 WeakPolarHBondContact O-CB 3.33Å; Q732-C789 PolarHBondContact O-N 3Å; Q732-C789 PolarHBondContact O-SG 3.26Å; C735-C789 WeakPolarHBondContact CA-SG 3.31Å; C735-C789 HydrophobicContact CB-CB 3.94Å; C735-C789 WeakPolarHBondContact CB-SG 3.25Å; C735-C789 PolarHBondContact N-SG 3.43Å; C735-C789 WeakPolarHBondContact SG-CA 3.22Å; C735-C789 WeakPolarHBondContact SG-CB 3.44Å; C735-C789 CovalentContact SG-SG 2.04Å; C735-C789 PolarHBondContact SG-SG 3.16Å; G787-C789 PolarHBondContact O-N 3.39Å; C789-K791 PolarHBondContact O-N 3.33Å
790	P	64.9	Low	60.6	Low	57 Å²	57	91.8 Å²	91.8	37%	0.37	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-62	134.6	174.8	25.5	-32.8	0	0	0	109.8	D794	P790-D794 HydrophobicContact CB-CB 4.08Å
791	K	56.8	Low	57.9	Low	122 Å²	122	97.6 Å²	97.6	53%	0.53	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-59.1	155.9	-175.2	-68.1	-171.9	173.9	-173.2	0	110.9	E785 C789 E793 D794	E785-K791 IonicContact OE1-NZ 2.66Å; E785-K791 PolarHBondContact OE1-NZ 2.99Å; C789-K791 PolarHBondContact O-N 3.33Å; K791-E793 PolarHBondContact O-N 2.9Å; K791-E793 VanDerWaalsContact O-N 3.13Å; K791-D794 WeakPolarHBondContact O-CA 3.43Å; K791-D794 VanDerWaalsContact O-CB 3.28Å; K791-D794 WeakPolarHBondContact O-CB 3.28Å; K791-D794 PolarHBondContact O-N 3.45Å
792	E	48.2	Very low	55.2	Low	134 Å²	134	95.7 Å²	95.7	63%	0.626	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.2	-169.8	-150	148.1	-158.5	0	0	113.1	R731 D794 H795	R731-E792 IonicContact CZ-OE2 3.71Å; R731-E792 VanDerWaalsContact NH1-CD 3.34Å; R731-E792 IonicContact NH1-OE1 3.03Å; R731-E792 PolarHBondContact NH1-OE1 3.07Å; R731-E792 IonicContact NH1-OE2 2.7Å; R731-E792 PolarHBondContact NH1-OE2 3.34Å; R731-E792 IonicContact NH2-OE2 3.3Å; E792-D794 VanDerWaalsContact C-N 3.27Å; E792-D794 PolarHBondContact O-N 3.01Å; E792-H795 PolarHBondContact O-N 2.98Å
793	E	41.3	Very low	52.8	Low	162 Å²	162	93.6 Å²	93.6	76%	0.757	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-30.1	170.1	-60.7	-169.4	141	0	0	113.6	K791 H795 R796 A797	K791-E793 PolarHBondContact O-N 2.9Å; K791-E793 VanDerWaalsContact O-N 3.13Å; E793-H795 PolarHBondContact O-N 2.85Å; E793-R796 CarbonylContact O-C 3.59Å; E793-R796 WeakPolarHBondContact O-CA 3.31Å; E793-R796 WeakPolarHBondContact O-CB 3.29Å; E793-R796 PolarHBondContact O-N 3.32Å; E793-A797 PolarHBondContact O-N 3.19Å
794	D	38.1	Very low	50.1	Low	24 Å²	24	98 Å²	98	13%	0.128	51%	0.509	C	S	.	.	H	α-helix	trans	-72.4	-9.1	173.9	-76.1	-49.4	0	0	0	112.7	P790 K791 E792 R796 A797 K798 R801	P790-D794 HydrophobicContact CB-CB 4.08Å; K791-D794 WeakPolarHBondContact O-CA 3.43Å; K791-D794 VanDerWaalsContact O-CB 3.28Å; K791-D794 WeakPolarHBondContact O-CB 3.28Å; K791-D794 PolarHBondContact O-N 3.45Å; E792-D794 VanDerWaalsContact C-N 3.27Å; E792-D794 PolarHBondContact O-N 3.01Å; D794-R796 VanDerWaalsContact C-N 3.29Å; D794-A797 PolarHBondContact O-N 3.02Å; D794-K798 HydrophobicContact CB-CG 4.39Å; D794-K798 WeakPolarHBondContact O-CA 2.95Å; D794-K798 WeakPolarHBondContact O-CB 3.47Å; D794-K798 WeakPolarHBondContact O-CD 3.11Å; D794-K798 WeakPolarHBondContact O-CG 3.48Å; D794-K798 PolarHBondContact O-N 3.42Å; D794-R801 WeakPolarHBondContact OD1-CD 3.46Å; D794-R801 IonicContact OD1-CZ 3.41Å; D794-R801 VanDerWaalsContact OD1-CZ 3.29Å; D794-R801 IonicContact OD1-NE 3.79Å; D794-R801 IonicContact OD1-NH1 2.62Å; D794-R801 PolarHBondContact OD1-NH1 3.39Å; D794-R801 IonicContact OD2-NH1 2.68Å; D794-R801 PolarHBondContact OD2-NH1 3.29Å
795	H	43.8	Very low	47.6	Very low	124 Å²	124	101.3 Å²	101.3	57%	0.574	54%	0.544	S	S	*	.	H	α-helix	trans	-73.5	-23.1	163.8	-82.9	-103	0	0	0	112.6	E792 E793 K798	E792-H795 PolarHBondContact O-N 2.98Å; E793-H795 PolarHBondContact O-N 2.85Å; H795-K798 PolarHBondContact CE1-NZ 3.24Å; H795-K798 PolarHBondContact NE2-NZ 2.99Å
796	R	40	Very low	46	Very low	246 Å²	246	102.3 Å²	102.3	93%	0.928	56%	0.557	S	S	*	*	H	α-helix	trans	-84.8	-26.9	163.1	-92.3	179.5	169.9	165.6	-1.5	113.2	E793 D794	E793-R796 CarbonylContact O-C 3.59Å; E793-R796 WeakPolarHBondContact O-CA 3.31Å; E793-R796 WeakPolarHBondContact O-CB 3.29Å; E793-R796 PolarHBondContact O-N 3.32Å; D794-R796 VanDerWaalsContact C-N 3.29Å
797	A	36	Very low	44.9	Very low	24 Å²	24	107.6 Å²	107.6	20%	0.198	57%	0.57	C	S	.	*	H	α-helix	trans	-110.5	1.8	-171.4	0	0	0	0	0	116.9	E793 D794 G799 L800 R801	E793-A797 PolarHBondContact O-N 3.19Å; D794-A797 PolarHBondContact O-N 3.02Å; A797-G799 VanDerWaalsContact C-N 3.25Å; A797-G799 PolarHBondContact O-N 3.5Å; A797-L800 WeakPolarHBondContact O-CA 3.42Å; A797-L800 VanDerWaalsContact O-CB 3.28Å; A797-L800 WeakPolarHBondContact O-CB 3.42Å; A797-L800 PolarHBondContact O-N 3.46Å; A797-R801 PolarHBondContact O-N 3.44Å
798	K	30.7	Very low	43.6	Very low	96 Å²	96	112.6 Å²	112.6	42%	0.417	59%	0.59	S	S	.	*	H	α-helix	trans	-61.2	-29.7	176.4	-97	161.1	-174.3	177.5	0	113.6	D794 H795 L800	D794-K798 HydrophobicContact CB-CG 4.39Å; D794-K798 WeakPolarHBondContact O-CA 2.95Å; D794-K798 WeakPolarHBondContact O-CB 3.47Å; D794-K798 WeakPolarHBondContact O-CD 3.11Å; D794-K798 WeakPolarHBondContact O-CG 3.48Å; D794-K798 PolarHBondContact O-N 3.42Å; H795-K798 PolarHBondContact CE1-NZ 3.24Å; H795-K798 PolarHBondContact NE2-NZ 2.99Å; K798-L800 PolarHBondContact O-N 3.43Å
799	G	39	Very low	42.5	Very low	63 Å²	63	113.8 Å²	113.8	65%	0.649	59%	0.589	S	S	*	*	H	α-helix	trans	-68.6	-17.2	169.6	0	0	0	0	0	114	A797	A797-G799 VanDerWaalsContact C-N 3.25Å; A797-G799 PolarHBondContact O-N 3.5Å
800	L	33.2	Very low	41	Very low	111 Å²	111	123.9 Å²	123.9	58%	0.581	62%	0.623	S	S	*	*	H	α-helix	trans	-100.9	-30	-170	-152.6	74.1	0	0	0	113.8	A797 K798	A797-L800 WeakPolarHBondContact O-CA 3.42Å; A797-L800 VanDerWaalsContact O-CB 3.28Å; A797-L800 WeakPolarHBondContact O-CB 3.42Å; A797-L800 PolarHBondContact O-N 3.46Å; K798-L800 PolarHBondContact O-N 3.43Å
801	R	35.3	Very low	40.2	Very low	170 Å²	170	128.8 Å²	128.8	64%	0.642	65%	0.645	S	S	*	*	H	α-helix	trans	-91.4	-24.6	-175	-71.1	-178.1	178.1	166.1	-2.9	115	D794 A797 I803	D794-R801 WeakPolarHBondContact OD1-CD 3.46Å; D794-R801 IonicContact OD1-CZ 3.41Å; D794-R801 VanDerWaalsContact OD1-CZ 3.29Å; D794-R801 IonicContact OD1-NE 3.79Å; D794-R801 IonicContact OD1-NH1 2.62Å; D794-R801 PolarHBondContact OD1-NH1 3.39Å; D794-R801 IonicContact OD2-NH1 2.68Å; D794-R801 PolarHBondContact OD2-NH1 3.29Å; A797-R801 PolarHBondContact O-N 3.44Å; R801-I803 PolarHBondContact O-N 2.87Å
802	A	34.3	Very low	39.5	Very low	90 Å²	90	130.9 Å²	130.9	74%	0.744	66%	0.662	S	S	*	*	S	Bend	trans	-69.3	-13.7	179.2	0	0	0	0	0	114.5
803	I	40.9	Very low	39.1	Very low	98 Å²	98	130 Å²	130	50%	0.503	66%	0.661	S	S	.	*	S	Bend	trans	-109.4	-20	-172.8	-58.9	178.8	0	0	0	112.3	R801 G805 F821	R801-I803 PolarHBondContact O-N 2.87Å; I803-G805 PolarHBondContact O-N 3.05Å; I803-F821 HydrophobicContact CD1-CD1 4.31Å; I803-F821 HydrophobicContact CD1-CE1 3.51Å; I803-F821 HydrophobicContact CD1-CZ 4.19Å
804	L	36.7	Very low	39.2	Very low	125 Å²	125	131.3 Å²	131.3	65%	0.654	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	10.9	-179.6	-106.3	84.2	0	0	0	115	V806	L804-V806 VanDerWaalsContact C-N 3.3Å; L804-V806 PolarHBondContact O-N 3.25Å
805	G	36.6	Very low	39.3	Very low	71 Å²	71	135 Å²	135	73%	0.732	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-17.1	176.4	0	0	0	0	0	114.7	I803	I803-G805 PolarHBondContact O-N 3.05Å
806	V	44.8	Very low	39.1	Very low	122 Å²	122	135.4 Å²	135.4	74%	0.739	69%	0.692	S	S	*	*	S	Bend	trans	-140.1	105.7	177.2	-173.9	0	0	0	0	109.7	L804	L804-V806 VanDerWaalsContact C-N 3.3Å; L804-V806 PolarHBondContact O-N 3.25Å
807	I	39.8	Very low	39.3	Very low	165 Å²	165	127.5 Å²	127.5	85%	0.846	67%	0.668	S	S	*	*			trans	168.8	122.5	144.2	-87.8	151.9	0	0	0	108.2
808	N	35.6	Very low	39.5	Very low	136 Å²	136	130 Å²	130	73%	0.727	68%	0.684	S	S	*	*			trans	-87	139.5	-178.9	-164.8	-4	0	0	0	111.1
809	R	44.4	Very low	39.7	Very low	225 Å²	225	132.4 Å²	132.4	85%	0.849	70%	0.7	S	S	*	*			trans	37.2	108.9	163.1	-77.4	169.4	176.1	-151.3	-0.5	119.1
810	R	41.2	Very low	39.5	Very low	237 Å²	237	134.1 Å²	134.1	89%	0.894	70%	0.698	S	S	*	*				-171.8	139.6	113.5	-101.2	163.1	-175.9	-174.2	1.4	112.1
811	L	47.9	Very low	39.6	Very low	159 Å²	159	134.2 Å²	134.2	83%	0.832	69%	0.694	S	S	*	*	S	Bend	trans	-71.2	160.2	174.1	-89.9	69.1	0	0	0	111.1
812	L	41.2	Very low	39.6	Very low	167 Å²	167	130 Å²	130	87%	0.874	70%	0.696	S	S	*	*	S	Bend	trans	94.2	-24.2	178.9	-65.7	161.6	0	0	0	118	R814	L812-R814 VanDerWaalsContact C-N 3.31Å; L812-R814 PolarHBondContact O-N 3.02Å
813	L	39.9	Very low	39.7	Very low	116 Å²	116	132.7 Å²	132.7	61%	0.607	70%	0.697	S	S	*	*	S	Bend	trans	-88.5	11.9	176.2	-146	68.4	0	0	0	114.4	I817	L813-I817 HydrophobicContact CB-CD1 4.42Å; L813-I817 HydrophobicContact CD2-CD1 3.55Å; L813-I817 HydrophobicContact CG-CD1 3.63Å; L813-I817 HydrophobicContact CG-CG1 4.13Å; L813-I817 WeakPolarHBondContact O-CB 3.39Å; L813-I817 WeakPolarHBondContact O-CG1 3.47Å
814	R	43.1	Very low	39.6	Very low	189 Å²	189	132.1 Å²	132.1	71%	0.713	70%	0.702	S	S	*	*	H	α-helix	trans	-79.9	-38.6	-178.9	-83.7	-175.3	169.7	-179.8	-4.7	114.3	L812 S818	L812-R814 VanDerWaalsContact C-N 3.31Å; L812-R814 PolarHBondContact O-N 3.02Å; R814-S818 WeakPolarHBondContact O-CB 3.39Å; R814-S818 PolarHBondContact O-N 2.99Å; R814-S818 PolarHBondContact O-OG 3.37Å
815	S	40.2	Very low	40.2	Very low	102 Å²	102	131.2 Å²	131.2	71%	0.713	71%	0.706	S	S	*	*	H	α-helix	trans	-74.4	-42.6	-174.3	-177.1	0	0	0	0	112.9
816	L	40.6	Very low	40.8	Very low	131 Å²	131	131.4 Å²	131.4	69%	0.686	71%	0.708	S	S	*	*	H	α-helix	trans	-72.6	-29.8	178.9	-86.2	152.2	0	0	0	113.8	T820	L816-T820 PolarHBondContact O-OG1 2.84Å
817	I	43.4	Very low	41.5	Very low	81 Å²	81	130.3 Å²	130.3	42%	0.415	70%	0.697	S	S	.	*	H	α-helix	trans	-80.8	-35.8	177.3	-66.1	-178.8	0	0	0	111.9	L813 L819 T820 F821	L813-I817 HydrophobicContact CB-CD1 4.42Å; L813-I817 HydrophobicContact CD2-CD1 3.55Å; L813-I817 HydrophobicContact CG-CD1 3.63Å; L813-I817 HydrophobicContact CG-CG1 4.13Å; L813-I817 WeakPolarHBondContact O-CB 3.39Å; L813-I817 WeakPolarHBondContact O-CG1 3.47Å; I817-L819 PolarHBondContact O-N 3.34Å; I817-T820 WeakPolarHBondContact CA-OG1 3.49Å; I817-T820 PolarHBondContact O-N 2.84Å; I817-T820 VanDerWaalsContact O-N 3.13Å; I817-T820 PolarHBondContact O-OG1 3.18Å; I817-F821 HydrophobicContact CG2-CB 4.39Å; I817-F821 WeakPolarHBondContact O-CB 3.17Å; I817-F821 PolarHBondContact O-N 2.9Å
818	S	39.9	Very low	42.5	Very low	77 Å²	77	123.5 Å²	123.5	54%	0.538	67%	0.668	S	S	.	*	H	α-helix	trans	-58.9	-30.7	173.5	-83.3	0	0	0	0	113.3	R814	R814-S818 WeakPolarHBondContact O-CB 3.39Å; R814-S818 PolarHBondContact O-N 2.99Å; R814-S818 PolarHBondContact O-OG 3.37Å
819	L	35.8	Very low	43.8	Very low	145 Å²	145	124.6 Å²	124.6	76%	0.759	67%	0.67	S	S	*	*	H	α-helix	trans	-79.3	-26.8	177.6	-155.2	76	0	0	0	113.3	I817	I817-L819 PolarHBondContact O-N 3.34Å
820	T	35.6	Very low	44.7	Very low	100 Å²	100	118.8 Å²	118.8	61%	0.613	65%	0.653	S	S	*	*	H	α-helix	trans	-94	-28.8	-178	39.5	0	0	0	0	113.5	L816 I817	L816-T820 PolarHBondContact O-OG1 2.84Å; I817-T820 WeakPolarHBondContact CA-OG1 3.49Å; I817-T820 PolarHBondContact O-N 2.84Å; I817-T820 VanDerWaalsContact O-N 3.13Å; I817-T820 PolarHBondContact O-OG1 3.18Å
821	F	34.2	Very low	46	Very low	112 Å²	112	108.9 Å²	108.9	49%	0.491	62%	0.618	S	S	.	*	H	α-helix	trans	-85.5	-14.7	-177.4	-136.8	-86.4	0	0	0	114.5	I803 I817 L823 S824	I803-F821 HydrophobicContact CD1-CD1 4.31Å; I803-F821 HydrophobicContact CD1-CE1 3.51Å; I803-F821 HydrophobicContact CD1-CZ 4.19Å; I817-F821 HydrophobicContact CG2-CB 4.39Å; I817-F821 WeakPolarHBondContact O-CB 3.17Å; I817-F821 PolarHBondContact O-N 2.9Å; F821-L823 PolarHBondContact O-N 3.21Å; F821-L823 VanDerWaalsContact O-N 3.12Å; F821-S824 PolarHBondContact O-N 3.12Å
822	A	35.4	Very low	47.2	Very low	83 Å²	83	104 Å²	104	69%	0.686	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-9.5	175.6	0	0	0	0	0	114.3
823	L	36.3	Very low	48.9	Very low	146 Å²	146	96.7 Å²	96.7	76%	0.764	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-1.6	179.3	-102.3	81.4	0	0	0	114.8	F821 S825	F821-L823 PolarHBondContact O-N 3.21Å; F821-L823 VanDerWaalsContact O-N 3.12Å; L823-S825 PolarHBondContact O-N 3.14Å
824	S	38.9	Very low	51	Low	85 Å²	85	91.2 Å²	91.2	59%	0.594	53%	0.528	S	S	*	.			trans	-96.4	38	-170.1	-169.3	0	0	0	0	115.1	F821 G826	F821-S824 PolarHBondContact O-N 3.12Å; S824-G826 PolarHBondContact O-N 3.47Å
825	S	48.9	Very low	53	Low	107 Å²	107	86.2 Å²	86.2	75%	0.748	51%	0.514	S	S	*	.			trans	-75.9	104.5	159.7	-66.9	0	0	0	0	108.3	L823 L827	L823-S825 PolarHBondContact O-N 3.14Å; S825-L827 PolarHBondContact O-N 3.48Å
826	G	48.8	Very low	55.2	Low	75 Å²	75	87 Å²	87	77%	0.773	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-58.6	128.4	177.7	0	0	0	0	0	110.9	S824 G828	S824-G826 PolarHBondContact O-N 3.47Å; G826-G828 PolarHBondContact O-N 3.03Å; G826-G828 VanDerWaalsContact O-N 3.12Å
827	L	60.2	Low	57.4	Low	98 Å²	98	84.5 Å²	84.5	51%	0.513	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-62.1	116.8	177.3	-87.6	72.9	0	0	0	109.5	L644 S825 I832	L644-L827 HydrophobicContact CD1-CD2 3.97Å; L644-L827 HydrophobicContact CD2-CD2 4.41Å; L644-L827 HydrophobicContact CD2-CG 4.49Å; S825-L827 PolarHBondContact O-N 3.48Å; L827-I832 HydrophobicContact CB-CD1 3.94Å; L827-I832 HydrophobicContact CD2-CD1 3.82Å; L827-I832 HydrophobicContact CD2-CG1 4.11Å
828	G	59.8	Low	59.5	Low	22 Å²	22	84.6 Å²	84.6	23%	0.227	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-59.5	142.2	171.2	0	0	0	0	0	110.9	G826 E830 N831	G826-G828 PolarHBondContact O-N 3.03Å; G826-G828 VanDerWaalsContact O-N 3.12Å; G828-E830 PolarHBondContact O-N 2.96Å; G828-E830 VanDerWaalsContact O-N 3.07Å; G828-N831 PolarHBondContact O-N 3.39Å
829	M	63.6	Low	61.9	Low	159 Å²	159	86.6 Å²	86.6	78%	0.783	50%	0.504	S	S	*	.	H	α-helix	trans	-58.9	-22.9	179.2	-170.1	167.8	64.8	0	0	112.3	N831 I832 G833	M829-N831 PolarHBondContact O-N 2.89Å; M829-I832 PolarHBondContact O-N 3.02Å; M829-G833 WeakPolarHBondContact O-CA 3.38Å; M829-G833 PolarHBondContact O-N 3.28Å
830	E	64.4	Low	64.5	Low	104 Å²	104	83.7 Å²	83.7	49%	0.486	49%	0.492	S	S	.	.	H	α-helix	trans	-58.8	-36.6	172	61.1	-132.9	149.4	0	0	114.3	G828 I832	G828-E830 PolarHBondContact O-N 2.96Å; G828-E830 VanDerWaalsContact O-N 3.07Å; E830-I832 VanDerWaalsContact C-N 3.35Å
831	N	67.8	Low	67.1	Low	29 Å²	29	82.1 Å²	82.1	16%	0.155	48%	0.484	C	S	.	.	H	α-helix	trans	-77.1	-20.6	179.7	-68.6	-4.6	0	0	0	113.3	P534 L644 G828 M829	P534-N831 WeakPolarHBondContact CG-OD1 3.38Å; L644-N831 HydrophobicContact CD2-CB 4.41Å; G828-N831 PolarHBondContact O-N 3.39Å; M829-N831 PolarHBondContact O-N 2.89Å
832	I	73.8	Confident	69.8	Low	57 Å²	57	78.8 Å²	78.8	29%	0.292	48%	0.481	S	S	.	.	H	α-helix	trans	-108.1	-19.3	-175.2	-51.2	-178.9	0	0	0	111	L827 M829 E830 G834 I835 F836	L827-I832 HydrophobicContact CB-CD1 3.94Å; L827-I832 HydrophobicContact CD2-CD1 3.82Å; L827-I832 HydrophobicContact CD2-CG1 4.11Å; M829-I832 PolarHBondContact O-N 3.02Å; E830-I832 VanDerWaalsContact C-N 3.35Å; I832-G834 VanDerWaalsContact C-N 3.31Å; I832-G834 PolarHBondContact O-N 3.48Å; I832-G834 VanDerWaalsContact O-N 3.13Å; I832-I835 HydrophobicContact CG2-CD1 4.3Å; I832-I835 WeakPolarHBondContact O-CB 3.33Å; I832-I835 PolarHBondContact O-N 3.21Å; I832-F836 HydrophobicContact CB-CE2 4.49Å; I832-F836 HydrophobicContact CG2-CD2 4.27Å; I832-F836 HydrophobicContact CG2-CE2 3.69Å
833	G	76.8	Confident	72.6	Confident	12 Å²	12	80 Å²	80	12%	0.124	48%	0.476	C	S	.	.	H	α-helix	trans	-52.4	-39.8	-171	0	0	0	0	0	115	M829 I835 F836 V837	M829-G833 WeakPolarHBondContact O-CA 3.38Å; M829-G833 PolarHBondContact O-N 3.28Å; G833-I835 VanDerWaalsContact C-N 3.27Å; G833-I835 PolarHBondContact O-N 3Å; G833-F836 PolarHBondContact O-N 3.36Å; G833-V837 PolarHBondContact O-N 3.35Å
834	G	82.8	Confident	75.2	Confident	1 Å²	1	78.2 Å²	78.2	1%	0.01	47%	0.466	C	S	.	.	H	α-helix	trans	-64	-27.3	178.3	0	0	0	0	0	114.5	Y536 I832 F836 V837 V838	Y536-G834 VanDerWaalsContact O-CA 3.22Å; Y536-G834 WeakPolarHBondContact O-CA 3.4Å; Y536-G834 PolarHBondContact O-N 2.83Å; I832-G834 VanDerWaalsContact C-N 3.31Å; I832-G834 PolarHBondContact O-N 3.48Å; I832-G834 VanDerWaalsContact O-N 3.13Å; G834-F836 VanDerWaalsContact C-N 3.34Å; G834-V837 PolarHBondContact O-N 3.15Å; G834-V838 WeakPolarHBondContact O-CG2 3.23Å; G834-V838 PolarHBondContact O-N 3.32Å
835	I	86.5	Confident	77.8	Confident	84 Å²	84	78.5 Å²	78.5	43%	0.431	46%	0.464	S	S	.	.	H	α-helix	trans	-66.3	-40.4	176.5	-59.2	175.9	0	0	0	110	F539 I832 G833 V838 L839	F539-I835 HydrophobicContact CB-CD1 4.36Å; F539-I835 HydrophobicContact CB-CG1 4.44Å; F539-I835 HydrophobicContact CD1-CG1 3.92Å; F539-I835 HydrophobicContact CD2-CG1 4.32Å; F539-I835 HydrophobicContact CE1-CG1 4.24Å; F539-I835 HydrophobicContact CG-CD1 4.39Å; F539-I835 HydrophobicContact CG-CG1 3.97Å; I832-I835 HydrophobicContact CG2-CD1 4.3Å; I832-I835 WeakPolarHBondContact O-CB 3.33Å; I832-I835 PolarHBondContact O-N 3.21Å; G833-I835 VanDerWaalsContact C-N 3.27Å; G833-I835 PolarHBondContact O-N 3Å; I835-V838 PolarHBondContact O-N 2.96Å; I835-L839 WeakPolarHBondContact O-CB 3.38Å; I835-L839 PolarHBondContact O-N 3.48Å
836	F	85.4	Confident	79.8	Confident	120 Å²	120	76.3 Å²	76.3	53%	0.526	45%	0.452	S	S	.	.	H	α-helix	trans	-66.7	-37.3	174.6	-65.8	-75.9	0	0	0	112.3	I832 G833 G834 L839 V840	I832-F836 HydrophobicContact CB-CE2 4.49Å; I832-F836 HydrophobicContact CG2-CD2 4.27Å; I832-F836 HydrophobicContact CG2-CE2 3.69Å; G833-F836 PolarHBondContact O-N 3.36Å; G834-F836 VanDerWaalsContact C-N 3.34Å; F836-L839 PolarHBondContact O-N 3.38Å; F836-V840 WeakPolarHBondContact O-CG2 3.42Å; F836-V840 PolarHBondContact O-N 2.92Å
837	V	86.5	Confident	81.8	Confident	77 Å²	77	77.2 Å²	77.2	47%	0.467	44%	0.438	S	S	.	.	H	α-helix	trans	-61.9	-47.2	174.3	177.1	0	0	0	0	110.8	G833 G834 L839 V840 C841	G833-V837 PolarHBondContact O-N 3.35Å; G834-V837 PolarHBondContact O-N 3.15Å; V837-L839 VanDerWaalsContact C-N 3.33Å; V837-L839 PolarHBondContact O-N 3.17Å; V837-V840 PolarHBondContact O-N 2.9Å; V837-C841 WeakPolarHBondContact O-CB 3.21Å; V837-C841 PolarHBondContact O-N 3.45Å; V837-C841 PolarHBondContact O-SG 3.14Å; V837-C841 VanDerWaalsContact O-SG 3.34Å
838	V	88.8	Confident	83.3	Confident	83 Å²	83	78.6 Å²	78.6	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-61.3	-41.5	176.7	172.8	0	0	0	0	111.4	F539 G834 I835 G842	F539-V838 HydrophobicContact CZ-CG2 4.27Å; G834-V838 WeakPolarHBondContact O-CG2 3.23Å; G834-V838 PolarHBondContact O-N 3.32Å; I835-V838 PolarHBondContact O-N 2.96Å; V838-G842 PolarHBondContact O-N 3.21Å
839	L	89.3	Confident	84.8	Confident	120 Å²	120	82 Å²	82	63%	0.628	45%	0.451	S	S	*	.	H	α-helix	trans	-60.8	-48.2	177.1	-173.4	75.9	0	0	0	112.2	I835 F836 V837 G842 L843	I835-L839 WeakPolarHBondContact O-CB 3.38Å; I835-L839 PolarHBondContact O-N 3.48Å; F836-L839 PolarHBondContact O-N 3.38Å; V837-L839 VanDerWaalsContact C-N 3.33Å; V837-L839 PolarHBondContact O-N 3.17Å; L839-G842 PolarHBondContact O-N 3.19Å; L839-L843 PolarHBondContact O-N 3.36Å
840	V	90.5	Very high	86	Confident	84 Å²	84	77.1 Å²	77.1	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-65.4	-44.3	180	171.4	0	0	0	0	111	F836 V837 G842 L843 L844	F836-V840 WeakPolarHBondContact O-CG2 3.42Å; F836-V840 PolarHBondContact O-N 2.92Å; V837-V840 PolarHBondContact O-N 2.9Å; V840-G842 VanDerWaalsContact C-N 3.35Å; V840-G842 PolarHBondContact O-N 3.44Å; V840-L843 PolarHBondContact O-N 3.29Å; V840-L844 HydrophobicContact CG1-CD1 4.07Å; V840-L844 WeakPolarHBondContact O-CG 3.41Å; V840-L844 PolarHBondContact O-N 2.82Å
841	C	90.4	Very high	87.1	Confident	66 Å²	66	75.8 Å²	75.8	45%	0.446	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-43.4	174.8	-71.2	0	0	0	0	111.9	V837 L843 L844 V845	V837-C841 WeakPolarHBondContact O-CB 3.21Å; V837-C841 PolarHBondContact O-N 3.45Å; V837-C841 PolarHBondContact O-SG 3.14Å; V837-C841 VanDerWaalsContact O-SG 3.34Å; C841-L843 PolarHBondContact O-N 3.29Å; C841-L844 PolarHBondContact O-N 3.13Å; C841-V845 WeakPolarHBondContact O-CG2 3.36Å; C841-V845 PolarHBondContact O-N 3.16Å
842	G	91.4	Very high	87.9	Confident	42 Å²	42	78.2 Å²	78.2	43%	0.433	45%	0.448	S	S	.	.	H	α-helix	trans	-61.4	-42	176	0	0	0	0	0	113	V838 L839 V840 V845 A846	V838-G842 PolarHBondContact O-N 3.21Å; L839-G842 PolarHBondContact O-N 3.19Å; V840-G842 VanDerWaalsContact C-N 3.35Å; V840-G842 PolarHBondContact O-N 3.44Å; G842-V845 PolarHBondContact O-N 2.71Å; G842-A846 WeakPolarHBondContact O-CB 3.39Å; G842-A846 PolarHBondContact O-N 2.93Å
843	L	93.4	Very high	88.7	Confident	110 Å²	110	81.6 Å²	81.6	58%	0.576	46%	0.463	S	S	*	.	H	α-helix	trans	-63.2	-45.7	175.6	-171.2	77	0	0	0	111.7	L839 V840 C841 V845 A846 I847	L839-L843 PolarHBondContact O-N 3.36Å; V840-L843 PolarHBondContact O-N 3.29Å; C841-L843 PolarHBondContact O-N 3.29Å; L843-V845 PolarHBondContact O-N 3.49Å; L843-A846 PolarHBondContact O-N 2.92Å; L843-I847 HydrophobicContact CD2-CD1 4.38Å; L843-I847 HydrophobicContact CG-CD1 3.99Å; L843-I847 VanDerWaalsContact O-CG1 3.32Å; L843-I847 WeakPolarHBondContact O-CG1 3.27Å; L843-I847 PolarHBondContact O-N 2.71Å
844	L	92.1	Very high	89	Confident	108 Å²	108	86.3 Å²	86.3	57%	0.565	48%	0.48	S	S	*	.	H	α-helix	trans	-62.7	-41.6	178.5	-71.5	171.5	0	0	0	111.9	V840 C841 I847 F848	V840-L844 HydrophobicContact CG1-CD1 4.07Å; V840-L844 WeakPolarHBondContact O-CG 3.41Å; V840-L844 PolarHBondContact O-N 2.82Å; C841-L844 PolarHBondContact O-N 3.13Å; L844-I847 PolarHBondContact O-N 2.92Å; L844-F848 VanDerWaalsContact O-CB 3.29Å; L844-F848 WeakPolarHBondContact O-CB 3.46Å; L844-F848 PolarHBondContact O-N 3.37Å
845	V	92.6	Very high	89	Confident	91 Å²	91	89.6 Å²	89.6	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-64.4	-42	174.5	171.8	0	0	0	0	111.2	C841 G842 L843 F848 M849	C841-V845 WeakPolarHBondContact O-CG2 3.36Å; C841-V845 PolarHBondContact O-N 3.16Å; G842-V845 PolarHBondContact O-N 2.71Å; L843-V845 PolarHBondContact O-N 3.49Å; V845-F848 PolarHBondContact O-N 3.42Å; V845-M849 HydrophobicContact CG1-CG 4.35Å; V845-M849 WeakPolarHBondContact O-CB 3.39Å; V845-M849 WeakPolarHBondContact O-CG 3.48Å; V845-M849 PolarHBondContact O-N 3.34Å
846	A	91.6	Very high	88.7	Confident	60 Å²	60	93.8 Å²	93.8	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-63.4	-43.7	177	0	0	0	0	0	112.3	G842 L843 M849 A850	G842-A846 WeakPolarHBondContact O-CB 3.39Å; G842-A846 PolarHBondContact O-N 2.93Å; L843-A846 PolarHBondContact O-N 2.92Å; A846-M849 PolarHBondContact O-N 3.36Å; A846-A850 WeakPolarHBondContact O-CB 3.33Å; A846-A850 PolarHBondContact O-N 3.04Å
847	I	91.1	Very high	88.4	Confident	94 Å²	94	94.2 Å²	94.2	48%	0.482	52%	0.515	S	S	.	.	H	α-helix	trans	-61.9	-45.6	174.5	-68.2	166	0	0	0	110.4	L843 L844 M849 A850 V851	L843-I847 HydrophobicContact CD2-CD1 4.38Å; L843-I847 HydrophobicContact CG-CD1 3.99Å; L843-I847 VanDerWaalsContact O-CG1 3.32Å; L843-I847 WeakPolarHBondContact O-CG1 3.27Å; L843-I847 PolarHBondContact O-N 2.71Å; L844-I847 PolarHBondContact O-N 2.92Å; I847-M849 PolarHBondContact O-N 2.95Å; I847-A850 PolarHBondContact O-N 3.48Å; I847-V851 WeakPolarHBondContact O-CG2 3.34Å; I847-V851 PolarHBondContact O-N 2.81Å
848	F	91.1	Very high	87.6	Confident	127 Å²	127	94.7 Å²	94.7	56%	0.557	52%	0.515	S	S	*	.	H	α-helix	trans	-62.1	-43.8	178.7	-179.7	-107.1	0	0	0	112.3	L844 V845 V851 L852	L844-F848 VanDerWaalsContact O-CB 3.29Å; L844-F848 WeakPolarHBondContact O-CB 3.46Å; L844-F848 PolarHBondContact O-N 3.37Å; V845-F848 PolarHBondContact O-N 3.42Å; F848-V851 PolarHBondContact O-N 3.15Å; F848-L852 HydrophobicContact CD1-CD1 3.93Å; F848-L852 HydrophobicContact CD1-CG 4.44Å; F848-L852 HydrophobicContact CE1-CD1 3.42Å; F848-L852 VanDerWaalsContact CE1-CD1 3.42Å; F848-L852 HydrophobicContact CE1-CG 4.1Å; F848-L852 HydrophobicContact CE2-CG 4.47Å; F848-L852 HydrophobicContact CZ-CD1 3.8Å; F848-L852 HydrophobicContact CZ-CD2 4.3Å; F848-L852 HydrophobicContact CZ-CG 4.12Å; F848-L852 WeakPolarHBondContact O-CG 3.44Å; F848-L852 PolarHBondContact O-N 3.26Å
849	M	90.6	Very high	86.8	Confident	93 Å²	93	99.5 Å²	99.5	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-63.8	-42	175.2	-72.1	-59.8	-60.6	0	0	112	V845 A846 I847 V851 L852 E853	V845-M849 HydrophobicContact CG1-CG 4.35Å; V845-M849 WeakPolarHBondContact O-CB 3.39Å; V845-M849 WeakPolarHBondContact O-CG 3.48Å; V845-M849 PolarHBondContact O-N 3.34Å; A846-M849 PolarHBondContact O-N 3.36Å; I847-M849 PolarHBondContact O-N 2.95Å; M849-V851 VanDerWaalsContact C-N 3.33Å; M849-V851 PolarHBondContact O-N 3.21Å; M849-L852 PolarHBondContact O-N 3.05Å; M849-L852 HydrophobicContact SD-CD1 4.22Å; M849-E853 WeakPolarHBondContact O-CG 3.49Å; M849-E853 PolarHBondContact O-N 3.48Å
850	A	88.6	Confident	85.7	Confident	57 Å²	57	99.7 Å²	99.7	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-37.8	175.1	0	0	0	0	0	112.4	A846 I847 F854	A846-A850 WeakPolarHBondContact O-CB 3.33Å; A846-A850 PolarHBondContact O-N 3.04Å; I847-A850 PolarHBondContact O-N 3.48Å; A850-F854 VanDerWaalsContact O-CB 3.27Å; A850-F854 WeakPolarHBondContact O-CB 3.49Å; A850-F854 PolarHBondContact O-N 2.88Å
851	V	87.3	Confident	84.1	Confident	77 Å²	77	98.9 Å²	98.9	47%	0.467	53%	0.529	S	S	.	.	H	α-helix	trans	-66.4	-41.6	172.9	170.2	0	0	0	0	111.3	I847 F848 M849 F854 V855	I847-V851 WeakPolarHBondContact O-CG2 3.34Å; I847-V851 PolarHBondContact O-N 2.81Å; F848-V851 PolarHBondContact O-N 3.15Å; M849-V851 VanDerWaalsContact C-N 3.33Å; M849-V851 PolarHBondContact O-N 3.21Å; V851-F854 PolarHBondContact O-N 3.01Å; V851-V855 HydrophobicContact CG1-CG2 4.41Å; V851-V855 WeakPolarHBondContact O-CB 3.48Å; V851-V855 VanDerWaalsContact O-CG2 3.29Å; V851-V855 WeakPolarHBondContact O-CG2 3.5Å; V851-V855 PolarHBondContact O-N 3.46Å
852	L	86.4	Confident	82.2	Confident	79 Å²	79	101.7 Å²	101.7	41%	0.414	55%	0.546	S	S	.	.	H	α-helix	trans	-63.5	-44.3	175.1	-74.6	-179.6	0	0	0	112.2	F848 M849 V855 W856	F848-L852 HydrophobicContact CD1-CD1 3.93Å; F848-L852 HydrophobicContact CD1-CG 4.44Å; F848-L852 HydrophobicContact CE1-CD1 3.42Å; F848-L852 VanDerWaalsContact CE1-CD1 3.42Å; F848-L852 HydrophobicContact CE1-CG 4.1Å; F848-L852 HydrophobicContact CE2-CG 4.47Å; F848-L852 HydrophobicContact CZ-CD1 3.8Å; F848-L852 HydrophobicContact CZ-CD2 4.3Å; F848-L852 HydrophobicContact CZ-CG 4.12Å; F848-L852 WeakPolarHBondContact O-CG 3.44Å; F848-L852 PolarHBondContact O-N 3.26Å; M849-L852 PolarHBondContact O-N 3.05Å; M849-L852 HydrophobicContact SD-CD1 4.22Å; L852-V855 PolarHBondContact O-N 3.47Å; L852-W856 VanDerWaalsContact O-CB 3.25Å; L852-W856 WeakPolarHBondContact O-CB 3.41Å; L852-W856 PolarHBondContact O-N 2.87Å
853	E	90.1	Very high	80.5	Confident	128 Å²	128	103.3 Å²	103.3	60%	0.598	56%	0.563	S	S	*	*	H	α-helix	trans	-62	-42.4	174.6	-75	-174.6	173.5	0	0	111.5	M849 W856 M857	M849-E853 WeakPolarHBondContact O-CG 3.49Å; M849-E853 PolarHBondContact O-N 3.48Å; E853-W856 PolarHBondContact O-N 3.38Å; E853-M857 WeakPolarHBondContact O-CB 3.24Å; E853-M857 WeakPolarHBondContact O-CG 3.3Å; E853-M857 PolarHBondContact O-N 3.37Å
854	F	83.3	Confident	78.1	Confident	112 Å²	112	105.9 Å²	105.9	49%	0.491	58%	0.577	S	S	.	*	H	α-helix	trans	-62.5	-46	176	-177	-109.1	0	0	0	112	A850 V851 M857 L858 V868	A850-F854 VanDerWaalsContact O-CB 3.27Å; A850-F854 WeakPolarHBondContact O-CB 3.49Å; A850-F854 PolarHBondContact O-N 2.88Å; V851-F854 PolarHBondContact O-N 3.01Å; F854-M857 PolarHBondContact O-N 2.85Å; F854-L858 HydrophobicContact CD1-CD1 3.81Å; F854-L858 HydrophobicContact CE1-CD1 3.46Å; F854-L858 VanDerWaalsContact CE1-CD1 3.46Å; F854-L858 HydrophobicContact CE1-CG 4.34Å; F854-L858 HydrophobicContact CG-CD1 4.48Å; F854-L858 HydrophobicContact CZ-CD1 3.86Å; F854-L858 HydrophobicContact CZ-CG 4.35Å; F854-L858 WeakPolarHBondContact O-CB 3.49Å; F854-L858 VanDerWaalsContact O-CG 3.31Å; F854-L858 WeakPolarHBondContact O-CG 3.32Å; F854-L858 PolarHBondContact O-N 3.45Å; F854-V868 HydrophobicContact CZ-CG1 4.49Å
855	V	82.2	Confident	76.3	Confident	70 Å²	70	110.1 Å²	110.1	42%	0.424	59%	0.594	S	S	.	*	H	α-helix	trans	-66	-36.7	176.3	170.6	0	0	0	0	111.8	V851 L852 K859	V851-V855 HydrophobicContact CG1-CG2 4.41Å; V851-V855 WeakPolarHBondContact O-CB 3.48Å; V851-V855 VanDerWaalsContact O-CG2 3.29Å; V851-V855 WeakPolarHBondContact O-CG2 3.5Å; V851-V855 PolarHBondContact O-N 3.46Å; L852-V855 PolarHBondContact O-N 3.47Å; V855-K859 PolarHBondContact O-N 2.77Å
856	W	81.1	Confident	74.3	Confident	171 Å²	171	113.7 Å²	113.7	65%	0.648	61%	0.605	S	S	*	*	H	α-helix	trans	-64.5	-47.7	174	-174.5	-60.1	0	0	0	111.1	L852 E853 L858 K859 Q860	L852-W856 VanDerWaalsContact O-CB 3.25Å; L852-W856 WeakPolarHBondContact O-CB 3.41Å; L852-W856 PolarHBondContact O-N 2.87Å; E853-W856 PolarHBondContact O-N 3.38Å; W856-L858 PolarHBondContact O-N 3.39Å; W856-K859 PolarHBondContact O-N 3.41Å; W856-K859 VanDerWaalsContact O-N 3.14Å; W856-Q860 PolarHBondContact O-N 3.25Å
857	M	77.6	Confident	72.5	Confident	129 Å²	129	114.7 Å²	114.7	64%	0.635	61%	0.608	S	S	*	*	H	α-helix	trans	-62.6	-40.6	177.7	-74.6	-72.8	-76.2	0	0	111.9	E853 F854 K859 Q860 A861	E853-M857 WeakPolarHBondContact O-CB 3.24Å; E853-M857 WeakPolarHBondContact O-CG 3.3Å; E853-M857 PolarHBondContact O-N 3.37Å; F854-M857 PolarHBondContact O-N 2.85Å; M857-K859 VanDerWaalsContact C-N 3.33Å; M857-K859 PolarHBondContact O-N 3.33Å; M857-Q860 PolarHBondContact O-N 3.01Å; M857-A861 PolarHBondContact O-N 2.87Å; M857-A861 VanDerWaalsContact O-N 3.12Å
858	L	70.6	Confident	71	Confident	88 Å²	88	113.7 Å²	113.7	46%	0.461	61%	0.606	S	S	.	*	H	α-helix	trans	-61.5	-38.7	172.2	-75.5	173.6	0	0	0	112.4	F854 W856	F854-L858 HydrophobicContact CD1-CD1 3.81Å; F854-L858 HydrophobicContact CE1-CD1 3.46Å; F854-L858 VanDerWaalsContact CE1-CD1 3.46Å; F854-L858 HydrophobicContact CE1-CG 4.34Å; F854-L858 HydrophobicContact CG-CD1 4.48Å; F854-L858 HydrophobicContact CZ-CD1 3.86Å; F854-L858 HydrophobicContact CZ-CG 4.35Å; F854-L858 WeakPolarHBondContact O-CB 3.49Å; F854-L858 VanDerWaalsContact O-CG 3.31Å; F854-L858 WeakPolarHBondContact O-CG 3.32Å; F854-L858 PolarHBondContact O-N 3.45Å; W856-L858 PolarHBondContact O-N 3.39Å
859	K	71.8	Confident	69.2	Low	183 Å²	183	112 Å²	112	80%	0.796	61%	0.609	S	S	*	*	H	α-helix	trans	-71.2	-26.2	174.5	-89.3	-173.9	171.9	-178.9	0	114.1	V855 W856 M857	V855-K859 PolarHBondContact O-N 2.77Å; W856-K859 PolarHBondContact O-N 3.41Å; W856-K859 VanDerWaalsContact O-N 3.14Å; M857-K859 VanDerWaalsContact C-N 3.33Å; M857-K859 PolarHBondContact O-N 3.33Å
860	Q	66.6	Low	67.7	Low	125 Å²	125	112.8 Å²	112.8	58%	0.584	61%	0.611	S	S	*	*	H	α-helix	trans	-89.4	-9.4	178.9	-77.2	-166.8	-24.9	0	0	114.2	W856 M857 P862	W856-Q860 PolarHBondContact O-N 3.25Å; M857-Q860 PolarHBondContact O-N 3.01Å; Q860-P862 VanDerWaalsContact O-CD 3.23Å; Q860-P862 WeakPolarHBondContact O-CD 3.08Å
861	A	56.6	Low	66.3	Low	67 Å²	67	115 Å²	115	55%	0.554	61%	0.612	S	S	*	*	S	Bend	trans	-78.7	111.8	175.8	0	0	0	0	0	111.2	M857 G863	M857-A861 PolarHBondContact O-N 2.87Å; M857-A861 VanDerWaalsContact O-N 3.12Å; A861-G863 PolarHBondContact O-N 3.48Å
862	P	49.3	Very low	64.9	Low	125 Å²	125	117.4 Å²	117.4	81%	0.812	62%	0.62	S	S	*	*			trans	-78.9	114.1	177	31.2	-29.8	0	0	0	110.1	Q860	Q860-P862 VanDerWaalsContact O-CD 3.23Å; Q860-P862 WeakPolarHBondContact O-CD 3.08Å
863	G	55.6	Low	63.6	Low	75 Å²	75	119.2 Å²	119.2	77%	0.773	63%	0.629	S	S	*	*	S	Bend	trans	38.1	87.7	157.5	0	0	0	0	0	117.9	A861	A861-G863 PolarHBondContact O-N 3.48Å
864	N	44.2	Very low	62	Low	165 Å²	165	119.8 Å²	119.8	88%	0.882	63%	0.626	S	S	*	*			trans	-148.7	120.8	146.3	-136	7.7	0	0	0	109.3	Q866	N864-Q866 PolarHBondContact O-N 2.99Å
865	E	53	Low	60.9	Low	197 Å²	197	120.9 Å²	120.9	92%	0.921	63%	0.633	S	S	*	*			trans	-76.8	102.7	-172.5	-66.3	179.5	139.6	0	0	111.4
866	Q	52.6	Low	59.8	Low	166 Å²	166	123 Å²	123	78%	0.776	64%	0.641	S	S	*	*			trans	-152.1	126.4	157.6	-109.7	160	15.3	0	0	109.1	N864 V868	N864-Q866 PolarHBondContact O-N 2.99Å; Q866-V868 PolarHBondContact O-N 3.23Å; Q866-V868 VanDerWaalsContact O-N 3.13Å
867	S	53.1	Low	58.7	Low	80 Å²	80	120.9 Å²	120.9	56%	0.559	64%	0.638	S	S	*	*			trans	-74.3	103.6	-173.1	39.5	0	0	0	0	111.7	C869 E870	S867-C869 PolarHBondContact O-N 2.9Å; S867-E870 PolarHBondContact O-N 3.3Å
868	V	58.4	Low	57.6	Low	74 Å²	74	116.4 Å²	116.4	45%	0.448	63%	0.625	S	S	.	*	H	α-helix	trans	-48.3	-28.1	179.1	-177.9	0	0	0	0	113.6	F854 Q866 E870 E871 M872	F854-V868 HydrophobicContact CZ-CG1 4.49Å; Q866-V868 PolarHBondContact O-N 3.23Å; Q866-V868 VanDerWaalsContact O-N 3.13Å; V868-E870 VanDerWaalsContact C-N 3.25Å; V868-E870 PolarHBondContact O-N 2.54Å; V868-E871 PolarHBondContact O-N 3.47Å; V868-M872 PolarHBondContact O-N 3.03Å
869	C	54.8	Low	56.9	Low	92 Å²	92	117.8 Å²	117.8	62%	0.622	63%	0.631	S	S	*	*	H	α-helix	trans	-57.7	-34.5	175.6	-164.5	0	0	0	0	113.3	S867 L873	S867-C869 PolarHBondContact O-N 2.9Å; C869-L873 PolarHBondContact O-N 2.78Å; C869-L873 VanDerWaalsContact O-N 3.16Å
870	E	58	Low	56.3	Low	108 Å²	108	114.5 Å²	114.5	51%	0.505	63%	0.626	S	S	.	*	H	α-helix	trans	-78	-35	-179.4	-155.3	-177.4	148.7	0	0	112.3	S867 V868 R874	S867-E870 PolarHBondContact O-N 3.3Å; V868-E870 VanDerWaalsContact C-N 3.25Å; V868-E870 PolarHBondContact O-N 2.54Å; E870-R874 WeakPolarHBondContact O-CB 3.44Å; E870-R874 PolarHBondContact O-N 3.46Å; E870-R874 VanDerWaalsContact O-N 3.15Å; E870-R874 IonicContact OE1-CZ 3.75Å; E870-R874 IonicContact OE1-NH2 3.04Å; E870-R874 PolarHBondContact OE1-NH2 2.86Å
871	E	58.8	Low	55.6	Low	103 Å²	103	114.2 Å²	114.2	48%	0.481	63%	0.628	S	S	.	*	H	α-helix	trans	-64.9	-43.6	172.9	-138.9	74.9	-126.3	0	0	110.7	V868 L873 R874 E875	V868-E871 PolarHBondContact O-N 3.47Å; E871-L873 PolarHBondContact O-N 2.93Å; E871-R874 WeakPolarHBondContact O-CB 3.22Å; E871-R874 PolarHBondContact O-N 3.16Å; E871-R874 VanDerWaalsContact O-N 3.13Å; E871-R874 IonicContact OE1-NH1 3.57Å; E871-E875 PolarHBondContact O-N 3.35Å
872	M	58.5	Low	55	Low	128 Å²	128	116.8 Å²	116.8	63%	0.631	64%	0.641	S	S	*	*	H	α-helix	trans	-67.2	-36.7	-178.7	-146.6	177.3	76.8	0	0	112.2	V868 R874 L876	V868-M872 PolarHBondContact O-N 3.03Å; M872-R874 VanDerWaalsContact C-N 3.33Å; M872-L876 WeakPolarHBondContact O-CB 3.49Å; M872-L876 PolarHBondContact O-N 3.19Å
873	L	58.9	Low	54.7	Low	117 Å²	117	121.3 Å²	121.3	61%	0.613	64%	0.642	S	S	*	*	H	α-helix	trans	-65	-36.2	171.4	-111.6	156.9	0	0	0	112.2	C869 E871 H877	C869-L873 PolarHBondContact O-N 2.78Å; C869-L873 VanDerWaalsContact O-N 3.16Å; E871-L873 PolarHBondContact O-N 2.93Å; L873-H877 WeakPolarHBondContact O-CB 3.5Å; L873-H877 PolarHBondContact O-N 3.4Å
874	R	57.7	Low	54	Low	140 Å²	140	125.9 Å²	125.9	53%	0.528	65%	0.648	S	S	.	*	H	α-helix	trans	-71.9	-40.4	179.4	-146	173.6	-77.7	143.6	-7.2	111.8	E870 E871 M872 G878	E870-R874 WeakPolarHBondContact O-CB 3.44Å; E870-R874 PolarHBondContact O-N 3.46Å; E870-R874 VanDerWaalsContact O-N 3.15Å; E870-R874 IonicContact OE1-CZ 3.75Å; E870-R874 IonicContact OE1-NH2 3.04Å; E870-R874 PolarHBondContact OE1-NH2 2.86Å; E871-R874 WeakPolarHBondContact O-CB 3.22Å; E871-R874 PolarHBondContact O-N 3.16Å; E871-R874 VanDerWaalsContact O-N 3.13Å; E871-R874 IonicContact OE1-NH1 3.57Å; M872-R874 VanDerWaalsContact C-N 3.33Å; R874-G878 PolarHBondContact O-N 3.12Å
875	E	59.8	Low	53.8	Low	136 Å²	136	123.2 Å²	123.2	64%	0.636	64%	0.643	S	S	*	*	H	α-helix	trans	-64.3	-47.6	170.6	-76	-96.7	139.4	0	0	111.9	E871 H877 G878 I879	E871-E875 PolarHBondContact O-N 3.35Å; E875-H877 VanDerWaalsContact C-N 3.29Å; E875-H877 PolarHBondContact O-N 2.93Å; E875-G878 WeakPolarHBondContact O-CA 3.46Å; E875-G878 PolarHBondContact O-N 3.41Å; E875-I879 WeakPolarHBondContact O-CG1 3.29Å; E875-I879 PolarHBondContact O-N 3.36Å
876	L	59.3	Low	53.3	Low	114 Å²	114	122.2 Å²	122.2	60%	0.597	64%	0.643	S	S	*	*	H	α-helix	trans	-59.5	-41.3	178.9	-160.2	90.7	0	0	0	111.5	M872 I879 V880	M872-L876 WeakPolarHBondContact O-CB 3.49Å; M872-L876 PolarHBondContact O-N 3.19Å; L876-I879 PolarHBondContact O-N 2.92Å; L876-V880 WeakPolarHBondContact O-CG2 3.35Å; L876-V880 PolarHBondContact O-N 3.2Å
877	H	56.8	Low	52.5	Low	127 Å²	127	123.1 Å²	123.1	59%	0.588	65%	0.647	S	S	*	*	H	α-helix	trans	-67	-36.1	175.5	-159.7	-128.4	0	0	0	111.9	L873 E875 L881	L873-H877 WeakPolarHBondContact O-CB 3.5Å; L873-H877 PolarHBondContact O-N 3.4Å; E875-H877 VanDerWaalsContact C-N 3.29Å; E875-H877 PolarHBondContact O-N 2.93Å; H877-L881 WeakPolarHBondContact O-CB 3.38Å; H877-L881 PolarHBondContact O-N 3.16Å
878	G	54.3	Low	51.6	Low	34 Å²	34	125.8 Å²	125.8	35%	0.351	66%	0.66	S	S	.	*	H	α-helix	trans	-65	-37.5	172.9	0	0	0	0	0	114	R874 E875 L881 C882	R874-G878 PolarHBondContact O-N 3.12Å; E875-G878 WeakPolarHBondContact O-CA 3.46Å; E875-G878 PolarHBondContact O-N 3.41Å; G878-L881 PolarHBondContact O-N 3.32Å; G878-C882 PolarHBondContact O-N 2.72Å
879	I	57.4	Low	50.2	Low	117 Å²	117	133.1 Å²	133.1	60%	0.6	68%	0.679	S	S	*	*	H	α-helix	trans	-68.6	-44	176.6	-67.5	163.9	0	0	0	110.8	E875 L876 L881 C882	E875-I879 WeakPolarHBondContact O-CG1 3.29Å; E875-I879 PolarHBondContact O-N 3.36Å; L876-I879 PolarHBondContact O-N 2.92Å; I879-L881 PolarHBondContact O-N 3.24Å; I879-C882 PolarHBondContact O-N 2.98Å
880	V	59.6	Low	49	Very low	115 Å²	115	139.6 Å²	139.6	70%	0.697	69%	0.69	S	S	*	*	H	α-helix	trans	-64.4	-25.1	176.6	171.4	0	0	0	0	112.4	L876	L876-V880 WeakPolarHBondContact O-CG2 3.35Å; L876-V880 PolarHBondContact O-N 3.2Å
881	L	51	Low	47.7	Very low	118 Å²	118	145.1 Å²	145.1	62%	0.618	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	6.5	177.2	-83.1	156.1	0	0	0	114.6	H877 G878 I879 R883	H877-L881 WeakPolarHBondContact O-CB 3.38Å; H877-L881 PolarHBondContact O-N 3.16Å; G878-L881 PolarHBondContact O-N 3.32Å; I879-L881 PolarHBondContact O-N 3.24Å; L881-R883 PolarHBondContact O-N 3.14Å
882	C	43.9	Very low	46.4	Very low	121 Å²	121	151.6 Å²	151.6	82%	0.818	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	38.2	61.7	176.5	-76.1	0	0	0	0	115.1	G878 I879	G878-C882 PolarHBondContact O-N 2.72Å; I879-C882 PolarHBondContact O-N 2.98Å
883	R	43.6	Very low	45	Very low	220 Å²	220	150.6 Å²	150.6	83%	0.83	74%	0.739	S	S	*	*			trans	-116.7	105.3	177.6	-161.2	174.5	-169.2	170.1	4	111.7	L881 S885	L881-R883 PolarHBondContact O-N 3.14Å; R883-S885 PolarHBondContact O-N 3.5Å
884	D	40.7	Very low	43.5	Very low	171 Å²	171	149.8 Å²	149.8	91%	0.914	75%	0.749	S	S	*	*			trans	-59.8	125.7	178.4	-79.2	-34.1	0	0	0	112.5
885	S	38.9	Very low	42.2	Very low	109 Å²	109	148.8 Å²	148.8	76%	0.762	76%	0.764	S	S	*	*			trans	-137.9	85.2	170.5	65.9	0	0	0	0	113.1	R883 Q887	R883-S885 PolarHBondContact O-N 3.5Å; S885-Q887 PolarHBondContact O-N 3.44Å
886	L	42.7	Very low	40.9	Very low	176 Å²	176	150.2 Å²	150.2	92%	0.921	78%	0.775	S	S	*	*			trans	-68	107.8	159.6	-83.4	164.3	0	0	0	110
887	Q	37.4	Very low	39.4	Very low	186 Å²	186	153.7 Å²	153.7	87%	0.869	79%	0.79	S	S	*	*			trans	-132.2	113.4	162.3	-75.5	-157.3	-2.9	0	0	113.4	S885	S885-Q887 PolarHBondContact O-N 3.44Å
888	V	32.7	Very low	37.9	Very low	136 Å²	136	159 Å²	159	82%	0.824	81%	0.805	S	S	*	*			trans	-79.2	119.6	172.2	174.1	0	0	0	0	109.9	R890	V888-R890 PolarHBondContact O-N 3.32Å; V888-R890 VanDerWaalsContact O-N 3.15Å
889	R	29.1	Very low	36.9	Very low	227 Å²	227	163.3 Å²	163.3	86%	0.857	83%	0.827	S	S	*	*			trans	-76.6	98.4	-176	-160.5	177.4	-165.6	178.8	7.2	112.1
890	R	30	Very low	35.4	Very low	228 Å²	228	169.6 Å²	169.6	86%	0.86	84%	0.843	S	S	*	*			trans	-102.1	101	178.1	-151.7	178	-163.1	174.8	5.6	111.1	V888	V888-R890 PolarHBondContact O-N 3.32Å; V888-R890 VanDerWaalsContact O-N 3.15Å
891	R	30.2	Very low	34.5	Very low	225 Å²	225	168.9 Å²	168.9	85%	0.849	84%	0.84	S	S	*	*			trans	-67.4	131.6	172.5	-74.9	-177.5	174.4	173.8	-1.6	110.2
892	R	32.6	Very low	33.6	Very low	239 Å²	239	169.8 Å²	169.8	90%	0.902	85%	0.845	S	S	*	*			trans	-109.9	136.9	167.2	-78.3	-177.7	175.2	167	-0.8	109.5
893	A	27.9	Very low	33.2	Very low	107 Å²	107	170.1 Å²	170.1	88%	0.884	85%	0.846	S	S	*	*			trans	-127.3	146.7	151.6	0	0	0	0	0	106.6
894	A	29	Very low	32.7	Very low	100 Å²	100	166.6 Å²	166.6	83%	0.826	84%	0.843	S	S	*	*			trans	-145.4	128.1	-171.4	0	0	0	0	0	113.5
895	S	29.9	Very low	32.1	Very low	119 Å²	119	167.1 Å²	167.1	83%	0.832	84%	0.84	S	S	*	*			trans	-161.8	91.2	155.8	44	0	0	0	0	106.5
896	L	31.9	Very low	31.6	Very low	166 Å²	166	169.4 Å²	169.4	87%	0.869	84%	0.838	S	S	*	*				81.5	96.6	69.9	-158.2	155.5	0	0	0	113.5
897	M	27.6	Very low	31	Very low	187 Å²	187	171.1 Å²	171.1	92%	0.921	83%	0.833	S	S	*	*			trans	-158.5	149.4	134.2	-110.2	-174	-177.5	0	0	113.6
898	R	26.6	Very low	30.7	Very low	239 Å²	239	174.6 Å²	174.6	90%	0.902	84%	0.838	S	S	*	*			trans	-60.7	153.9	-164.3	-72.6	168.1	162.5	160.9	-5.5	117.6
899	P	31.8	Very low	30.5	Very low	124 Å²	124	172.4 Å²	172.4	81%	0.805	83%	0.834	S	S	*	*			trans	-106.1	158.3	146.8	37.2	-29.2	0	0	0	113.4
900	R	27.1	Very low	30.5	Very low	249 Å²	249	173.6 Å²	173.6	94%	0.94	84%	0.839	S	S	*	*			trans	-147.1	160.3	162.2	-111.6	-160.6	171.6	176.9	-2.4	108.4
901	P	40.8	Very low	30.4	Very low	99 Å²	99	167.2 Å²	167.2	64%	0.643	84%	0.835	S	S	*	*				-136	172.3	-114.5	41.1	-24.6	0	0	0	117.2
902	L	31.3	Very low	30.3	Very low	138 Å²	138	161.4 Å²	161.4	72%	0.723	84%	0.835	S	S	*	*			trans	73.9	156.4	150.9	-79.8	169.4	0	0	0	117.3	L904	L902-L904 HydrophobicContact CD2-CD1 3.69Å
903	P	34.8	Very low	30	Very low	127 Å²	127	154.5 Å²	154.5	83%	0.825	83%	0.829	S	S	*	*			cis	-126.7	177	36.3	38.4	-20.5	0	0	0	119.6
904	L	32.8	Very low	30.1	Very low	146 Å²	146	155.9 Å²	155.9	76%	0.764	83%	0.826	S	S	*	*			trans	-77.6	156.7	175.3	-98.8	88.7	0	0	0	113.1	L902	L902-L904 HydrophobicContact CD2-CD1 3.69Å
905	E	29.3	Very low	29.9	Very low	183 Å²	183	155.8 Å²	155.8	86%	0.855	82%	0.819	S	S	*	*			trans	153.4	150.6	136.4	-89.7	-177.5	151.9	0	0	110.1
906	E	28.7	Very low	29.7	Very low	156 Å²	156	157.3 Å²	157.3	73%	0.729	82%	0.817	S	S	*	*			cis	-149.7	-173.4	-15.8	-145.1	-151.5	145.7	0	0	110
907	R	29.8	Very low	29.4	Very low	213 Å²	213	154.1 Å²	154.1	80%	0.804	81%	0.808	S	S	*	*			trans	-73	149.9	-171.4	-62.4	159.2	167.6	166.8	-5.4	114.8
908	R	30.2	Very low	29.4	Very low	258 Å²	258	153.5 Å²	153.5	97%	0.974	81%	0.809	S	S	*	*				-162.7	156.1	122.8	-107.7	168.4	-169.1	121.1	1.1	112.4
909	A	28.7	Very low	29.4	Very low	91 Å²	91	145.8 Å²	145.8	75%	0.752	80%	0.804	S	S	*	*			trans	-111.9	-177.2	-164.3	0	0	0	0	0	113.8
910	R	29.3	Very low	29.2	Very low	252 Å²	252	149.1 Å²	149.1	95%	0.951	81%	0.806	S	S	*	*			trans	100.4	133.7	-177.3	-62.5	169.6	-177.5	167.4	0.5	112.5
911	A	27.4	Very low	29.1	Very low	94 Å²	94	144.1 Å²	144.1	78%	0.777	80%	0.797	S	S	*	*			cis	-158.6	167.1	-5.2	0	0	0	0	0	112.1
912	A	29.2	Very low	28.3	Very low	103 Å²	103	145 Å²	145	85%	0.851	80%	0.804	S	S	*	*			trans	55.1	120.8	154	0	0	0	0	0	120.5
913	A	25.7	Very low	28	Very low	94 Å²	94	143.4 Å²	143.4	78%	0.777	81%	0.811	S	S	*	*			trans	-95.8	-157.1	165.7	0	0	0	0	0	111.7
914	V	29.4	Very low	27.4	Very low	135 Å²	135	140.3 Å²	140.3	82%	0.818	80%	0.802	S	S	*	*			trans	82.4	106.9	173.9	-174.2	0	0	0	0	113.4
915	S	24.9	Very low	27.1	Very low	99 Å²	99	140.7 Å²	140.7	69%	0.692	81%	0.81	S	S	*	*			cis	74.1	156.2	4.2	-154.2	0	0	0	0	118.4
916	L	26.5	Very low	27	Very low	151 Å²	151	135.8 Å²	135.8	79%	0.791	81%	0.809	S	S	*	*			trans	70.5	120.4	179.8	-55.2	167.2	0	0	0	114
917	S	25.8	Very low	27	Very low	98 Å²	98	136.3 Å²	136.3	69%	0.685	82%	0.816	S	S	*	*			cis	83.4	127	47.3	81.8	0	0	0	0	114.5
918	N	26.2	Very low	27.5	Very low	174 Å²	174	131 Å²	131	93%	0.93	81%	0.809	S	S	*	*			trans	-62.4	149.4	-173.6	-60.7	-35.6	0	0	0	114.8
919	G	27.8	Very low	27.5	Very low	77 Å²	77	126.1 Å²	126.1	79%	0.794	80%	0.797	S	S	*	*			trans	-179.6	61.1	174.2	0	0	0	0	0	118.9
920	K	26.7	Very low	28.1	Very low	194 Å²	194	126.3 Å²	126.3	84%	0.843	79%	0.791	S	S	*	*			trans	32.4	140.3	148.3	-96	177.6	172.4	179	0	123.7
921	L	26.2	Very low	28.2	Very low	145 Å²	145	121.9 Å²	121.9	76%	0.759	79%	0.785	S	S	*	*			trans	75.4	109.9	141.3	-76.5	160.1	0	0	0	120.8
922	C	24	Very low	28.6	Very low	116 Å²	116	122.1 Å²	122.1	78%	0.784	78%	0.781	S	S	*	*				172.5	148.4	92	-102.3	0	0	0	0	115
923	A	24	Very low	29	Very low	105 Å²	105	123.3 Å²	123.3	87%	0.868	77%	0.769	S	S	*	*			trans	44.8	129.7	151.2	0	0	0	0	0	123.6
924	G	23.8	Very low	29.7	Very low	62 Å²	62	129.3 Å²	129.3	64%	0.639	77%	0.772	S	S	*	*				119	103.2	126.8	0	0	0	0	0	120.1
925	T	25.5	Very low	30.1	Very low	154 Å²	154	129.6 Å²	129.6	95%	0.945	77%	0.768	S	S	*	*			trans	61.9	131.7	145.8	59.7	0	0	0	0	121.6
926	G	26.8	Very low	30.8	Very low	80 Å²	80	128.2 Å²	128.2	83%	0.825	76%	0.763	S	S	*	*			trans	128.2	100.8	156.3	0	0	0	0	0	117.1
927	L	29.4	Very low	31.4	Very low	168 Å²	168	127.6 Å²	127.6	88%	0.88	76%	0.756	S	S	*	*			trans	-74.2	172.6	164	-100.3	72.2	0	0	0	111.5
928	P	40.3	Very low	32.1	Very low	101 Å²	101	130 Å²	130	66%	0.656	76%	0.756	S	S	*	*			cis	-140.3	170.4	-36.7	38.2	-21	0	0	0	115.3
929	E	30.5	Very low	32.6	Very low	155 Å²	155	125.8 Å²	125.8	72%	0.724	75%	0.745	S	S	*	*			trans	64.5	165.6	148.8	-87.9	-163.9	171.8	0	0	122.1
930	P	41.3	Very low	33.1	Very low	96 Å²	96	125.6 Å²	125.6	62%	0.623	74%	0.736	S	S	*	*			cis	-132.9	124.1	-16.4	29.1	-8.4	0	0	0	114.2
931	L	31.6	Very low	33.5	Very low	159 Å²	159	123.5 Å²	123.5	83%	0.832	73%	0.733	S	S	*	*	S	Bend	trans	-142.5	-17.9	164.5	-146.4	85.6	0	0	0	115.2	H933	L931-H933 VanDerWaalsContact C-N 3.32Å; L931-H933 PolarHBondContact O-N 3.06Å
932	S	35.7	Very low	34	Very low	99 Å²	99	123.3 Å²	123.3	69%	0.692	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-19.4	-179	44.2	0	0	0	0	114.4	R934	S932-R934 PolarHBondContact O-N 2.97Å
933	H	37.7	Very low	34.5	Very low	128 Å²	128	122.1 Å²	122.1	59%	0.593	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-14.5	-173.8	-113.8	-69.3	0	0	0	115.4	L931	L931-H933 VanDerWaalsContact C-N 3.32Å; L931-H933 PolarHBondContact O-N 3.06Å
934	R	39.6	Very low	35.1	Very low	220 Å²	220	128.9 Å²	128.9	83%	0.83	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-28.1	-179	-71.9	-167.4	-178	-170.5	2.5	114.8	S932	S932-R934 PolarHBondContact O-N 2.97Å
935	L	38.3	Very low	35.3	Very low	140 Å²	140	129.2 Å²	129.2	73%	0.733	74%	0.743	S	S	*	*	H	α-helix	trans	-83.9	-23.1	-179.7	-74.2	168.8	0	0	0	113.7	Q937	L935-Q937 VanDerWaalsContact C-N 3.27Å; L935-Q937 PolarHBondContact O-N 3.19Å
936	A	39.6	Very low	35.4	Very low	71 Å²	71	128.2 Å²	128.2	59%	0.587	74%	0.741	S	S	*	*	H	α-helix	trans	-73.9	-18	174.8	0	0	0	0	0	113.4
937	Q	39.4	Very low	35.6	Very low	138 Å²	138	129.9 Å²	129.9	65%	0.645	74%	0.74	S	S	*	*	H	α-helix	trans	-94.7	-20.3	-172.3	-156.7	160.8	-4.8	0	0	113.6	L935	L935-Q937 VanDerWaalsContact C-N 3.27Å; L935-Q937 PolarHBondContact O-N 3.19Å
938	E	40.5	Very low	35.5	Very low	149 Å²	149	130.3 Å²	130.3	70%	0.696	74%	0.737	S	S	*	*	H	α-helix	trans	-81.3	-27.4	174.2	-67.5	-174.2	152.1	0	0	112.8	A940	E938-A940 VanDerWaalsContact C-N 3.26Å; E938-A940 PolarHBondContact O-N 3.21Å
939	A	36.8	Very low	35	Very low	85 Å²	85	133.2 Å²	133.2	70%	0.702	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-17.3	174.7	0	0	0	0	0	113.8
940	A	37.3	Very low	34.9	Very low	73 Å²	73	137.3 Å²	137.3	60%	0.603	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-4.8	-175.9	0	0	0	0	0	114.5	E938	E938-A940 VanDerWaalsContact C-N 3.26Å; E938-A940 PolarHBondContact O-N 3.21Å
941	L	35.7	Very low	34.3	Very low	149 Å²	149	139.8 Å²	139.8	78%	0.78	76%	0.761	S	S	*	*	S	Bend	trans	-100.7	-3	-170.9	-103.4	164.1	0	0	0	115.7
942	V	36.3	Very low	34	Very low	141 Å²	141	137.8 Å²	137.8	86%	0.855	76%	0.758	S	S	*	*	S	Bend	trans	-94.5	-9.7	178.9	-177.5	0	0	0	0	112.7
943	A	34	Very low	34	Very low	91 Å²	91	138.1 Å²	138.1	75%	0.752	76%	0.758	S	S	*	*	S	Bend	trans	-104	35	-172.8	0	0	0	0	0	115
944	R	37.8	Very low	33.6	Very low	247 Å²	247	141.3 Å²	141.3	93%	0.932	77%	0.774	S	S	*	*			trans	-139.4	88.9	169.6	-78.1	-169.6	173.9	173.7	-0.9	112.1
945	G	27.7	Very low	33.3	Very low	70 Å²	70	137.3 Å²	137.3	72%	0.722	78%	0.778	S	S	*	*			trans	-168	140.1	170.2	0	0	0	0	0	112.1
946	C	26.6	Very low	32.8	Very low	132 Å²	132	142.3 Å²	142.3	89%	0.892	79%	0.787	S	S	*	*			trans	65.7	71.5	168.5	-60.6	0	0	0	0	118	H948	C946-H948 PolarHBondContact O-N 3.41Å; C946-H948 VanDerWaalsContact O-N 3.17Å
947	S	31.4	Very low	32.3	Very low	115 Å²	115	149.4 Å²	149.4	80%	0.804	80%	0.798	S	S	*	*			trans	-67.8	94.6	147.7	52.7	0	0	0	0	110.9
948	H	27.2	Very low	31.8	Very low	178 Å²	178	151.7 Å²	151.7	82%	0.824	81%	0.806	S	S	*	*			trans	-156.4	89.6	164	-99.6	-64.3	0	0	0	111.5	C946	C946-H948 PolarHBondContact O-N 3.41Å; C946-H948 VanDerWaalsContact O-N 3.17Å
949	I	28.9	Very low	31	Very low	161 Å²	161	154.6 Å²	154.6	83%	0.826	82%	0.82	S	S	*	*			trans	-91.2	107.8	163.6	-70	174.4	0	0	0	107.7	I951	I949-I951 HydrophobicContact CG2-CG1 4.02Å
950	R	28.8	Very low	30.5	Very low	241 Å²	241	153.6 Å²	153.6	91%	0.909	82%	0.818	S	S	*	*			trans	-77.3	117.9	162.2	-82.9	-177.1	173.2	170.9	-1.8	108.2
951	I	30	Very low	30	Very low	149 Å²	149	158.7 Å²	158.7	76%	0.764	83%	0.834	S	S	*	*			trans	-91.3	128.5	165.3	-63.7	171.5	0	0	0	107.7	I949	I949-I951 HydrophobicContact CG2-CG1 4.02Å
952	C	24.6	Very low	29.5	Very low	116 Å²	116	163.4 Å²	163.4	78%	0.784	84%	0.841	S	S	*	*			trans	-143.6	155.8	167.2	-118	0	0	0	0	108.2
953	P	35	Very low	29	Very low	107 Å²	107	165.6 Å²	165.6	70%	0.695	85%	0.845	S	S	*	*	S	Bend		-138.7	107.4	-100.5	34.6	-15.3	0	0	0	114.9
954	E	30.3	Very low	28.6	Very low	195 Å²	195	172.7 Å²	172.7	91%	0.911	85%	0.852	S	S	*	*	S	Bend	trans	-139.9	13.4	171.2	-83.5	-145.6	144.4	0	0	116.4
955	C	33	Very low	28.4	Very low	135 Å²	135	166.2 Å²	166.2	91%	0.912	84%	0.842	S	S	*	*			trans	-128.2	65.2	177.7	-72.7	0	0	0	0	113
956	R	28.7	Very low	28.3	Very low	245 Å²	245	168.1 Å²	168.1	93%	0.925	85%	0.851	S	S	*	*			trans	-144.9	59.2	173.4	-150.5	180	-165.9	-174.4	4.4	115.2
957	R	27.7	Very low	28.3	Very low	221 Å²	221	165.3 Å²	165.3	83%	0.834	84%	0.844	S	S	*	*			trans	-166.7	128.9	161.6	-103.5	176.1	-175.5	176.5	1.6	105.7
958	F	28.6	Very low	28	Very low	185 Å²	185	165.3 Å²	165.3	81%	0.811	85%	0.851	S	S	*	*			cis	-133.8	136.9	5	-87	-103.2	0	0	0	110.5
959	Q	23.9	Very low	28	Very low	210 Å²	210	160.5 Å²	160.5	98%	0.981	85%	0.85	S	S	*	*			trans	-151.9	115.1	146.3	-116.2	-176	12.6	0	0	110.2
960	G	26.3	Very low	27.9	Very low	64 Å²	64	162.5 Å²	162.5	66%	0.66	86%	0.856	S	S	*	*			trans	-177.1	140.3	175.1	0	0	0	0	0	105.8
961	L	27.6	Very low	27.8	Very low	180 Å²	180	155.7 Å²	155.7	94%	0.942	85%	0.851	S	S	*	*			cis	-146.3	147.2	23.5	-74	142.9	0	0	0	111.6
962	R	24.9	Very low	27.7	Very low	248 Å²	248	156.4 Å²	156.4	94%	0.936	86%	0.856	S	S	*	*			trans	-162.9	115.1	145.7	-141.2	178.4	-169.9	175.7	4.5	112.5
963	M	26.2	Very low	28.5	Very low	187 Å²	187	156.2 Å²	156.2	92%	0.921	85%	0.853	S	S	*	*			trans	-169.2	122.4	153.9	-101	179.2	-169.9	0	0	106.8
964	R	24.6	Very low	28	Very low	241 Å²	241	156 Å²	156	91%	0.909	85%	0.854	S	S	*	*				68.3	156.4	79.3	-107.1	-167.8	175.3	174.6	-0.6	114.1
965	P	33.7	Very low	28.4	Very low	111 Å²	111	151.8 Å²	151.8	72%	0.721	84%	0.843	S	S	*	*				-126.6	179.9	-110.1	42.2	-27.4	0	0	0	116.8
966	A	26.3	Very low	28.1	Very low	109 Å²	109	151.1 Å²	151.1	90%	0.901	84%	0.835	S	S	*	*			trans	68.1	147	168.2	0	0	0	0	0	117.7
967	G	25.5	Very low	28.1	Very low	73 Å²	73	147.2 Å²	147.2	75%	0.753	83%	0.827	S	S	*	*			cis	173.8	174.1	-6.7	0	0	0	0	0	113.1
968	A	27	Very low	27.9	Very low	115 Å²	115	140.6 Å²	140.6	95%	0.95	82%	0.815	S	S	*	*			trans	73.8	136	168.4	0	0	0	0	0	121.1
969	G	26.5	Very low	27.8	Very low	78 Å²	78	140.4 Å²	140.4	80%	0.804	82%	0.816	S	S	*	*			trans	145.9	111.9	166.7	0	0	0	0	0	115.3
970	E	26.5	Very low	28	Very low	202 Å²	202	139.6 Å²	139.6	94%	0.944	81%	0.813	S	S	*	*			trans	-60.2	166.8	-177.6	-57.5	155.1	136.6	0	0	114.4
971	A	26.4	Very low	27.9	Very low	99 Å²	99	141.6 Å²	141.6	82%	0.818	82%	0.817	S	S	*	*			cis	-158.6	176.5	25.9	0	0	0	0	0	114.4
972	L	28.8	Very low	28	Very low	164 Å²	164	140.3 Å²	140.3	86%	0.859	81%	0.809	S	S	*	*			trans	-82.8	177.7	172.3	-111.3	76.2	0	0	0	112.7
973	P	41	Very low	28	Very low	112 Å²	112	136.5 Å²	136.5	73%	0.727	80%	0.802	S	S	*	*			cis	-133.6	180	5.5	32.8	-9.7	0	0	0	117.9
974	S	24.8	Very low	28.1	Very low	102 Å²	102	138.1 Å²	138.1	71%	0.713	80%	0.798	S	S	*	*			trans	-53.1	171.6	167.6	56.8	0	0	0	0	115.7
975	P	39.5	Very low	28.2	Very low	106 Å²	106	132.1 Å²	132.1	69%	0.688	78%	0.784	S	S	*	*			cis	-155.4	177.4	33.8	42.8	-19.7	0	0	0	121.9
976	T	26.6	Very low	28	Very low	121 Å²	121	135.8 Å²	135.8	74%	0.742	79%	0.788	S	S	*	*			trans	72.5	145.9	146.3	43.9	0	0	0	0	124.8
977	H	26.9	Very low	28.1	Very low	163 Å²	163	135.9 Å²	135.9	76%	0.755	78%	0.778	S	S	*	*			trans	101.6	107.7	145.1	-94.3	-71.9	0	0	0	122.7
978	S	25.4	Very low	28.3	Very low	82 Å²	82	139.1 Å²	139.1	57%	0.573	78%	0.783	S	S	*	*				47.7	137.7	129.9	55.2	0	0	0	0	124.4
979	E	26	Very low	28.4	Very low	181 Å²	181	141.5 Å²	141.5	85%	0.846	78%	0.78	S	S	*	*			trans	58.3	118.9	141.2	-65.5	172.2	143.8	0	0	119.8
980	E	27.2	Very low	28.5	Very low	193 Å²	193	143 Å²	143	90%	0.902	78%	0.778	S	S	*	*				-168.3	152.1	101.5	-108.6	-176.7	163.8	0	0	113.2
981	S	24.8	Very low	28.6	Very low	106 Å²	106	138.6 Å²	138.6	74%	0.741	77%	0.77	S	S	*	*			trans	-80	142.3	176.4	48.3	0	0	0	0	112.8
982	I	28.7	Very low	28.8	Very low	153 Å²	153	142.6 Å²	142.6	79%	0.785	77%	0.772	S	S	*	*			trans	-129.1	103.2	155.5	-60.4	-176.6	0	0	0	109.7
983	E	25.6	Very low	29.9	Very low	168 Å²	168	140.6 Å²	140.6	79%	0.785	77%	0.768	S	S	*	*			trans	-75	143.4	165.5	-176.1	170.7	-133.9	0	0	109.6
984	W	28.8	Very low	29.3	Very low	221 Å²	221	148 Å²	148	84%	0.837	79%	0.793	S	S	*	*			trans	-131.5	90.9	166.7	-100.6	95.8	0	0	0	109.6
985	D	27.2	Very low	29.5	Very low	115 Å²	115	150.3 Å²	150.3	62%	0.615	80%	0.797	S	S	*	*			trans	-77.9	138.9	175.4	-152.7	-0.6	0	0	0	110.6
986	K	28.9	Very low	29	Very low	188 Å²	188	152.6 Å²	152.6	82%	0.817	80%	0.803	S	S	*	*			trans	-151.5	82	166.3	-105.3	-168.9	-176.8	179.4	0	110.5
987	T	28	Very low	29.1	Very low	111 Å²	111	154.4 Å²	154.4	68%	0.681	81%	0.806	S	S	*	*			trans	-75	129	166	51.7	0	0	0	0	111.8
988	T	30.4	Very low	29.3	Very low	141 Å²	141	153.9 Å²	153.9	87%	0.865	81%	0.809	S	S	*	*			trans	-140.7	109	151.2	45.5	0	0	0	0	109.4
989	N	29.5	Very low	29.5	Very low	165 Å²	165	158.4 Å²	158.4	88%	0.882	82%	0.824	S	S	*	*			trans	-69.7	141.5	170.1	-76.9	-25.8	0	0	0	111
990	S	28.4	Very low	29.7	Very low	109 Å²	109	156.9 Å²	156.9	76%	0.762	82%	0.823	S	S	*	*			trans	-172.2	115.7	130.6	57.3	0	0	0	0	113
991	S	28	Very low	29.9	Very low	110 Å²	110	154.3 Å²	154.3	77%	0.769	82%	0.817	S	S	*	*			trans	47.7	104.5	140.4	60.9	0	0	0	0	120.9
992	E	31.2	Very low	30.3	Very low	184 Å²	184	158 Å²	158	86%	0.86	82%	0.823	S	S	*	*				-52.7	161.4	128.6	-92.4	172.5	-172.9	0	0	111.5
993	P	50.2	Low	30.4	Very low	121 Å²	121	158.4 Å²	158.4	79%	0.786	83%	0.826	S	S	*	*			cis	-140.2	151.4	36.1	40.2	-22.2	0	0	0	118.4
994	E	29	Very low	30.9	Very low	268 Å²	268	157.5 Å²	157.5	100%	1.252	83%	0.83	S	S	*	*				-167.5	0	121.4	-109.4	-175.9	-175.2	0	0	110.8

Retrieved 994 of 994 residues in 1234.3 ms (Link to these results)

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