A0A096MQR0_PAPAN Loading...

Ankyrin repeat and LEM domain-containing protein 2

Involved in mitotic nuclear envelope reassembly by promoting dephosphorylation of BAF/BANF1 during mitotic exit. Coordinates the control of BAF/BANF1 dephosphorylation by inhibiting VRK1 kinase and promoting dephosphorylation of BAF/BANF1 by protein phosphatase 2A (PP2A), thereby facilitating nuclear envelope assembly. May regulate nuclear localization of VRK1 in non-dividing cells. It is unclear whether it acts as a real PP2A regulatory subunit or whether it is involved in recruitment of the PP2A complex. Involved in brain development.

AlphaFold DB , UniProt , Accession A0A096MQR0, Species PAPAN (Papio anubis, Olive baboon), Gene ANKLE2, Length 939 aa.

						>A0A096MQR0_PAPAN|A0A096MQR0|ANKLE2
MLWPRLAAAEWAALAWELLGASVLLIAVRWLVRRLGPRPGGLGRSGTPVPPPPAAAAPAPGEMTMDAVLARLKLLNPDDLREEIVKAGLKCGPITSTTRFIFEKKLAQALLEQGGRLPSFDHHEAGATALSQDTQRILKSAEGNPTDQAGFSEDRDFGYSVGLNPPEEEAVTSKTRSVPPSAVDTYGTAVTASKEPPLYYGVCPVYEDVPARNERIHVYENKKEALQAVKMIKGSRFKAFSTREDAEKFARGICDYFPSPSRPSLPLSPVKTAPLFSNDGLKDGLCLSESETVNKERANSYKNPRTQDLTAKLRKAVEKGEEDTFSDLIWSNPRYLIGSGDNPTIVQEGCRYNVMHVAAKENQASICRLTLDVLENPDFMRLMYPDDDEAMLQKRIRYVVDLYLNTPDKMGYDTPLHFACKFGSADVVNVLSSHHLIVKNPRNKYDKTPEDVICERSKNKSVELKERIREYLKGHYYVPLLRAEDTSSPVIGELWSPDQTAEASHVSRHGGSPRDPVLTLRAFAGPLSPAKAEDFRKLWKTPPREKAGFLHHVKKSDPERGFERVGRELAHELGYPWVEYWEFLGCFVDLSSQEGLQRLEEYLTQQEIGKKAQQETGEREASCGDKATMSGSNSISVRAFLDEDDMSLEEIKNRQNAARNNSPPTVGAFGYARCSIFPLEQEADLIEAAEPGGPHSSRNGLCHPLSHSRTLVGKRPKAPRGEEAHLPPVSDLTVEFDKLNLQNVGSSVSKTPDENTKTKDKILTSRIDAVERDLLEPPPPADQLGPGRRRTESEMSARIANMSLSPSSPGHEGQLEVTRESARRLFLFGEEPSKLDQDVLAALECADVDPHQFPAVHRWKTAVLCYSPSDRQSWPSPAVKGKFKSRLPDLSGPHSYSPGRNSAAGSNPGKPGPGSPGRYSPAHGNQLRRMARLAELAAL
					

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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	47	Very low	55.1	Low	233 Å²	233	135.6 Å²	135.6	100%	1.148	67%	0.672	S	S	*	*				0	83.9	0	-68	173.1	170.9	0	0	109.7
2	L	47.4	Very low	56.2	Low	137 Å²	137	128 Å²	128	72%	0.717	65%	0.646	S	S	*	*			trans	-130.1	-38	-177.6	-87.2	162.8	0	0	0	114.1	R5	L2-R5 PolarHBondContact O-N 2.98Å; L2-R5 VanDerWaalsContact O-N 3.12Å
3	W	43	Very low	57.3	Low	232 Å²	232	122.5 Å²	122.5	88%	0.879	63%	0.632	S	S	*	*	H	α-helix	trans	-49.3	-44.8	-179.9	-111.8	-54.2	0	0	0	115.9	R5 L6	W3-R5 PolarHBondContact O-N 3.01Å; W3-R5 VanDerWaalsContact O-N 3.09Å; W3-L6 PolarHBondContact O-N 3.31Å
4	P	54.3	Low	58.2	Low	103 Å²	103	120.3 Å²	120.3	67%	0.669	62%	0.621	S	S	*	*	H	α-helix	trans	-63.6	-17.3	-177.8	-25.1	35.4	0	0	0	115.3
5	R	51.8	Low	59.3	Low	205 Å²	205	115.7 Å²	115.7	77%	0.774	61%	0.608	S	S	*	*	H	α-helix	trans	-89	-23.6	-179.1	-72.8	-173.4	171.5	-171.5	-2.9	113.8	L2 W3	L2-R5 PolarHBondContact O-N 2.98Å; L2-R5 VanDerWaalsContact O-N 3.12Å; W3-R5 PolarHBondContact O-N 3.01Å; W3-R5 VanDerWaalsContact O-N 3.09Å
6	L	51.4	Low	60.6	Low	106 Å²	106	120.5 Å²	120.5	56%	0.555	62%	0.616	S	S	*	*	H	α-helix	trans	-71.5	-53.7	176.2	-96.6	145.4	0	0	0	111	W3 A8 A9 E10	W3-L6 PolarHBondContact O-N 3.31Å; L6-A8 VanDerWaalsContact C-N 3.25Å; L6-A8 PolarHBondContact O-N 3.44Å; L6-A9 WeakPolarHBondContact O-CB 3.45Å; L6-A9 PolarHBondContact O-N 2.72Å; L6-E10 PolarHBondContact O-N 3.1Å
7	A	56.8	Low	61.8	Low	42 Å²	42	122.1 Å²	122.1	35%	0.347	62%	0.62	S	S	.	*	H	α-helix	trans	-56	-39.9	178.3	0	0	0	0	0	112.4	A9 E10 W11	A7-A9 VanDerWaalsContact C-N 3.27Å; A7-A9 PolarHBondContact O-N 3.16Å; A7-E10 PolarHBondContact O-N 3.48Å; A7-W11 PolarHBondContact O-N 3.26Å
8	A	58.4	Low	62.7	Low	62 Å²	62	122.1 Å²	122.1	51%	0.512	62%	0.621	S	S	.	*	H	α-helix	trans	-62.9	-30.6	177.6	0	0	0	0	0	113.6	L6 A12	L6-A8 VanDerWaalsContact C-N 3.25Å; L6-A8 PolarHBondContact O-N 3.44Å; A8-A12 WeakPolarHBondContact O-CB 3.34Å; A8-A12 PolarHBondContact O-N 2.89Å
9	A	61.1	Low	63.8	Low	61 Å²	61	120.9 Å²	120.9	50%	0.504	62%	0.616	S	S	.	*	H	α-helix	trans	-76.2	-39.4	175.9	0	0	0	0	0	112	L6 A7 A12 A13	L6-A9 WeakPolarHBondContact O-CB 3.45Å; L6-A9 PolarHBondContact O-N 2.72Å; A7-A9 VanDerWaalsContact C-N 3.27Å; A7-A9 PolarHBondContact O-N 3.16Å; A9-A12 PolarHBondContact O-N 2.86Å; A9-A13 PolarHBondContact O-N 2.94Å
10	E	64.3	Low	64.8	Low	118 Å²	118	116.8 Å²	116.8	55%	0.551	61%	0.605	S	S	*	*	H	α-helix	trans	-65.8	-44.6	177.7	-66.6	167.6	163	0	0	111.5	L6 A7 A12 A13 L14	L6-E10 PolarHBondContact O-N 3.1Å; A7-E10 PolarHBondContact O-N 3.48Å; E10-A12 VanDerWaalsContact C-N 3.31Å; E10-A12 PolarHBondContact O-N 3.36Å; E10-A13 PolarHBondContact O-N 3.05Å; E10-L14 PolarHBondContact O-N 3.45Å; E10-L14 VanDerWaalsContact O-N 3.08Å
11	W	70.1	Confident	65.6	Low	193 Å²	193	113.7 Å²	113.7	73%	0.731	60%	0.596	S	S	*	*	H	α-helix	trans	-63.4	-34.9	173.1	-77.2	111	0	0	0	112.9	A7 L14 A15	A7-W11 PolarHBondContact O-N 3.26Å; W11-L14 HydrophobicContact CE3-CD1 4.49Å; W11-A15 WeakPolarHBondContact O-CB 3.15Å; W11-A15 PolarHBondContact O-N 2.89Å; W11-A15 VanDerWaalsContact O-N 3.11Å
12	A	69.3	Low	67.2	Low	44 Å²	44	105.5 Å²	105.5	36%	0.364	56%	0.562	S	S	.	*	H	α-helix	trans	-67	-42.7	174.2	0	0	0	0	0	111.8	A8 A9 E10 A15 W16	A8-A12 WeakPolarHBondContact O-CB 3.34Å; A8-A12 PolarHBondContact O-N 2.89Å; A9-A12 PolarHBondContact O-N 2.86Å; E10-A12 VanDerWaalsContact C-N 3.31Å; E10-A12 PolarHBondContact O-N 3.36Å; A12-A15 PolarHBondContact O-N 2.7Å; A12-W16 PolarHBondContact O-N 3.33Å
13	A	70.4	Confident	69.1	Low	56 Å²	56	103.6 Å²	103.6	46%	0.463	56%	0.556	S	S	.	*	H	α-helix	trans	-59.7	-48.7	176.9	0	0	0	0	0	111.7	A9 E10 A15 W16 E17	A9-A13 PolarHBondContact O-N 2.94Å; E10-A13 PolarHBondContact O-N 3.05Å; A13-A15 VanDerWaalsContact C-N 3.31Å; A13-A15 PolarHBondContact O-N 3.29Å; A13-W16 PolarHBondContact O-N 3.17Å; A13-W16 VanDerWaalsContact O-N 3.13Å; A13-E17 PolarHBondContact O-N 2.99Å
14	L	69	Low	71.1	Confident	92 Å²	92	97.9 Å²	97.9	48%	0.482	54%	0.542	S	S	.	.	H	α-helix	trans	-59.9	-38.3	176.4	-71.4	170.4	0	0	0	112.8	E10 W11 E17 L18	E10-L14 PolarHBondContact O-N 3.45Å; E10-L14 VanDerWaalsContact O-N 3.08Å; W11-L14 HydrophobicContact CE3-CD1 4.49Å; L14-E17 PolarHBondContact O-N 3.11Å; L14-L18 WeakPolarHBondContact O-CB 3.21Å; L14-L18 WeakPolarHBondContact O-CG 3.21Å; L14-L18 PolarHBondContact O-N 2.81Å
15	A	74.8	Confident	72.5	Confident	51 Å²	51	99 Å²	99	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-65.5	-38.1	175.6	0	0	0	0	0	112.6	W11 A12 A13 L19	W11-A15 WeakPolarHBondContact O-CB 3.15Å; W11-A15 PolarHBondContact O-N 2.89Å; W11-A15 VanDerWaalsContact O-N 3.11Å; A12-A15 PolarHBondContact O-N 2.7Å; A13-A15 VanDerWaalsContact C-N 3.31Å; A13-A15 PolarHBondContact O-N 3.29Å; A15-L19 PolarHBondContact O-N 3.16Å; A15-L19 VanDerWaalsContact O-N 3.07Å
16	W	79.7	Confident	74	Confident	193 Å²	193	95 Å²	95	73%	0.731	53%	0.534	S	S	*	.	H	α-helix	trans	-69.3	-38.2	175	-78.6	111.1	0	0	0	112.7	A12 A13 L19 G20	A12-W16 PolarHBondContact O-N 3.33Å; A13-W16 PolarHBondContact O-N 3.17Å; A13-W16 VanDerWaalsContact O-N 3.13Å; W16-L19 HydrophobicContact CE3-CD1 4.4Å; W16-L19 PolarHBondContact O-N 3.38Å; W16-G20 PolarHBondContact O-N 3.28Å
17	E	81.1	Confident	75.5	Confident	148 Å²	148	92.4 Å²	92.4	69%	0.692	53%	0.528	S	S	*	.	H	α-helix	trans	-67.1	-40.7	174.7	-68.6	-157.5	157.3	0	0	112.4	A13 L14 L19 G20 A21	A13-E17 PolarHBondContact O-N 2.99Å; L14-E17 PolarHBondContact O-N 3.11Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.11Å; E17-G20 PolarHBondContact O-N 3.16Å; E17-G20 VanDerWaalsContact O-N 3.17Å; E17-A21 WeakPolarHBondContact O-CB 3.46Å; E17-A21 PolarHBondContact O-N 2.99Å
18	L	77.8	Confident	76.8	Confident	122 Å²	122	94 Å²	94	64%	0.639	53%	0.534	S	S	*	.	H	α-helix	trans	-63.9	-36.9	174.9	-72.8	169.8	0	0	0	112.5	L14 S22	L14-L18 WeakPolarHBondContact O-CB 3.21Å; L14-L18 WeakPolarHBondContact O-CG 3.21Å; L14-L18 PolarHBondContact O-N 2.81Å; L18-S22 WeakPolarHBondContact O-CB 3.43Å; L18-S22 PolarHBondContact O-N 3.48Å; L18-S22 PolarHBondContact O-OG 3.42Å
19	L	83.9	Confident	77.6	Confident	99 Å²	99	100.8 Å²	100.8	52%	0.518	55%	0.546	S	S	.	.	H	α-helix	trans	-65.4	-44	170.2	-83.2	166.4	0	0	0	111.8	A15 W16 E17 S22 V23	A15-L19 PolarHBondContact O-N 3.16Å; A15-L19 VanDerWaalsContact O-N 3.07Å; W16-L19 HydrophobicContact CE3-CD1 4.4Å; W16-L19 PolarHBondContact O-N 3.38Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.11Å; L19-S22 WeakPolarHBondContact O-CB 3.46Å; L19-S22 PolarHBondContact O-N 3.5Å; L19-V23 WeakPolarHBondContact O-CG2 3.44Å; L19-V23 PolarHBondContact O-N 3.05Å
20	G	84.8	Confident	78.7	Confident	39 Å²	39	105.1 Å²	105.1	40%	0.402	55%	0.549	S	S	.	.	H	α-helix	trans	-58	-49.9	175.8	0	0	0	0	0	112.5	W16 E17 S22 V23 L24	W16-G20 PolarHBondContact O-N 3.28Å; E17-G20 PolarHBondContact O-N 3.16Å; E17-G20 VanDerWaalsContact O-N 3.17Å; G20-S22 VanDerWaalsContact C-N 3.31Å; G20-S22 PolarHBondContact O-N 2.98Å; G20-V23 PolarHBondContact O-N 3.23Å; G20-L24 WeakPolarHBondContact O-CB 3.37Å; G20-L24 PolarHBondContact O-N 3.15Å
21	A	81.6	Confident	79.2	Confident	51 Å²	51	103.7 Å²	103.7	42%	0.421	55%	0.545	S	S	.	.	H	α-helix	trans	-60.1	-39.4	175.7	0	0	0	0	0	112.3	E17 L24 L25	E17-A21 WeakPolarHBondContact O-CB 3.46Å; E17-A21 PolarHBondContact O-N 2.99Å; A21-L24 PolarHBondContact O-N 2.87Å; A21-L25 WeakPolarHBondContact O-CG 3.46Å; A21-L25 PolarHBondContact O-N 3.27Å
22	S	79.8	Confident	79.4	Confident	62 Å²	62	99.1 Å²	99.1	43%	0.434	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-43.7	176.6	-61.2	0	0	0	0	112.4	L18 L19 G20 L24 L25 I26	L18-S22 WeakPolarHBondContact O-CB 3.43Å; L18-S22 PolarHBondContact O-N 3.48Å; L18-S22 PolarHBondContact O-OG 3.42Å; L19-S22 WeakPolarHBondContact O-CB 3.46Å; L19-S22 PolarHBondContact O-N 3.5Å; G20-S22 VanDerWaalsContact C-N 3.31Å; G20-S22 PolarHBondContact O-N 2.98Å; S22-L24 VanDerWaalsContact C-N 3.35Å; S22-L25 PolarHBondContact O-N 3.21Å; S22-I26 WeakPolarHBondContact O-CG1 3.29Å; S22-I26 PolarHBondContact O-N 3.47Å; S22-I26 VanDerWaalsContact O-N 3.12Å
23	V	87	Confident	79.3	Confident	96 Å²	96	107.9 Å²	107.9	58%	0.582	56%	0.562	S	S	*	*	H	α-helix	trans	-64.7	-39.9	174.5	171.9	0	0	0	0	111	L19 G20 I26 A27	L19-V23 WeakPolarHBondContact O-CG2 3.44Å; L19-V23 PolarHBondContact O-N 3.05Å; G20-V23 PolarHBondContact O-N 3.23Å; V23-I26 PolarHBondContact O-N 2.65Å; V23-A27 WeakPolarHBondContact O-CB 3.39Å; V23-A27 PolarHBondContact O-N 3.48Å
24	L	86.3	Confident	78.8	Confident	113 Å²	113	113.7 Å²	113.7	59%	0.592	57%	0.572	S	S	*	*	H	α-helix	trans	-67.1	-39.8	179.9	-155.6	152.6	0	0	0	111.6	G20 A21 S22 I26 A27 V28	G20-L24 WeakPolarHBondContact O-CB 3.37Å; G20-L24 PolarHBondContact O-N 3.15Å; A21-L24 PolarHBondContact O-N 2.87Å; S22-L24 VanDerWaalsContact C-N 3.35Å; L24-I26 PolarHBondContact O-N 3.42Å; L24-A27 PolarHBondContact O-N 3.39Å; L24-V28 HydrophobicContact CD2-CG2 4.07Å; L24-V28 WeakPolarHBondContact O-CG2 3.42Å; L24-V28 PolarHBondContact O-N 3.38Å
25	L	82.3	Confident	78.3	Confident	126 Å²	126	115.7 Å²	115.7	66%	0.66	58%	0.582	S	S	*	*	H	α-helix	trans	-60.7	-42	170.5	-78.6	167.2	0	0	0	112.5	A21 S22 R29	A21-L25 WeakPolarHBondContact O-CG 3.46Å; A21-L25 PolarHBondContact O-N 3.27Å; S22-L25 PolarHBondContact O-N 3.21Å; L25-R29 VanDerWaalsContact O-CB 3.29Å; L25-R29 WeakPolarHBondContact O-CB 3.25Å; L25-R29 PolarHBondContact O-N 3.42Å
26	I	84.8	Confident	77.3	Confident	121 Å²	121	115 Å²	115	62%	0.621	58%	0.581	S	S	*	*	H	α-helix	trans	-64.3	-43.1	175.4	-68.3	164.9	0	0	0	110.6	S22 V23 L24 R29 W30	S22-I26 WeakPolarHBondContact O-CG1 3.29Å; S22-I26 PolarHBondContact O-N 3.47Å; S22-I26 VanDerWaalsContact O-N 3.12Å; V23-I26 PolarHBondContact O-N 2.65Å; L24-I26 PolarHBondContact O-N 3.42Å; I26-R29 PolarHBondContact O-N 3.04Å; I26-W30 WeakPolarHBondContact O-CB 3.4Å; I26-W30 PolarHBondContact O-N 3.4Å
27	A	81.1	Confident	75.5	Confident	52 Å²	52	112.3 Å²	112.3	43%	0.43	59%	0.588	S	S	.	*	H	α-helix	trans	-62.8	-45	177.7	0	0	0	0	0	112.3	V23 L24 W30 L31	V23-A27 WeakPolarHBondContact O-CB 3.39Å; V23-A27 PolarHBondContact O-N 3.48Å; L24-A27 PolarHBondContact O-N 3.39Å; A27-W30 PolarHBondContact O-N 3.05Å; A27-L31 WeakPolarHBondContact O-CB 3.42Å; A27-L31 PolarHBondContact O-N 3.29Å
28	V	84.7	Confident	73.5	Confident	76 Å²	76	116.5 Å²	116.5	46%	0.461	60%	0.597	S	S	.	*	H	α-helix	trans	-61.8	-44.5	174.3	170	0	0	0	0	111	L24 W30 L31 V32	L24-V28 HydrophobicContact CD2-CG2 4.07Å; L24-V28 WeakPolarHBondContact O-CG2 3.42Å; L24-V28 PolarHBondContact O-N 3.38Å; V28-W30 VanDerWaalsContact C-N 3.28Å; V28-W30 PolarHBondContact O-N 3.46Å; V28-L31 WeakPolarHBondContact O-CB 3.47Å; V28-L31 PolarHBondContact O-N 3.06Å; V28-L31 VanDerWaalsContact O-N 3.12Å; V28-V32 HydrophobicContact CG1-CG2 4.47Å; V28-V32 WeakPolarHBondContact O-CG2 3.37Å; V28-V32 PolarHBondContact O-N 2.89Å
29	R	76.2	Confident	71.6	Confident	204 Å²	204	116.7 Å²	116.7	77%	0.77	61%	0.606	S	S	*	*	H	α-helix	trans	-66.6	-29.1	179.3	-155.7	172.7	-166	173.8	4.3	112.8	L25 I26 R33	L25-R29 VanDerWaalsContact O-CB 3.29Å; L25-R29 WeakPolarHBondContact O-CB 3.25Å; L25-R29 PolarHBondContact O-N 3.42Å; I26-R29 PolarHBondContact O-N 3.04Å; R29-R33 PolarHBondContact O-N 3.42Å
30	W	83.3	Confident	69.3	Low	151 Å²	151	116 Å²	116	57%	0.572	62%	0.622	S	S	*	*	H	α-helix	trans	-73	-41.9	169.3	-177.4	87.8	0	0	0	112.1	I26 A27 V28 R33 R34	I26-W30 WeakPolarHBondContact O-CB 3.4Å; I26-W30 PolarHBondContact O-N 3.4Å; A27-W30 PolarHBondContact O-N 3.05Å; V28-W30 VanDerWaalsContact C-N 3.28Å; V28-W30 PolarHBondContact O-N 3.46Å; W30-R33 WeakPolarHBondContact O-CB 3.32Å; W30-R33 PolarHBondContact O-N 3.47Å; W30-R34 PolarHBondContact O-N 3.15Å
31	L	74.9	Confident	67.1	Low	88 Å²	88	117.6 Å²	117.6	46%	0.461	64%	0.639	S	S	.	*	H	α-helix	trans	-62.9	-44.6	178.3	-153.2	79.5	0	0	0	111.6	A27 V28 R33 R34 L35	A27-L31 WeakPolarHBondContact O-CB 3.42Å; A27-L31 PolarHBondContact O-N 3.29Å; V28-L31 WeakPolarHBondContact O-CB 3.47Å; V28-L31 PolarHBondContact O-N 3.06Å; V28-L31 VanDerWaalsContact O-N 3.12Å; L31-R33 VanDerWaalsContact C-N 3.33Å; L31-R33 PolarHBondContact O-N 2.79Å; L31-R34 CarbonylContact O-C 3.56Å; L31-R34 WeakPolarHBondContact O-CA 3.41Å; L31-R34 WeakPolarHBondContact O-CB 3.33Å; L31-R34 PolarHBondContact O-N 3.19Å; L31-L35 HydrophobicContact CD2-CD1 4.14Å; L31-L35 HydrophobicContact CG-CD1 4Å; L31-L35 WeakPolarHBondContact O-CG 3.47Å; L31-L35 PolarHBondContact O-N 2.9Å
32	V	74.9	Confident	65	Low	98 Å²	98	124.1 Å²	124.1	59%	0.594	67%	0.666	S	S	*	*	H	α-helix	trans	-60	-41.5	174.4	171.8	0	0	0	0	111.3	V28 R34 L35 G36	V28-V32 HydrophobicContact CG1-CG2 4.47Å; V28-V32 WeakPolarHBondContact O-CG2 3.37Å; V28-V32 PolarHBondContact O-N 2.89Å; V32-R34 PolarHBondContact O-N 3.05Å; V32-L35 PolarHBondContact O-N 3.43Å; V32-G36 PolarHBondContact O-N 3.48Å; V32-G36 VanDerWaalsContact O-N 3.14Å
33	R	66.4	Low	62.7	Low	227 Å²	227	124.4 Å²	124.4	86%	0.857	68%	0.679	S	S	*	*	H	α-helix	trans	-65.1	-21	172.2	-88.5	-177.5	165.7	176.5	-3.9	114.1	R29 W30 L31	R29-R33 PolarHBondContact O-N 3.42Å; W30-R33 WeakPolarHBondContact O-CB 3.32Å; W30-R33 PolarHBondContact O-N 3.47Å; L31-R33 VanDerWaalsContact C-N 3.33Å; L31-R33 PolarHBondContact O-N 2.79Å
34	R	60.7	Low	60.3	Low	178 Å²	178	131.8 Å²	131.8	67%	0.672	70%	0.696	S	S	*	*	H	α-helix	trans	-93.8	-21.8	179.6	-160.7	176.3	-174.9	-157	0.8	113.3	W30 L31 V32	W30-R34 PolarHBondContact O-N 3.15Å; L31-R34 CarbonylContact O-C 3.56Å; L31-R34 WeakPolarHBondContact O-CA 3.41Å; L31-R34 WeakPolarHBondContact O-CB 3.33Å; L31-R34 PolarHBondContact O-N 3.19Å; V32-R34 PolarHBondContact O-N 3.05Å
35	L	58.6	Low	57.8	Low	134 Å²	134	132.4 Å²	132.4	70%	0.702	71%	0.71	S	S	*	*	H	α-helix	trans	-98.1	-9.9	178.9	-67.6	170.6	0	0	0	113.7	L31 V32	L31-L35 HydrophobicContact CD2-CD1 4.14Å; L31-L35 HydrophobicContact CG-CD1 4Å; L31-L35 WeakPolarHBondContact O-CG 3.47Å; L31-L35 PolarHBondContact O-N 2.9Å; V32-L35 PolarHBondContact O-N 3.43Å
36	G	52.6	Low	55.3	Low	38 Å²	38	130 Å²	130	39%	0.392	72%	0.716	S	S	.	*	S	Bend	trans	-61.2	146.8	171.2	0	0	0	0	0	112.5	V32 R38	V32-G36 PolarHBondContact O-N 3.48Å; V32-G36 VanDerWaalsContact O-N 3.14Å; G36-R38 PolarHBondContact O-N 3.5Å
37	P	41.8	Very low	52.7	Low	135 Å²	135	131 Å²	131	88%	0.877	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-59.5	126.1	-175.8	-24.1	34	0	0	0	112.7
38	R	39.9	Very low	51.1	Low	236 Å²	236	133.7 Å²	133.7	89%	0.891	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-81	131.1	167.6	-77.3	-177.7	167.5	-169.7	-5.9	109.6	G36 G40	G36-R38 PolarHBondContact O-N 3.5Å; R38-G40 PolarHBondContact O-N 3.32Å
39	P	39	Very low	48.6	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-63.6	134.8	166.3	28	-33.1	0	0	0	109.4
40	G	35.5	Very low	46.6	Very low	84 Å²	84	132 Å²	132	87%	0.866	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-73.2	152.4	177.6	0	0	0	0	0	112.3	R38	R38-G40 PolarHBondContact O-N 3.32Å
41	G	38.6	Very low	44.9	Very low	73 Å²	73	130 Å²	130	75%	0.753	76%	0.762	S	S	*	*			trans	-159.3	121.6	175.3	0	0	0	0	0	112.9
42	L	37.1	Very low	43.3	Very low	188 Å²	188	131.4 Å²	131.4	98%	0.984	78%	0.776	S	S	*	*			trans	-175.6	139.5	169.8	-98.9	154.1	0	0	0	105.8
43	G	30.6	Very low	41.5	Very low	69 Å²	69	132.8 Å²	132.8	71%	0.711	79%	0.787	S	S	*	*			cis	-163.8	177.5	-1.7	0	0	0	0	0	112.5
44	R	37.4	Very low	40.2	Very low	250 Å²	250	126.9 Å²	126.9	94%	0.943	79%	0.787	S	S	*	*			trans	-58.6	147.9	-172.5	-66	165.9	161.2	176.8	-7.7	116
45	S	33.5	Very low	38.8	Very low	127 Å²	127	123.4 Å²	123.4	89%	0.888	80%	0.796	S	S	*	*				-179.5	154.9	106.4	54.2	0	0	0	0	113.1
46	G	30.1	Very low	37.5	Very low	76 Å²	76	121.7 Å²	121.7	78%	0.784	80%	0.801	S	S	*	*			trans	105.6	128.8	166	0	0	0	0	0	117.7
47	T	30.7	Very low	36.8	Very low	142 Å²	142	124.5 Å²	124.5	87%	0.871	82%	0.821	S	S	*	*			trans	-145.6	172.8	174.4	36.9	0	0	0	0	108.1
48	P	45.7	Very low	36.4	Very low	108 Å²	108	123.7 Å²	123.7	70%	0.701	82%	0.816	S	S	*	*			cis	-135.4	164.5	-17.4	34.5	-16.5	0	0	0	116
49	V	33.7	Very low	36.1	Very low	134 Å²	134	116.5 Å²	116.5	81%	0.812	81%	0.807	S	S	*	*			trans	67	156	143	161.5	0	0	0	0	117.7
50	P	34	Very low	36.5	Very low	110 Å²	110	117.1 Å²	117.1	71%	0.714	81%	0.811	S	S	*	*			cis	-125.3	172.6	6.1	42.2	-27.8	0	0	0	117.5
51	P	46.6	Very low	37.3	Very low	109 Å²	109	116.6 Å²	116.6	71%	0.708	81%	0.805	S	S	*	*			trans	-89.1	-177.3	155.8	40	-35.7	0	0	0	111.4
52	P	42	Very low	37.8	Very low	118 Å²	118	121.7 Å²	121.7	77%	0.766	81%	0.809	S	S	*	*			cis	-123.1	-133.8	6.9	43.8	-23.8	0	0	0	110.7
53	P	36.1	Very low	39	Very low	127 Å²	127	118.5 Å²	118.5	83%	0.825	79%	0.791	S	S	*	*			cis	-103.4	176.9	12	41.5	-34.3	0	0	0	114.8
54	A	39.4	Very low	41.4	Very low	102 Å²	102	119 Å²	119	84%	0.843	78%	0.78	S	S	*	*			trans	-109.2	150.5	178.2	0	0	0	0	0	112.9
55	A	31.1	Very low	43.4	Very low	105 Å²	105	109.7 Å²	109.7	87%	0.868	75%	0.748	S	S	*	*			trans	-155.4	139.3	166.2	0	0	0	0	0	109.1
56	A	33.1	Very low	45.6	Very low	98 Å²	98	109.5 Å²	109.5	81%	0.81	74%	0.737	S	S	*	*			cis	-147.6	150.7	-19.4	0	0	0	0	0	108
57	A	37	Very low	48.1	Very low	97 Å²	97	108.5 Å²	108.5	80%	0.802	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-76.4	138.1	177.5	0	0	0	0	0	110.8
58	P	32.6	Very low	50.5	Low	119 Å²	119	101.9 Å²	101.9	77%	0.773	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-65.6	149.4	166.6	29.7	-33.9	0	0	0	110.2
59	A	34.5	Very low	52.4	Low	85 Å²	85	97.6 Å²	97.6	70%	0.702	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-69	150.1	-174.8	0	0	0	0	0	112.6	G61	A59-G61 PolarHBondContact O-N 2.93Å
60	P	47.6	Very low	54.8	Low	139 Å²	139	93.9 Å²	93.9	90%	0.903	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	101	175	29.8	-33.7	0	0	0	110.4
61	G	52.4	Low	57.2	Low	72 Å²	72	93.5 Å²	93.5	74%	0.742	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	174.4	-35.8	174.1	0	0	0	0	0	116.5	A59 M63	A59-G61 PolarHBondContact O-N 2.93Å; G61-M63 PolarHBondContact O-N 3.28Å
62	E	47.7	Very low	59.1	Low	180 Å²	180	88.3 Å²	88.3	84%	0.841	59%	0.586	S	S	*	*			trans	-79.9	108.7	-175.9	-78.3	-171.2	126.6	0	0	113	T64	E62-T64 PolarHBondContact O-N 3Å; E62-T64 VanDerWaalsContact O-N 3.13Å
63	M	63	Low	61.1	Low	121 Å²	121	88.4 Å²	88.4	60%	0.596	57%	0.574	S	S	*	*			trans	-74.6	94	165.3	-70.5	-160.2	-171.3	0	0	110.3	G61 V68 L111	G61-M63 PolarHBondContact O-N 3.28Å; M63-V68 HydrophobicContact CB-CG2 3.99Å; M63-V68 HydrophobicContact SD-CG2 4.27Å; M63-L111 WeakPolarHBondContact O-CD2 3.49Å
64	T	80.8	Confident	63.4	Low	80 Å²	80	89.3 Å²	89.3	49%	0.491	57%	0.571	S	S	.	*			trans	-70.7	148.3	172.3	64.2	0	0	0	0	111.4	E62 D66 A67 V68	E62-T64 PolarHBondContact O-N 3Å; E62-T64 VanDerWaalsContact O-N 3.13Å; T64-D66 PolarHBondContact O-N 3.47Å; T64-A67 PolarHBondContact O-N 3.34Å; T64-A67 WeakPolarHBondContact OG1-CB 3.34Å; T64-V68 PolarHBondContact O-N 2.95Å
65	M	80.9	Confident	65.5	Low	54 Å²	54	86.4 Å²	86.4	27%	0.266	54%	0.541	S	S	.	.	H	α-helix	trans	-53.4	-40.8	-179.2	-177.1	61.8	163.6	0	0	112.5	V68 L69 K104 A107 Q108 L111	M65-V68 PolarHBondContact O-N 2.91Å; M65-L69 HydrophobicContact CE-CD1 4.25Å; M65-L69 HydrophobicContact CG-CD1 4.02Å; M65-L69 WeakPolarHBondContact O-CB 3.45Å; M65-L69 VanDerWaalsContact O-CG 3.28Å; M65-L69 WeakPolarHBondContact O-CG 3.15Å; M65-L69 PolarHBondContact O-N 3.38Å; M65-L69 HydrophobicContact SD-CD1 4.41Å; M65-L69 HydrophobicContact SD-CG 4.46Å; M65-K104 HydrophobicContact CE-CG 3.94Å; M65-A107 HydrophobicContact CE-CB 3.96Å; M65-A107 HydrophobicContact SD-CB 3.69Å; M65-Q108 HydrophobicContact CE-CB 4.49Å; M65-L111 HydrophobicContact CB-CD1 3.88Å; M65-L111 HydrophobicContact CG-CD1 4.28Å; M65-L111 HydrophobicContact SD-CD1 3.48Å; M65-L111 WeakPolarHBondContact SD-CD1 3.35Å
66	D	79.3	Confident	67.9	Low	124 Å²	124	86.2 Å²	86.2	66%	0.663	53%	0.525	S	S	*	.	H	α-helix	trans	-71.3	-32.7	179.9	-62	-50	0	0	0	112.8	T64 A70	T64-D66 PolarHBondContact O-N 3.47Å; D66-A70 VanDerWaalsContact O-CB 3.26Å; D66-A70 WeakPolarHBondContact O-CB 3.43Å; D66-A70 PolarHBondContact O-N 2.69Å
67	A	81.8	Confident	70.2	Confident	54 Å²	54	84.3 Å²	84.3	45%	0.446	51%	0.505	S	S	.	.	H	α-helix	trans	-68.8	-40	173.5	0	0	0	0	0	111.9	T64 A70 R71	T64-A67 PolarHBondContact O-N 3.34Å; T64-A67 WeakPolarHBondContact OG1-CB 3.34Å; A67-A70 PolarHBondContact O-N 3.17Å; A67-R71 PolarHBondContact O-N 2.74Å; A67-R71 VanDerWaalsContact O-N 3.13Å
68	V	82.1	Confident	72.3	Confident	4 Å²	4	83.9 Å²	83.9	2%	0.024	49%	0.489	C	S	.	.	H	α-helix	trans	-66.2	-46.1	174.5	-177.5	0	0	0	0	110.5	M63 T64 M65 A70 R71 L72 A107 L110	M63-V68 HydrophobicContact CB-CG2 3.99Å; M63-V68 HydrophobicContact SD-CG2 4.27Å; T64-V68 PolarHBondContact O-N 2.95Å; M65-V68 PolarHBondContact O-N 2.91Å; V68-A70 VanDerWaalsContact C-N 3.31Å; V68-A70 PolarHBondContact O-N 3.33Å; V68-R71 PolarHBondContact O-N 3.19Å; V68-R71 VanDerWaalsContact O-N 3.15Å; V68-L72 HydrophobicContact CG1-CD1 4.2Å; V68-L72 HydrophobicContact CG1-CG 4.42Å; V68-L72 WeakPolarHBondContact O-CG 3.33Å; V68-L72 PolarHBondContact O-N 3.16Å; V68-A107 HydrophobicContact CB-CB 4.28Å; V68-A107 HydrophobicContact CG1-CB 3.76Å; V68-L110 HydrophobicContact CG1-CD1 3.96Å
69	L	85.4	Confident	74.7	Confident	18 Å²	18	81.4 Å²	81.4	9%	0.094	47%	0.469	C	S	.	.	H	α-helix	trans	-61.6	-36.2	175.3	-74.5	172.2	0	0	0	112.9	M65 R71 K73 E103 A107	M65-L69 HydrophobicContact CE-CD1 4.25Å; M65-L69 HydrophobicContact CG-CD1 4.02Å; M65-L69 WeakPolarHBondContact O-CB 3.45Å; M65-L69 VanDerWaalsContact O-CG 3.28Å; M65-L69 WeakPolarHBondContact O-CG 3.15Å; M65-L69 PolarHBondContact O-N 3.38Å; M65-L69 HydrophobicContact SD-CD1 4.41Å; M65-L69 HydrophobicContact SD-CG 4.46Å; L69-R71 VanDerWaalsContact C-N 3.35Å; L69-K73 VanDerWaalsContact O-CG 3.29Å; L69-K73 WeakPolarHBondContact O-CG 3.42Å; L69-K73 PolarHBondContact O-N 2.98Å; L69-E103 HydrophobicContact CD2-CB 4.43Å; L69-A107 HydrophobicContact CD2-CB 3.77Å; L69-A107 HydrophobicContact CG-CB 3.99Å
70	A	83.6	Confident	77	Confident	55 Å²	55	77.3 Å²	77.3	46%	0.455	44%	0.436	S	S	.	.	H	α-helix	trans	-63.7	-39.6	174.2	0	0	0	0	0	111.8	D66 A67 V68	D66-A70 VanDerWaalsContact O-CB 3.26Å; D66-A70 WeakPolarHBondContact O-CB 3.43Å; D66-A70 PolarHBondContact O-N 2.69Å; A67-A70 PolarHBondContact O-N 3.17Å; V68-A70 VanDerWaalsContact C-N 3.31Å; V68-A70 PolarHBondContact O-N 3.33Å
71	R	84.2	Confident	78.7	Confident	103 Å²	103	75.4 Å²	75.4	39%	0.389	41%	0.411	S	S	.	.	H	α-helix	trans	-66.2	-47.1	175.4	-164	-179.4	80	-141.5	5.6	112.1	A67 V68 L69 K73 L74 E83	A67-R71 PolarHBondContact O-N 2.74Å; A67-R71 VanDerWaalsContact O-N 3.13Å; V68-R71 PolarHBondContact O-N 3.19Å; V68-R71 VanDerWaalsContact O-N 3.15Å; L69-R71 VanDerWaalsContact C-N 3.35Å; R71-K73 VanDerWaalsContact C-N 3.29Å; R71-K73 PolarHBondContact O-N 3.34Å; R71-L74 WeakPolarHBondContact O-CB 3.15Å; R71-L74 PolarHBondContact O-N 2.65Å; R71-L74 VanDerWaalsContact O-N 3.1Å; R71-E83 IonicContact NH2-OE2 2.78Å
72	L	85.6	Confident	80.1	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-65.8	-28.9	-177	-64.5	179.9	0	0	0	113.5	V68 L74 L75 L80 E83 R99 E103 L106 A107	V68-L72 HydrophobicContact CG1-CD1 4.2Å; V68-L72 HydrophobicContact CG1-CG 4.42Å; V68-L72 WeakPolarHBondContact O-CG 3.33Å; V68-L72 PolarHBondContact O-N 3.16Å; L72-L74 PolarHBondContact O-N 3.24Å; L72-L75 HydrophobicContact CD2-CD1 3.75Å; L72-L75 PolarHBondContact O-N 2.91Å; L72-L80 HydrophobicContact CB-CD1 4.46Å; L72-L80 HydrophobicContact CD2-CD1 4.4Å; L72-E83 WeakPolarHBondContact CD2-OE2 3.48Å; L72-R99 PolarHBondContact O-NH2 3.46Å; L72-E103 HydrophobicContact CB-CB 4.44Å; L72-E103 HydrophobicContact CB-CG 4.29Å; L72-E103 WeakPolarHBondContact CD1-O 3.43Å; L72-L106 HydrophobicContact CD1-CB 3.96Å; L72-L106 HydrophobicContact CD1-CD2 3.85Å; L72-L106 HydrophobicContact CD1-CG 3.81Å; L72-L106 HydrophobicContact CD2-CD2 3.5Å; L72-L106 VanDerWaalsContact CD2-CD2 3.5Å; L72-L106 HydrophobicContact CD2-CG 4.2Å; L72-L106 HydrophobicContact CG-CD2 4.32Å; L72-A107 HydrophobicContact CD1-CB 3.98Å
73	K	85.9	Confident	81.9	Confident	119 Å²	119	72.8 Å²	72.8	52%	0.517	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.1	173.5	-77.3	170.3	-178.8	175.6	0	114.3	L69 R71 R99	L69-K73 VanDerWaalsContact O-CG 3.29Å; L69-K73 WeakPolarHBondContact O-CG 3.42Å; L69-K73 PolarHBondContact O-N 2.98Å; R71-K73 VanDerWaalsContact C-N 3.29Å; R71-K73 PolarHBondContact O-N 3.34Å; K73-R99 PolarHBondContact O-NH2 3.2Å
74	L	84.1	Confident	82.9	Confident	147 Å²	147	67 Å²	67	77%	0.77	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-10.9	179.6	-63.1	171.5	0	0	0	113.6	R71 L72	R71-L74 WeakPolarHBondContact O-CB 3.15Å; R71-L74 PolarHBondContact O-N 2.65Å; R71-L74 VanDerWaalsContact O-N 3.1Å; L72-L74 PolarHBondContact O-N 3.24Å
75	L	82.6	Confident	83.1	Confident	41 Å²	41	67.7 Å²	67.7	22%	0.215	35%	0.354	C	S	.	.	S	Bend	trans	-75.8	151.4	178.1	-64.9	179.5	0	0	0	112.1	L72 D79 L80 E83 R99	L72-L75 HydrophobicContact CD2-CD1 3.75Å; L72-L75 PolarHBondContact O-N 2.91Å; L75-D79 HydrophobicContact CB-CB 4.23Å; L75-D79 HydrophobicContact CD2-CB 4.17Å; L75-L80 HydrophobicContact CB-CB 4.27Å; L75-L80 HydrophobicContact CD1-CD1 4.36Å; L75-E83 HydrophobicContact CD1-CG 4.28Å; L75-R99 VanDerWaalsContact O-CZ 3.3Å; L75-R99 PolarHBondContact O-NH1 2.92Å; L75-R99 PolarHBondContact O-NH2 3.48Å
76	N	82.5	Confident	83.2	Confident	100 Å²	100	73.6 Å²	73.6	54%	0.535	38%	0.379	S	S	.	.			trans	-73.3	163	167.6	-59	-72.6	0	0	0	110.6	D78 D79 L80	N76-D78 PolarHBondContact O-N 3.26Å; N76-D79 WeakPolarHBondContact CB-OD2 3.45Å; N76-D79 PolarHBondContact N-OD2 3.1Å; N76-D79 PolarHBondContact ND2-OD2 3.09Å; N76-D79 PolarHBondContact O-N 3.13Å; N76-L80 VanDerWaalsContact O-CB 3.25Å; N76-L80 WeakPolarHBondContact O-CB 3.47Å; N76-L80 PolarHBondContact O-N 3.3Å
77	P	81.5	Confident	83.2	Confident	58 Å²	58	68.5 Å²	68.5	38%	0.377	35%	0.353	S	S	.	.	H	α-helix	trans	-57	-31.7	-180	-26.5	36.5	0	0	0	114	R81	P77-R81 VanDerWaalsContact O-CG 3.28Å; P77-R81 WeakPolarHBondContact O-CG 3.34Å; P77-R81 PolarHBondContact O-N 3.32Å; P77-R81 VanDerWaalsContact O-N 3.1Å
78	D	79.3	Confident	83.1	Confident	89 Å²	89	69.1 Å²	69.1	48%	0.476	37%	0.365	S	S	.	.	H	α-helix	trans	-81.5	-45.4	179.4	-66.8	-61.6	0	0	0	112.8	N76 L80 R81 E82	N76-D78 PolarHBondContact O-N 3.26Å; D78-L80 PolarHBondContact O-N 3.15Å; D78-R81 WeakPolarHBondContact O-CA 3.49Å; D78-R81 WeakPolarHBondContact O-CB 3.33Å; D78-R81 PolarHBondContact O-N 3Å; D78-R81 IonicContact OD1-CZ 3.32Å; D78-R81 IonicContact OD1-NH1 3.19Å; D78-R81 PolarHBondContact OD1-NH1 2.57Å; D78-E82 PolarHBondContact O-N 2.98Å
79	D	83.4	Confident	83.1	Confident	66 Å²	66	71.7 Å²	71.7	35%	0.353	38%	0.378	S	S	.	.	H	α-helix	trans	-54.5	-40	171	-32	-30.6	0	0	0	111	L75 N76 E82 E83	L75-D79 HydrophobicContact CB-CB 4.23Å; L75-D79 HydrophobicContact CD2-CB 4.17Å; N76-D79 WeakPolarHBondContact CB-OD2 3.45Å; N76-D79 PolarHBondContact N-OD2 3.1Å; N76-D79 PolarHBondContact ND2-OD2 3.09Å; N76-D79 PolarHBondContact O-N 3.13Å; D79-E82 PolarHBondContact O-N 2.88Å; D79-E83 PolarHBondContact O-N 3Å
80	L	83.9	Confident	82.8	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-66.1	-40.9	175.7	-178.6	64.6	0	0	0	111.8	L72 L75 N76 D78 E82 E83 I84 I94 R99 E103 L106	L72-L80 HydrophobicContact CB-CD1 4.46Å; L72-L80 HydrophobicContact CD2-CD1 4.4Å; L75-L80 HydrophobicContact CB-CB 4.27Å; L75-L80 HydrophobicContact CD1-CD1 4.36Å; N76-L80 VanDerWaalsContact O-CB 3.25Å; N76-L80 WeakPolarHBondContact O-CB 3.47Å; N76-L80 PolarHBondContact O-N 3.3Å; D78-L80 PolarHBondContact O-N 3.15Å; L80-E82 VanDerWaalsContact C-N 3.3Å; L80-E82 PolarHBondContact O-N 3.48Å; L80-E83 PolarHBondContact O-N 3.26Å; L80-I84 HydrophobicContact CD1-CD1 4.32Å; L80-I84 HydrophobicContact CG-CD1 3.97Å; L80-I84 WeakPolarHBondContact O-CD1 3.47Å; L80-I84 WeakPolarHBondContact O-CG1 3.46Å; L80-I84 PolarHBondContact O-N 2.89Å; L80-I84 VanDerWaalsContact O-N 3.08Å; L80-I94 HydrophobicContact CB-CD1 4.39Å; L80-I94 HydrophobicContact CD2-CD1 3.88Å; L80-I94 HydrophobicContact CG-CD1 3.95Å; L80-R99 HydrophobicContact CD2-CG 3.85Å; L80-E103 HydrophobicContact CD1-CG 4.16Å; L80-E103 HydrophobicContact CD2-CG 3.84Å; L80-L106 HydrophobicContact CD1-CD2 3.98Å
81	R	82.8	Confident	82.6	Confident	99 Å²	99	80 Å²	80	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-60.2	-40.7	172.2	-77.2	169.1	57.8	-100.3	-18.5	111.3	P77 D78 I84 V85 I94	P77-R81 VanDerWaalsContact O-CG 3.28Å; P77-R81 WeakPolarHBondContact O-CG 3.34Å; P77-R81 PolarHBondContact O-N 3.32Å; P77-R81 VanDerWaalsContact O-N 3.1Å; D78-R81 WeakPolarHBondContact O-CA 3.49Å; D78-R81 WeakPolarHBondContact O-CB 3.33Å; D78-R81 PolarHBondContact O-N 3Å; D78-R81 IonicContact OD1-CZ 3.32Å; D78-R81 IonicContact OD1-NH1 3.19Å; D78-R81 PolarHBondContact OD1-NH1 2.57Å; R81-I84 PolarHBondContact O-N 3Å; R81-V85 WeakPolarHBondContact O-CG2 3.29Å; R81-V85 PolarHBondContact O-N 2.95Å; R81-I94 HydrophobicContact CG-CD1 3.59Å; R81-I94 HydrophobicContact CG-CG1 3.77Å
82	E	82.7	Confident	82.1	Confident	139 Å²	139	76.6 Å²	76.6	65%	0.65	41%	0.405	S	S	*	.	H	α-helix	trans	-66.4	-45.3	178.8	-70.2	-171.4	-175.1	0	0	112.2	D78 D79 L80 I84 V85 K86	D78-E82 PolarHBondContact O-N 2.98Å; D79-E82 PolarHBondContact O-N 2.88Å; L80-E82 VanDerWaalsContact C-N 3.3Å; L80-E82 PolarHBondContact O-N 3.48Å; E82-I84 VanDerWaalsContact C-N 3.32Å; E82-I84 PolarHBondContact O-N 3.43Å; E82-V85 PolarHBondContact O-N 3.29Å; E82-K86 WeakPolarHBondContact O-CB 3.35Å; E82-K86 PolarHBondContact O-N 3.17Å
83	E	84.3	Confident	81.7	Confident	57 Å²	57	81.9 Å²	81.9	27%	0.266	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-36.4	174.1	-70.4	-135.5	132.6	0	0	112.4	R71 L72 L75 D79 L80 K86 A87 L106	R71-E83 IonicContact NH2-OE2 2.78Å; L72-E83 WeakPolarHBondContact CD2-OE2 3.48Å; L75-E83 HydrophobicContact CD1-CG 4.28Å; D79-E83 PolarHBondContact O-N 3Å; L80-E83 PolarHBondContact O-N 3.26Å; E83-K86 PolarHBondContact O-N 3.41Å; E83-A87 WeakPolarHBondContact O-CB 3.33Å; E83-A87 PolarHBondContact O-N 2.64Å; E83-L106 HydrophobicContact CB-CD1 4.39Å; E83-L106 HydrophobicContact CB-CD2 3.51Å
84	I	85.2	Confident	81.5	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	42%	0.422	C	S	.	.	H	α-helix	trans	-63.6	-46.3	176.1	-67.3	158.4	0	0	0	111.2	L80 R81 E82 A87 G88 L89 C91 I94 F102 L106	L80-I84 HydrophobicContact CD1-CD1 4.32Å; L80-I84 HydrophobicContact CG-CD1 3.97Å; L80-I84 WeakPolarHBondContact O-CD1 3.47Å; L80-I84 WeakPolarHBondContact O-CG1 3.46Å; L80-I84 PolarHBondContact O-N 2.89Å; L80-I84 VanDerWaalsContact O-N 3.08Å; R81-I84 PolarHBondContact O-N 3Å; E82-I84 VanDerWaalsContact C-N 3.32Å; E82-I84 PolarHBondContact O-N 3.43Å; I84-A87 PolarHBondContact O-N 3.41Å; I84-G88 PolarHBondContact O-N 3.12Å; I84-L89 HydrophobicContact CG2-CB 3.68Å; I84-L89 WeakPolarHBondContact O-CB 3.43Å; I84-L89 PolarHBondContact O-N 3.14Å; I84-C91 HydrophobicContact CB-CB 4.38Å; I84-C91 HydrophobicContact CG2-CB 3.72Å; I84-I94 HydrophobicContact CD1-CD1 3.73Å; I84-F102 HydrophobicContact CD1-CB 3.67Å; I84-F102 HydrophobicContact CD1-CD1 4.04Å; I84-F102 HydrophobicContact CD1-CG 4.1Å; I84-L106 HydrophobicContact CG1-CB 4.13Å; I84-L106 HydrophobicContact CG1-CD2 4.04Å
85	V	83.9	Confident	81.3	Confident	93 Å²	93	73.7 Å²	73.7	56%	0.564	40%	0.404	S	S	*	.	H	α-helix	trans	-66.9	-40	177.6	171.5	0	0	0	0	110.9	R81 E82 A87 G88 C91	R81-V85 WeakPolarHBondContact O-CG2 3.29Å; R81-V85 PolarHBondContact O-N 2.95Å; E82-V85 PolarHBondContact O-N 3.29Å; V85-A87 VanDerWaalsContact C-N 3.29Å; V85-A87 PolarHBondContact O-N 2.97Å; V85-G88 WeakPolarHBondContact O-CA 3.43Å; V85-G88 PolarHBondContact O-N 3.41Å; V85-C91 HydrophobicContact CG2-CB 4.44Å
86	K	82.3	Confident	81.1	Confident	179 Å²	179	77.6 Å²	77.6	78%	0.778	44%	0.435	S	S	*	.	H	α-helix	trans	-63.6	-31.7	175.6	-171.5	177.8	-179.1	-178.1	0	112.7	E82 E83 G88	E82-K86 WeakPolarHBondContact O-CB 3.35Å; E82-K86 PolarHBondContact O-N 3.17Å; E83-K86 PolarHBondContact O-N 3.41Å; K86-G88 PolarHBondContact O-N 2.81Å
87	A	80.1	Confident	80.9	Confident	16 Å²	16	78.7 Å²	78.7	13%	0.132	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	3.8	170.7	0	0	0	0	0	114	E83 I84 V85 L89 L106	E83-A87 WeakPolarHBondContact O-CB 3.33Å; E83-A87 PolarHBondContact O-N 2.64Å; I84-A87 PolarHBondContact O-N 3.41Å; V85-A87 VanDerWaalsContact C-N 3.29Å; V85-A87 PolarHBondContact O-N 2.97Å; A87-L89 VanDerWaalsContact C-N 3.3Å; A87-L89 HydrophobicContact CB-CG 4.45Å; A87-L89 PolarHBondContact O-N 2.94Å; A87-L106 HydrophobicContact CB-CD1 3.59Å
88	G	79.1	Confident	80.9	Confident	67 Å²	67	77.9 Å²	77.9	69%	0.691	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	10	179.7	0	0	0	0	0	114.7	I84 V85 K86	I84-G88 PolarHBondContact O-N 3.12Å; V85-G88 WeakPolarHBondContact O-CA 3.43Å; V85-G88 PolarHBondContact O-N 3.41Å; K86-G88 PolarHBondContact O-N 2.81Å
89	L	81.9	Confident	81.3	Confident	58 Å²	58	76.2 Å²	76.2	30%	0.304	43%	0.426	S	S	.	.			trans	-90.7	138.8	-177.8	-61.8	177.3	0	0	0	111.3	I84 A87 C91 K105 A109	I84-L89 HydrophobicContact CG2-CB 3.68Å; I84-L89 WeakPolarHBondContact O-CB 3.43Å; I84-L89 PolarHBondContact O-N 3.14Å; A87-L89 VanDerWaalsContact C-N 3.3Å; A87-L89 HydrophobicContact CB-CG 4.45Å; A87-L89 PolarHBondContact O-N 2.94Å; L89-C91 PolarHBondContact O-N 3.17Å; L89-K105 HydrophobicContact CD1-CB 4.32Å; L89-A109 HydrophobicContact CD1-CB 3.97Å
90	K	78.8	Confident	81.5	Confident	209 Å²	209	78.5 Å²	78.5	91%	0.909	43%	0.434	S	S	*	.			trans	-73.7	112.5	174.8	-66.9	-175.2	178.5	-177.7	0	110.3
91	C	79.9	Confident	81.6	Confident	38 Å²	38	83.1 Å²	83.1	26%	0.257	46%	0.457	S	S	.	.			trans	-92.6	137.8	176.2	-159.3	0	0	0	0	112	I84 V85 L89	I84-C91 HydrophobicContact CB-CB 4.38Å; I84-C91 HydrophobicContact CG2-CB 3.72Å; V85-C91 HydrophobicContact CG2-CB 4.44Å; L89-C91 PolarHBondContact O-N 3.17Å
92	G	74.7	Confident	81.8	Confident	32 Å²	32	80 Å²	80	33%	0.33	45%	0.446	S	S	.	.			trans	-93.6	-169.6	164.8	0	0	0	0	0	111.5	I94	G92-I94 PolarHBondContact O-N 2.73Å
93	P	76.2	Confident	82.1	Confident	112 Å²	112	73.8 Å²	73.8	73%	0.727	42%	0.417	S	S	*	.			trans	-62.8	122.5	168.5	27.1	-33.3	0	0	0	110	T95	P93-T95 PolarHBondContact O-N 2.89Å
94	I	81.6	Confident	82.3	Confident	28 Å²	28	76.1 Å²	76.1	14%	0.144	43%	0.426	C	S	.	.			trans	-81.4	111	175.6	-60.5	-167.4	0	0	0	108.9	L80 R81 I84 G92 R99 F102	L80-I94 HydrophobicContact CB-CD1 4.39Å; L80-I94 HydrophobicContact CD2-CD1 3.88Å; L80-I94 HydrophobicContact CG-CD1 3.95Å; R81-I94 HydrophobicContact CG-CD1 3.59Å; R81-I94 HydrophobicContact CG-CG1 3.77Å; I84-I94 HydrophobicContact CD1-CD1 3.73Å; G92-I94 PolarHBondContact O-N 2.73Å; I94-R99 HydrophobicContact CG2-CB 3.78Å; I94-R99 HydrophobicContact CG2-CG 4.08Å; I94-F102 HydrophobicContact CD1-CB 4.37Å; I94-F102 HydrophobicContact CD1-CD2 4.46Å; I94-F102 HydrophobicContact CD1-CG 4.46Å; I94-F102 HydrophobicContact CG1-CD2 4.07Å; I94-F102 HydrophobicContact CG1-CE2 4.44Å
95	T	80.6	Confident	82.4	Confident	66 Å²	66	81.9 Å²	81.9	41%	0.405	45%	0.451	S	S	.	.			trans	-107.8	161.2	172.3	63.8	0	0	0	0	110	P93 T97 T98 R99	P93-T95 PolarHBondContact O-N 2.89Å; T95-T97 PolarHBondContact O-N 3.43Å; T95-T97 PolarHBondContact OG1-OG1 2.93Å; T95-T98 PolarHBondContact N-OG1 3.37Å; T95-T98 PolarHBondContact O-N 2.87Å; T95-T98 PolarHBondContact O-OG1 3.06Å; T95-T98 VanDerWaalsContact O-OG1 3.13Å; T95-T98 PolarHBondContact OG1-OG1 3.42Å; T95-R99 WeakPolarHBondContact O-CB 3.43Å; T95-R99 PolarHBondContact O-N 3.2Å
96	S	77.6	Confident	82.5	Confident	123 Å²	123	77.5 Å²	77.5	86%	0.86	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-26	-179.7	-44.8	0	0	0	0	114
97	T	78.8	Confident	82.8	Confident	123 Å²	123	69 Å²	69	76%	0.755	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-21.2	176.7	52.2	0	0	0	0	114.2	T95	T95-T97 PolarHBondContact O-N 3.43Å; T95-T97 PolarHBondContact OG1-OG1 2.93Å
98	T	82.4	Confident	83	Confident	41 Å²	41	72.8 Å²	72.8	25%	0.252	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-22.3	-178.5	53.3	0	0	0	0	113	T95 F100 I101 F102	T95-T98 PolarHBondContact N-OG1 3.37Å; T95-T98 PolarHBondContact O-N 2.87Å; T95-T98 PolarHBondContact O-OG1 3.06Å; T95-T98 VanDerWaalsContact O-OG1 3.13Å; T95-T98 PolarHBondContact OG1-OG1 3.42Å; T98-F100 PolarHBondContact O-N 3.02Å; T98-I101 WeakPolarHBondContact O-CB 3.41Å; T98-I101 PolarHBondContact O-N 3.44Å; T98-F102 WeakPolarHBondContact O-CD2 3.37Å; T98-F102 PolarHBondContact O-N 3.44Å
99	R	86.3	Confident	83.2	Confident	53 Å²	53	70.2 Å²	70.2	20%	0.2	38%	0.375	C	S	.	.	H	α-helix	trans	-46	-52	-178.1	-178.6	174.3	165.4	132.2	15.2	114	L72 K73 L75 L80 I94 T95 I101 F102 E103	L72-R99 PolarHBondContact O-NH2 3.46Å; K73-R99 PolarHBondContact O-NH2 3.2Å; L75-R99 VanDerWaalsContact O-CZ 3.3Å; L75-R99 PolarHBondContact O-NH1 2.92Å; L75-R99 PolarHBondContact O-NH2 3.48Å; L80-R99 HydrophobicContact CD2-CG 3.85Å; I94-R99 HydrophobicContact CG2-CB 3.78Å; I94-R99 HydrophobicContact CG2-CG 4.08Å; T95-R99 WeakPolarHBondContact O-CB 3.43Å; T95-R99 PolarHBondContact O-N 3.2Å; R99-I101 VanDerWaalsContact C-N 3.26Å; R99-I101 PolarHBondContact O-N 2.89Å; R99-F102 WeakPolarHBondContact O-CB 3.32Å; R99-F102 PolarHBondContact O-N 2.92Å; R99-E103 HydrophobicContact CG-CG 4.27Å; R99-E103 IonicContact CZ-OE1 3.7Å; R99-E103 IonicContact NE-OE1 3.77Å; R99-E103 PolarHBondContact NE-OE1 3.41Å; R99-E103 IonicContact NH2-OE1 2.69Å; R99-E103 PolarHBondContact NH2-OE1 2.86Å; R99-E103 WeakPolarHBondContact O-CG 3.12Å; R99-E103 PolarHBondContact O-N 3.26Å
100	F	88.2	Confident	83.2	Confident	115 Å²	115	69.4 Å²	69.4	50%	0.504	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-30.6	-179.1	178.5	-112.8	0	0	0	113.8	T98 F102 K104	T98-F100 PolarHBondContact O-N 3.02Å; F100-F102 VanDerWaalsContact C-N 3.34Å; F100-K104 WeakPolarHBondContact O-CB 3.41Å; F100-K104 PolarHBondContact O-N 3Å
101	I	86.4	Confident	83.4	Confident	96 Å²	96	62.9 Å²	62.9	49%	0.492	35%	0.346	S	S	.	.	H	α-helix	trans	-68.6	-38.9	176.6	-53.6	175	0	0	0	109.9	T98 R99 K105	T98-I101 WeakPolarHBondContact O-CB 3.41Å; T98-I101 PolarHBondContact O-N 3.44Å; R99-I101 VanDerWaalsContact C-N 3.26Å; R99-I101 PolarHBondContact O-N 2.89Å; I101-K105 WeakPolarHBondContact O-CG 3.37Å; I101-K105 PolarHBondContact O-N 2.84Å; I101-K105 VanDerWaalsContact O-N 3.08Å
102	F	87.2	Confident	83.1	Confident	33 Å²	33	67.2 Å²	67.2	15%	0.145	36%	0.362	C	S	.	.	H	α-helix	trans	-72.9	-43.8	176.7	-76.7	-66.5	0	0	0	112.5	I84 I94 T98 R99 F100 K104 K105 L106	I84-F102 HydrophobicContact CD1-CB 3.67Å; I84-F102 HydrophobicContact CD1-CD1 4.04Å; I84-F102 HydrophobicContact CD1-CG 4.1Å; I94-F102 HydrophobicContact CD1-CB 4.37Å; I94-F102 HydrophobicContact CD1-CD2 4.46Å; I94-F102 HydrophobicContact CD1-CG 4.46Å; I94-F102 HydrophobicContact CG1-CD2 4.07Å; I94-F102 HydrophobicContact CG1-CE2 4.44Å; T98-F102 WeakPolarHBondContact O-CD2 3.37Å; T98-F102 PolarHBondContact O-N 3.44Å; R99-F102 WeakPolarHBondContact O-CB 3.32Å; R99-F102 PolarHBondContact O-N 2.92Å; F100-F102 VanDerWaalsContact C-N 3.34Å; F102-K104 VanDerWaalsContact C-N 3.31Å; F102-K104 PolarHBondContact O-N 3.42Å; F102-K105 PolarHBondContact O-N 3.06Å; F102-L106 WeakPolarHBondContact O-CB 3.49Å; F102-L106 PolarHBondContact O-N 2.8Å
103	E	88.7	Confident	82.6	Confident	9 Å²	9	70.8 Å²	70.8	4%	0.042	37%	0.37	C	S	.	.	H	α-helix	trans	-54.2	-46.4	171.4	-69.7	173.7	168.8	0	0	111.2	L69 L72 L80 R99 L106 A107	L69-E103 HydrophobicContact CD2-CB 4.43Å; L72-E103 HydrophobicContact CB-CB 4.44Å; L72-E103 HydrophobicContact CB-CG 4.29Å; L72-E103 WeakPolarHBondContact CD1-O 3.43Å; L80-E103 HydrophobicContact CD1-CG 4.16Å; L80-E103 HydrophobicContact CD2-CG 3.84Å; R99-E103 HydrophobicContact CG-CG 4.27Å; R99-E103 IonicContact CZ-OE1 3.7Å; R99-E103 IonicContact NE-OE1 3.77Å; R99-E103 PolarHBondContact NE-OE1 3.41Å; R99-E103 IonicContact NH2-OE1 2.69Å; R99-E103 PolarHBondContact NH2-OE1 2.86Å; R99-E103 WeakPolarHBondContact O-CG 3.12Å; R99-E103 PolarHBondContact O-N 3.26Å; E103-L106 PolarHBondContact O-N 3.34Å; E103-A107 WeakPolarHBondContact O-CB 3.32Å; E103-A107 PolarHBondContact O-N 3.42Å
104	K	89	Confident	81.6	Confident	106 Å²	106	68.3 Å²	68.3	46%	0.461	37%	0.365	S	S	.	.	H	α-helix	trans	-67.1	-38.1	179	-168.5	174.6	-178	176.3	0	113.4	M65 F100 F102 Q108	M65-K104 HydrophobicContact CE-CG 3.94Å; F100-K104 WeakPolarHBondContact O-CB 3.41Å; F100-K104 PolarHBondContact O-N 3Å; F102-K104 VanDerWaalsContact C-N 3.31Å; F102-K104 PolarHBondContact O-N 3.42Å; K104-Q108 WeakPolarHBondContact O-CB 3.2Å; K104-Q108 PolarHBondContact O-N 3.47Å; K104-Q108 VanDerWaalsContact O-N 3.1Å
105	K	86.9	Confident	79.8	Confident	122 Å²	122	70.5 Å²	70.5	53%	0.53	39%	0.394	S	S	.	.	H	α-helix	trans	-66.6	-42.9	175.2	-81	-176.9	174.1	-173.6	0	112.4	L89 I101 F102 Q108 A109	L89-K105 HydrophobicContact CD1-CB 4.32Å; I101-K105 WeakPolarHBondContact O-CG 3.37Å; I101-K105 PolarHBondContact O-N 2.84Å; I101-K105 VanDerWaalsContact O-N 3.08Å; F102-K105 PolarHBondContact O-N 3.06Å; K105-Q108 PolarHBondContact O-N 2.86Å; K105-A109 WeakPolarHBondContact O-CB 3.17Å; K105-A109 PolarHBondContact O-N 3.44Å
106	L	86.9	Confident	77.7	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.005	42%	0.415	C	S	.	.	H	α-helix	trans	-66.3	-44.8	177.1	175.9	59.4	0	0	0	111.1	L72 L80 E83 I84 A87 F102 E103 Q108 A109 L110	L72-L106 HydrophobicContact CD1-CB 3.96Å; L72-L106 HydrophobicContact CD1-CD2 3.85Å; L72-L106 HydrophobicContact CD1-CG 3.81Å; L72-L106 HydrophobicContact CD2-CD2 3.5Å; L72-L106 VanDerWaalsContact CD2-CD2 3.5Å; L72-L106 HydrophobicContact CD2-CG 4.2Å; L72-L106 HydrophobicContact CG-CD2 4.32Å; L80-L106 HydrophobicContact CD1-CD2 3.98Å; E83-L106 HydrophobicContact CB-CD1 4.39Å; E83-L106 HydrophobicContact CB-CD2 3.51Å; I84-L106 HydrophobicContact CG1-CB 4.13Å; I84-L106 HydrophobicContact CG1-CD2 4.04Å; A87-L106 HydrophobicContact CB-CD1 3.59Å; F102-L106 WeakPolarHBondContact O-CB 3.49Å; F102-L106 PolarHBondContact O-N 2.8Å; E103-L106 PolarHBondContact O-N 3.34Å; L106-Q108 VanDerWaalsContact C-N 3.31Å; L106-Q108 PolarHBondContact O-N 3.34Å; L106-A109 PolarHBondContact O-N 2.85Å; L106-L110 HydrophobicContact CD1-CD1 4Å; L106-L110 HydrophobicContact CD1-CD2 4.47Å; L106-L110 HydrophobicContact CD1-CG 3.97Å; L106-L110 HydrophobicContact CG-CD1 3.96Å; L106-L110 HydrophobicContact CG-CG 4.39Å; L106-L110 WeakPolarHBondContact O-CG 3.31Å; L106-L110 PolarHBondContact O-N 3.16Å
107	A	86.8	Confident	75.3	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-57.9	-43	176.1	0	0	0	0	0	112.3	M65 V68 L69 L72 E103 L111	M65-A107 HydrophobicContact CE-CB 3.96Å; M65-A107 HydrophobicContact SD-CB 3.69Å; V68-A107 HydrophobicContact CB-CB 4.28Å; V68-A107 HydrophobicContact CG1-CB 3.76Å; L69-A107 HydrophobicContact CD2-CB 3.77Å; L69-A107 HydrophobicContact CG-CB 3.99Å; L72-A107 HydrophobicContact CD1-CB 3.98Å; E103-A107 WeakPolarHBondContact O-CB 3.32Å; E103-A107 PolarHBondContact O-N 3.42Å; A107-L111 PolarHBondContact O-N 3.36Å; A107-L111 VanDerWaalsContact O-N 3.12Å
108	Q	85.1	Confident	73	Confident	97 Å²	97	79.3 Å²	79.3	45%	0.453	41%	0.414	S	S	.	.	H	α-helix	trans	-64.2	-44.6	175.2	-177.8	174.5	-14.6	0	0	112.2	M65 K104 K105 L106 L110 L111 E112	M65-Q108 HydrophobicContact CE-CB 4.49Å; K104-Q108 WeakPolarHBondContact O-CB 3.2Å; K104-Q108 PolarHBondContact O-N 3.47Å; K104-Q108 VanDerWaalsContact O-N 3.1Å; K105-Q108 PolarHBondContact O-N 2.86Å; L106-Q108 VanDerWaalsContact C-N 3.31Å; L106-Q108 PolarHBondContact O-N 3.34Å; Q108-L110 PolarHBondContact O-N 2.91Å; Q108-L111 WeakPolarHBondContact O-CB 3.42Å; Q108-L111 PolarHBondContact O-N 3.05Å; Q108-E112 HydrophobicContact CG-CG 4.48Å; Q108-E112 VanDerWaalsContact CG-OE1 3.28Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.48Å; Q108-E112 PolarHBondContact NE2-OE1 3.29Å; Q108-E112 WeakPolarHBondContact O-CG 3.29Å; Q108-E112 PolarHBondContact O-N 3.41Å
109	A	83.1	Confident	70.5	Confident	13 Å²	13	81.9 Å²	81.9	11%	0.107	43%	0.433	C	S	.	.	H	α-helix	trans	-64.5	-37.1	178.5	0	0	0	0	0	113	L89 K105 L106 E112 Q113	L89-A109 HydrophobicContact CD1-CB 3.97Å; K105-A109 WeakPolarHBondContact O-CB 3.17Å; K105-A109 PolarHBondContact O-N 3.44Å; L106-A109 PolarHBondContact O-N 2.85Å; A109-E112 PolarHBondContact O-N 3.48Å; A109-Q113 WeakPolarHBondContact O-CB 3.4Å; A109-Q113 VanDerWaalsContact O-CG 3.3Å; A109-Q113 WeakPolarHBondContact O-CG 3.3Å; A109-Q113 PolarHBondContact O-N 3.18Å
110	L	82	Confident	67.7	Low	41 Å²	41	88.9 Å²	88.9	22%	0.215	47%	0.466	C	S	.	.	H	α-helix	trans	-66.2	-38.4	175	-69.7	170.5	0	0	0	111.9	V68 L106 Q108 G114	V68-L110 HydrophobicContact CG1-CD1 3.96Å; L106-L110 HydrophobicContact CD1-CD1 4Å; L106-L110 HydrophobicContact CD1-CD2 4.47Å; L106-L110 HydrophobicContact CD1-CG 3.97Å; L106-L110 HydrophobicContact CG-CD1 3.96Å; L106-L110 HydrophobicContact CG-CG 4.39Å; L106-L110 WeakPolarHBondContact O-CG 3.31Å; L106-L110 PolarHBondContact O-N 3.16Å; Q108-L110 PolarHBondContact O-N 2.91Å; L110-G114 PolarHBondContact O-N 3.17Å
111	L	82.3	Confident	64.8	Low	72 Å²	72	90 Å²	90	38%	0.377	48%	0.477	S	S	.	.	H	α-helix	trans	-65.1	-43.9	172.6	-94.5	155.2	0	0	0	112.5	M63 M65 A107 Q108 Q113 G114	M63-L111 WeakPolarHBondContact O-CD2 3.49Å; M65-L111 HydrophobicContact CB-CD1 3.88Å; M65-L111 HydrophobicContact CG-CD1 4.28Å; M65-L111 HydrophobicContact SD-CD1 3.48Å; M65-L111 WeakPolarHBondContact SD-CD1 3.35Å; A107-L111 PolarHBondContact O-N 3.36Å; A107-L111 VanDerWaalsContact O-N 3.12Å; Q108-L111 WeakPolarHBondContact O-CB 3.42Å; Q108-L111 PolarHBondContact O-N 3.05Å; L111-Q113 VanDerWaalsContact C-N 3.33Å; L111-Q113 PolarHBondContact O-N 3.4Å; L111-G114 PolarHBondContact O-N 2.99Å
112	E	73.8	Confident	62	Low	128 Å²	128	93.2 Å²	93.2	60%	0.598	49%	0.49	S	S	*	.	H	α-helix	trans	-67	-32.7	177.5	-72.7	172.2	-169.2	0	0	112.2	Q108 A109	Q108-E112 HydrophobicContact CG-CG 4.48Å; Q108-E112 VanDerWaalsContact CG-OE1 3.28Å; Q108-E112 WeakPolarHBondContact CG-OE1 3.48Å; Q108-E112 PolarHBondContact NE2-OE1 3.29Å; Q108-E112 WeakPolarHBondContact O-CG 3.29Å; Q108-E112 PolarHBondContact O-N 3.41Å; A109-E112 PolarHBondContact O-N 3.48Å
113	Q	65.6	Low	59.1	Low	107 Å²	107	100.6 Å²	100.6	50%	0.5	52%	0.524	S	S	.	.	H	α-helix	trans	-71.8	-36.5	171.8	-73.9	176.8	6.9	0	0	112.8	A109 L111 G115 R116	A109-Q113 WeakPolarHBondContact O-CB 3.4Å; A109-Q113 VanDerWaalsContact O-CG 3.3Å; A109-Q113 WeakPolarHBondContact O-CG 3.3Å; A109-Q113 PolarHBondContact O-N 3.18Å; L111-Q113 VanDerWaalsContact C-N 3.33Å; L111-Q113 PolarHBondContact O-N 3.4Å; Q113-G115 PolarHBondContact O-N 3.45Å; Q113-G115 VanDerWaalsContact O-N 3.14Å; Q113-R116 PolarHBondContact O-N 3.43Å; Q113-R116 VanDerWaalsContact O-N 3.12Å
114	G	54.6	Low	56.1	Low	61 Å²	61	108.3 Å²	108.3	63%	0.629	56%	0.56	S	S	*	*	H	α-helix	trans	-59.4	-23.4	177	0	0	0	0	0	114.3	L110 L111 R116	L110-G114 PolarHBondContact O-N 3.17Å; L111-G114 PolarHBondContact O-N 2.99Å; G114-R116 VanDerWaalsContact C-N 3.3Å; G114-R116 PolarHBondContact O-N 2.79Å
115	G	44.2	Very low	53.2	Low	73 Å²	73	108.1 Å²	108.1	75%	0.753	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	0.5	176.2	0	0	0	0	0	115.9	Q113	Q113-G115 PolarHBondContact O-N 3.45Å; Q113-G115 VanDerWaalsContact O-N 3.14Å
116	R	35.3	Very low	50.2	Low	219 Å²	219	106.1 Å²	106.1	83%	0.826	59%	0.592	S	S	*	*			trans	-144.7	70.2	-171.1	-159.9	-176.2	-173.4	-161.1	1.3	115.1	Q113 G114 P118	Q113-R116 PolarHBondContact O-N 3.43Å; Q113-R116 VanDerWaalsContact O-N 3.12Å; G114-R116 VanDerWaalsContact C-N 3.3Å; G114-R116 PolarHBondContact O-N 2.79Å; R116-P118 WeakPolarHBondContact O-CD 3.42Å
117	L	27.5	Very low	47.3	Very low	165 Å²	165	110.3 Å²	110.3	86%	0.864	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-83.9	131.1	166	-79.1	167.3	0	0	0	112.4
118	P	31.6	Very low	44.4	Very low	114 Å²	114	116.7 Å²	116.7	74%	0.74	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-101	141.8	134.2	33.7	-28.5	0	0	0	110	R116	R116-P118 WeakPolarHBondContact O-CD 3.42Å
119	S	29.5	Very low	41.6	Very low	94 Å²	94	116.2 Å²	116.2	66%	0.657	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-73.9	147.6	176.8	51	0	0	0	0	113.1
120	F	26.7	Very low	38.8	Very low	200 Å²	200	123 Å²	123	88%	0.877	71%	0.712	S	S	*	*			trans	-161.2	164	136.9	-98.5	-59.6	0	0	0	110.9
121	D	26.8	Very low	36.2	Very low	138 Å²	138	125.9 Å²	125.9	74%	0.738	74%	0.736	S	S	*	*			trans	-98.5	-179.6	-149.2	-62.8	-84.3	0	0	0	117.4
122	H	29.5	Very low	33.8	Very low	165 Å²	165	131 Å²	131	76%	0.764	76%	0.758	S	S	*	*			trans	-50.6	151.7	-179.1	-65.5	-99.8	0	0	0	116.5
123	H	25.1	Very low	31.6	Very low	187 Å²	187	130.4 Å²	130.4	87%	0.866	76%	0.759	S	S	*	*				-157.8	-171.8	113.5	-109.6	-64.5	0	0	0	112
124	E	26.6	Very low	29.8	Very low	172 Å²	172	130.8 Å²	130.8	80%	0.804	77%	0.769	S	S	*	*			trans	-142	155.6	-139.8	-163.7	-176.9	-174.9	0	0	114.7
125	A	27.8	Very low	28.6	Very low	102 Å²	102	134.7 Å²	134.7	84%	0.843	77%	0.77	S	S	*	*			trans	64.5	165.7	160.9	0	0	0	0	0	119.8
126	G	24.2	Very low	27.8	Very low	80 Å²	80	140.8 Å²	140.8	83%	0.825	77%	0.771	S	S	*	*			trans	132.8	89.1	157.8	0	0	0	0	0	117.4
127	A	25.9	Very low	27.4	Very low	88 Å²	88	136.8 Å²	136.8	73%	0.727	76%	0.764	S	S	*	*			trans	-70.3	172.2	-178.4	0	0	0	0	0	117.4
128	T	25.6	Very low	27.4	Very low	135 Å²	135	136.3 Å²	136.3	83%	0.828	76%	0.762	S	S	*	*			trans	71.1	109.9	147.7	39.3	0	0	0	0	122.9
129	A	25.2	Very low	27.1	Very low	86 Å²	86	140.9 Å²	140.9	71%	0.711	77%	0.77	S	S	*	*				86.7	153.3	111.8	0	0	0	0	0	123.6
130	L	25.2	Very low	26.9	Very low	156 Å²	156	141.7 Å²	141.7	82%	0.817	78%	0.776	S	S	*	*			trans	71.2	101.9	161	-96	77	0	0	0	121.9
131	S	27.1	Very low	26.9	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	77%	0.766	S	S	*	*				78.7	153.9	107.8	-71.5	0	0	0	0	124.5
132	Q	32.1	Very low	26.8	Very low	178 Å²	178	139.2 Å²	139.2	83%	0.832	78%	0.777	S	S	*	*			trans	75.9	139.1	156.1	-77.6	179.5	-26.7	0	0	119.1
133	D	27.7	Very low	26.7	Very low	117 Å²	117	134.9 Å²	134.9	63%	0.626	78%	0.776	S	S	*	*			cis	-165.5	-176.3	-20.2	-146.4	-37.6	0	0	0	110.3
134	T	27.6	Very low	26.9	Very low	114 Å²	114	133.9 Å²	133.9	70%	0.699	78%	0.777	S	S	*	*			trans	98.8	77.3	156.3	-36.7	0	0	0	0	117.5
135	Q	29.3	Very low	27.4	Very low	143 Å²	143	131.7 Å²	131.7	67%	0.668	78%	0.778	S	S	*	*				35.1	139.1	115.3	-48	172.7	19.5	0	0	118.5
136	R	28.7	Very low	27.4	Very low	201 Å²	201	132.4 Å²	132.4	76%	0.758	77%	0.772	S	S	*	*				-169.7	143.4	67	-93.3	-170.3	165.7	-170	-3.7	116.1
137	I	26.7	Very low	27.6	Very low	135 Å²	135	134 Å²	134	69%	0.692	76%	0.762	S	S	*	*			trans	69.8	102.4	136.4	-60.7	174.5	0	0	0	119.9
138	L	27.3	Very low	27.7	Very low	155 Å²	155	138.1 Å²	138.1	81%	0.812	77%	0.766	S	S	*	*			trans	-23.5	145.4	142.9	-65.4	153.5	0	0	0	117.9
139	K	24.7	Very low	27.7	Very low	211 Å²	211	136 Å²	136	92%	0.917	76%	0.763	S	S	*	*				-153.2	162.5	120.5	-117.6	178.6	-175.9	-175.1	0	112
140	S	25.5	Very low	27.7	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	76%	0.762	S	S	*	*			trans	-140.6	176.8	-166.7	53.7	0	0	0	0	112
141	A	26.3	Very low	27.7	Very low	83 Å²	83	138.2 Å²	138.2	69%	0.686	77%	0.769	S	S	*	*			trans	84	105.5	166.8	0	0	0	0	0	118.3
142	E	25.8	Very low	27.7	Very low	204 Å²	204	138.1 Å²	138.1	95%	0.953	77%	0.768	S	S	*	*				68.3	124	104.3	-159.6	163.1	-128.8	0	0	120
143	G	25.8	Very low	27.6	Very low	73 Å²	73	138.8 Å²	138.8	75%	0.753	77%	0.772	S	S	*	*			trans	153.3	106.8	166.1	0	0	0	0	0	115.4
144	N	29.7	Very low	27.7	Very low	166 Å²	166	139.6 Å²	139.6	89%	0.888	78%	0.776	S	S	*	*			trans	-105.6	150.1	159.5	-98.3	1.6	0	0	0	108.9
145	P	38.3	Very low	27.9	Very low	127 Å²	127	145.2 Å²	145.2	83%	0.825	78%	0.784	S	S	*	*				-140.3	174.6	120.8	33.8	-18.3	0	0	0	114.5
146	T	27.8	Very low	27.9	Very low	117 Å²	117	144.6 Å²	144.6	72%	0.718	79%	0.785	S	S	*	*			trans	-72.7	166.2	176.6	49.4	0	0	0	0	111.8
147	D	27.6	Very low	27.8	Very low	114 Å²	114	144.6 Å²	144.6	61%	0.61	79%	0.791	S	S	*	*				-164.6	159.7	50.7	-109.4	-61.9	0	0	0	115.8
148	Q	27.5	Very low	27.9	Very low	173 Å²	173	140.2 Å²	140.2	81%	0.808	78%	0.779	S	S	*	*			trans	30	144.5	143.1	-73.7	172.3	78.8	0	0	122.3
149	A	26.2	Very low	28	Very low	92 Å²	92	143.4 Å²	143.4	76%	0.76	78%	0.782	S	S	*	*			cis	-162.3	159.7	1.3	0	0	0	0	0	113.4
150	G	25.1	Very low	28.2	Very low	68 Å²	68	137.9 Å²	137.9	70%	0.701	77%	0.77	S	S	*	*			trans	77.8	113	139.9	0	0	0	0	0	120.4
151	F	25.5	Very low	28.5	Very low	220 Å²	220	139.7 Å²	139.7	97%	0.965	78%	0.776	S	S	*	*				-165.4	159.7	127.9	-108.6	-70.8	0	0	0	109.9
152	S	27.5	Very low	28.5	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	78%	0.775	S	S	*	*			trans	-127.7	143.3	178.5	55.7	0	0	0	0	110.5
153	E	30.3	Very low	28.7	Very low	193 Å²	193	137.6 Å²	137.6	90%	0.902	77%	0.774	S	S	*	*				-171.2	170.8	122.6	-109.9	179.1	-169.4	0	0	113.3
154	D	29.3	Very low	28.7	Very low	133 Å²	133	141.2 Å²	141.2	71%	0.711	78%	0.776	S	S	*	*			trans	-77.7	153.3	-176.2	-178.5	22.2	0	0	0	113.1
155	R	31.2	Very low	29.5	Very low	233 Å²	233	138.2 Å²	138.2	88%	0.879	77%	0.766	S	S	*	*			trans	-169.9	110.7	137	-104.8	157.2	-155.2	-117.4	0.9	114.5
156	D	28.4	Very low	29.2	Very low	129 Å²	129	138 Å²	138	69%	0.69	77%	0.765	S	S	*	*			trans	-31.3	150.8	144.1	-178.5	23.1	0	0	0	115	G158	D156-G158 PolarHBondContact OD1-N 3.05Å; D156-G158 VanDerWaalsContact OD1-N 3.11Å
157	F	27.5	Very low	29.2	Very low	201 Å²	201	141.9 Å²	141.9	88%	0.882	77%	0.774	S	S	*	*			trans	-148.8	52	171.1	-128.5	-71.4	0	0	0	113.7
158	G	29.3	Very low	29.3	Very low	43 Å²	43	145.3 Å²	145.3	44%	0.443	79%	0.787	S	S	.	*			trans	-90	120.8	165.9	0	0	0	0	0	114	D156	D156-G158 PolarHBondContact OD1-N 3.05Å; D156-G158 VanDerWaalsContact OD1-N 3.11Å
159	Y	29.8	Very low	29.2	Very low	222 Å²	222	146 Å²	146	87%	0.871	79%	0.79	S	S	*	*			trans	-150.5	137.9	151.2	-85	-86.4	0	0	0	107.8
160	S	28.3	Very low	29.2	Very low	96 Å²	96	145 Å²	145	67%	0.671	78%	0.782	S	S	*	*			cis	114.3	119.8	10	-74.7	0	0	0	0	112.7
161	V	30.8	Very low	29.3	Very low	148 Å²	148	148.5 Å²	148.5	90%	0.897	79%	0.789	S	S	*	*			trans	69.6	137.3	157.6	-175.8	0	0	0	0	116.6
162	G	27.8	Very low	29.3	Very low	63 Å²	63	143.9 Å²	143.9	65%	0.649	78%	0.779	S	S	*	*			trans	-93.7	-164.1	174.6	0	0	0	0	0	112.3
163	L	28.5	Very low	29.3	Very low	179 Å²	179	144.1 Å²	144.1	94%	0.937	78%	0.781	S	S	*	*			trans	-155.4	168.7	163.9	-107.9	178.1	0	0	0	112.2
164	N	26.8	Very low	29.1	Very low	149 Å²	149	144.2 Å²	144.2	80%	0.797	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-83.4	171.4	175.5	-114.6	-7.5	0	0	0	111.4
165	P	45.2	Very low	28.8	Very low	104 Å²	104	143.9 Å²	143.9	68%	0.675	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-77.4	156	-173.5	32.7	-36.6	0	0	0	113.7
166	P	32	Very low	28.4	Very low	123 Å²	123	144.8 Å²	144.8	80%	0.799	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-85	162.4	167	35.8	-34.2	0	0	0	112.7
167	E	27.9	Very low	28.3	Very low	197 Å²	197	142.7 Å²	142.7	92%	0.921	78%	0.78	S	S	*	*			trans	-97.7	-160.5	178.3	-64.1	-179.7	124.8	0	0	112
168	E	30.2	Very low	28.4	Very low	186 Å²	186	139.4 Å²	139.4	87%	0.869	78%	0.776	S	S	*	*			trans	-86.2	-173.8	-165.5	-58.1	-167.1	123.4	0	0	115.7
169	E	26	Very low	28.7	Very low	187 Å²	187	143 Å²	143	87%	0.874	79%	0.792	S	S	*	*			trans	79	144.1	168.1	-63.3	-157.4	-143.2	0	0	119
170	A	26.6	Very low	29.1	Very low	71 Å²	71	138 Å²	138	59%	0.587	79%	0.786	S	S	*	*			cis	-165.8	164.1	-22.1	0	0	0	0	0	110.5
171	V	26.8	Very low	29.1	Very low	143 Å²	143	138.8 Å²	138.8	87%	0.867	79%	0.792	S	S	*	*			trans	56.8	153.9	167.9	-103.4	0	0	0	0	117.4
172	T	25	Very low	29.1	Very low	122 Å²	122	136 Å²	136	75%	0.748	79%	0.785	S	S	*	*			cis	-128.8	165.9	-4.5	60.2	0	0	0	0	107.7
173	S	28.3	Very low	29.2	Very low	104 Å²	104	139.4 Å²	139.4	73%	0.727	79%	0.792	S	S	*	*				-176.6	135	55.8	42.5	0	0	0	0	115.5
174	K	25.6	Very low	29.2	Very low	195 Å²	195	138 Å²	138	85%	0.848	79%	0.786	S	S	*	*			trans	58.7	83.7	130.5	-147.7	167.1	-170.7	174	0	121.5
175	T	23.3	Very low	29.2	Very low	127 Å²	127	135.5 Å²	135.5	78%	0.779	78%	0.776	S	S	*	*				61	110.9	118.7	-46.9	0	0	0	0	120.9
176	R	23.3	Very low	28.5	Very low	251 Å²	251	140.4 Å²	140.4	95%	0.947	78%	0.783	S	S	*	*				-143.1	158.2	122.1	-161.1	164.9	-179.4	165.7	0.5	110.4
177	S	25.2	Very low	28.4	Very low	86 Å²	86	138.1 Å²	138.1	60%	0.601	78%	0.781	S	S	*	*			trans	-126.3	138.2	-156.4	61.4	0	0	0	0	111.8
178	V	28.9	Very low	28.5	Very low	131 Å²	131	135.2 Å²	135.2	79%	0.794	78%	0.777	S	S	*	*				79.6	136.5	101.4	163.3	0	0	0	0	114.6
179	P	37.1	Very low	28.7	Very low	118 Å²	118	131.1 Å²	131.1	77%	0.766	78%	0.775	S	S	*	*			cis	-137.8	-127	-19.2	42.3	-19.6	0	0	0	113.4
180	P	38.3	Very low	29	Very low	117 Å²	117	128.7 Å²	128.7	76%	0.76	77%	0.773	S	S	*	*			trans	-110.3	-179.7	-146.4	45.2	-29.9	0	0	0	115.2
181	S	27.2	Very low	29.4	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	79%	0.785	S	S	*	*			trans	-147	145.9	138.8	-166.1	0	0	0	0	110.2
182	A	31.1	Very low	29.7	Very low	89 Å²	89	129.2 Å²	129.2	74%	0.736	78%	0.778	S	S	*	*			trans	-114.7	141.3	175.5	0	0	0	0	0	109.6
183	V	30.4	Very low	30.1	Very low	134 Å²	134	128.9 Å²	128.9	81%	0.812	78%	0.781	S	S	*	*			trans	-142.7	108	167.5	-178.2	0	0	0	0	108
184	D	28.1	Very low	30.5	Very low	151 Å²	151	133.6 Å²	133.6	81%	0.807	79%	0.788	S	S	*	*			trans	-70	144.9	161.7	-62.7	-72.5	0	0	0	110
185	T	27.8	Very low	31.6	Very low	96 Å²	96	132.6 Å²	132.6	59%	0.589	79%	0.786	S	S	*	*				-164.3	155	122.2	-13.5	0	0	0	0	112.8
186	Y	30.2	Very low	33.3	Very low	207 Å²	207	131 Å²	131	81%	0.812	78%	0.779	S	S	*	*			trans	39.6	120.6	161	40.9	-119.1	0	0	0	120.2
187	G	29.1	Very low	35.5	Very low	74 Å²	74	122.9 Å²	122.9	76%	0.763	76%	0.758	S	S	*	*			trans	-92.4	173.8	168.7	0	0	0	0	0	113.8
188	T	29.1	Very low	38.3	Very low	136 Å²	136	122.6 Å²	122.6	83%	0.834	75%	0.75	S	S	*	*			trans	-143.2	134.5	155.4	-65	0	0	0	0	107.4	V190	T188-V190 PolarHBondContact O-N 3.09Å
189	A	35.9	Very low	41.1	Very low	100 Å²	100	118.6 Å²	118.6	83%	0.826	72%	0.72	S	S	*	*			trans	-72.8	120.4	-176	0	0	0	0	0	111
190	V	32.4	Very low	43.5	Very low	137 Å²	137	114.6 Å²	114.6	83%	0.83	69%	0.69	S	S	*	*			trans	-104.7	118.3	163.5	179.5	0	0	0	0	107.6	T188 A192	T188-V190 PolarHBondContact O-N 3.09Å; V190-A192 PolarHBondContact O-N 2.91Å
191	T	34.5	Very low	45.9	Very low	137 Å²	137	109 Å²	109	84%	0.84	65%	0.654	S	S	*	*			trans	-71	96.9	-178.1	48	0	0	0	0	110.8	S193	T191-S193 PolarHBondContact O-N 2.85Å
192	A	32.1	Very low	48.7	Very low	87 Å²	87	103.6 Å²	103.6	72%	0.719	62%	0.616	S	S	*	*			trans	-59.9	129	166.9	0	0	0	0	0	109.8	V190 K194	V190-A192 PolarHBondContact O-N 2.91Å; A192-K194 PolarHBondContact O-N 2.99Å; A192-K194 VanDerWaalsContact O-N 3.11Å
193	S	34.2	Very low	51.1	Low	115 Å²	115	99.7 Å²	99.7	80%	0.804	58%	0.584	S	S	*	*			trans	-61.3	111.5	173.2	50	0	0	0	0	109.5	T191 E195	T191-S193 PolarHBondContact O-N 2.85Å; S193-E195 PolarHBondContact O-N 2.88Å; S193-E195 VanDerWaalsContact O-N 3.14Å
194	K	36.3	Very low	53.4	Low	203 Å²	203	95.8 Å²	95.8	88%	0.883	56%	0.561	S	S	*	*			trans	-66.1	112.1	177	-69.8	-174.7	177.2	-177	0	110	A192	A192-K194 PolarHBondContact O-N 2.99Å; A192-K194 VanDerWaalsContact O-N 3.11Å
195	E	49.4	Very low	55.3	Low	174 Å²	174	92.5 Å²	92.5	81%	0.813	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-56.4	146.3	151.8	-65.6	-173	136.9	0	0	108.7	S193	S193-E195 PolarHBondContact O-N 2.88Å; S193-E195 VanDerWaalsContact O-N 3.14Å
196	P	58.9	Low	56.6	Low	95 Å²	95	98.7 Å²	98.7	62%	0.617	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-61.1	136	179.6	25.5	-34	0	0	0	110.3	L198	P196-L198 PolarHBondContact O-N 3.08Å; P196-L198 VanDerWaalsContact O-N 3.16Å
197	P	69.8	Low	57.4	Low	80 Å²	80	97.4 Å²	97.4	52%	0.519	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-62.7	120	-177.3	25.3	-33.5	0	0	0	110.5	Y199	P197-Y199 HydrophobicContact CB-CE2 4.16Å; P197-Y199 HydrophobicContact CG-CE2 4.2Å; P197-Y199 WeakPolarHBondContact O-CE2 3.38Å
198	L	83.6	Confident	57.5	Low	80 Å²	80	101.1 Å²	101.1	42%	0.419	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-94	120.3	177.6	-72.6	171.4	0	0	0	110.1	P196 Y200 F240	P196-L198 PolarHBondContact O-N 3.08Å; P196-L198 VanDerWaalsContact O-N 3.16Å; L198-Y200 HydrophobicContact CB-CE2 4.28Å; L198-Y200 WeakPolarHBondContact O-CD2 3.46Å; L198-Y200 VanDerWaalsContact O-CE2 3.28Å; L198-Y200 WeakPolarHBondContact O-CE2 3.3Å; L198-F240 CarbonylContact C-O 3.54Å; L198-F240 WeakPolarHBondContact CA-O 3.39Å
199	Y	87.4	Confident	58	Low	46 Å²	46	101 Å²	101	18%	0.18	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.5	129.9	176.7	-59	-87.6	0	0	0	109.8	P197 E220 A239 F240 R243	P197-Y199 HydrophobicContact CB-CE2 4.16Å; P197-Y199 HydrophobicContact CG-CE2 4.2Å; P197-Y199 WeakPolarHBondContact O-CE2 3.38Å; Y199-E220 HydrophobicContact CD1-CG 3.59Å; Y199-E220 HydrophobicContact CE1-CG 3.5Å; Y199-A239 CarbonylContact O-C 3.56Å; Y199-A239 WeakPolarHBondContact O-CA 3.48Å; Y199-F240 PolarHBondContact N-O 2.78Å; Y199-F240 PolarHBondContact O-N 2.88Å; Y199-R243 HydrophobicContact CD1-CB 3.74Å; Y199-R243 HydrophobicContact CD1-CG 3.77Å; Y199-R243 HydrophobicContact CD2-CB 4.05Å; Y199-R243 HydrophobicContact CE1-CB 3.79Å; Y199-R243 HydrophobicContact CE1-CG 3.98Å; Y199-R243 HydrophobicContact CE2-CB 4.09Å; Y199-R243 HydrophobicContact CG-CB 3.88Å; Y199-R243 HydrophobicContact CG-CG 4.26Å
200	Y	88.4	Confident	58.3	Low	34 Å²	34	101.6 Å²	101.6	13%	0.133	56%	0.558	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.5	105.8	-176.5	-59	-80.9	0	0	0	109.9	L198 V218 Y219 K222 A225 K238 A239	L198-Y200 HydrophobicContact CB-CE2 4.28Å; L198-Y200 WeakPolarHBondContact O-CD2 3.46Å; L198-Y200 VanDerWaalsContact O-CE2 3.28Å; L198-Y200 WeakPolarHBondContact O-CE2 3.3Å; Y200-V218 WeakPolarHBondContact O-CA 3.17Å; Y200-Y219 WeakPolarHBondContact CD2-O 3.23Å; Y200-Y219 PolarHBondContact N-O 2.92Å; Y200-Y219 PolarHBondContact O-N 3.33Å; Y200-K222 HydrophobicContact CD1-CG 4.46Å; Y200-K222 HydrophobicContact CD2-CB 4.29Å; Y200-K222 HydrophobicContact CE1-CB 4.12Å; Y200-K222 HydrophobicContact CE1-CD 4.31Å; Y200-K222 HydrophobicContact CE1-CG 3.99Å; Y200-K222 HydrophobicContact CE2-CB 3.75Å; Y200-A225 HydrophobicContact CG-CB 4.19Å; Y200-K238 WeakPolarHBondContact CA-O 3.42Å; Y200-A239 HydrophobicContact CD1-CB 3.66Å; Y200-A239 HydrophobicContact CE1-CB 3.54Å
201	G	87.9	Confident	59	Low	0 Å²	0	99.8 Å²	99.8	0%	0	56%	0.558	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.9	138.1	174.3	0	0	0	0	0	111.6	F237 K238 F249	G201-F237 VanDerWaalsContact O-CA 3.26Å; G201-F237 WeakPolarHBondContact O-CA 3.41Å; G201-K238 PolarHBondContact N-O 3.29Å; G201-K238 PolarHBondContact O-N 3.38Å; G201-F249 WeakPolarHBondContact O-CE1 3.27Å
202	V	85.2	Confident	59.3	Low	0 Å²	0	104.5 Å²	104.5	0%	0	56%	0.56	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.3	119	175.7	-179	0	0	0	0	108.9	H217 Y219 A225 A228 V229 R236 F237 A250	V202-H217 HydrophobicContact CB-CB 3.99Å; V202-H217 PolarHBondContact N-O 2.91Å; V202-Y219 HydrophobicContact CG2-CD2 4.21Å; V202-Y219 HydrophobicContact CG2-CE2 4.05Å; V202-A225 HydrophobicContact CG2-CB 4.26Å; V202-A228 HydrophobicContact CG2-CB 4.44Å; V202-V229 HydrophobicContact CG1-CG2 3.8Å; V202-V229 HydrophobicContact CG2-CG2 3.94Å; V202-R236 WeakPolarHBondContact CA-O 3.31Å; V202-F237 HydrophobicContact CG2-CB 4.14Å; V202-A250 WeakPolarHBondContact O-CA 3.46Å; V202-A250 WeakPolarHBondContact O-CB 3.42Å
203	C	83.2	Confident	59.7	Low	8 Å²	8	106.9 Å²	106.9	5%	0.054	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.1	111.5	180	178.7	0	0	0	0	109.4	S235 R236 F249	C203-S235 CarbonylContact O-C 3.55Å; C203-S235 WeakPolarHBondContact O-CA 3.34Å; C203-S235 WeakPolarHBondContact O-CB 3.2Å; C203-R236 HydrophobicContact CB-CB 4.49Å; C203-R236 PolarHBondContact N-O 3.07Å; C203-R236 PolarHBondContact O-N 3.42Å; C203-F249 HydrophobicContact CB-CD1 4.33Å; C203-F249 HydrophobicContact CB-CE1 3.98Å; C203-F249 HydrophobicContact CB-CZ 4.35Å; C203-F249 WeakPolarHBondContact CB-O 3.41Å
204	P	78.6	Confident	60.4	Low	51 Å²	51	110.1 Å²	110.1	33%	0.331	56%	0.563	S	S	.	*			trans	-58.1	161.3	168	-21.5	33.8	0	0	0	112	I232	P204-I232 HydrophobicContact CB-CG2 4Å; P204-I232 HydrophobicContact CG-CG2 4.28Å
205	V	66.9	Low	61.6	Low	82 Å²	82	109.4 Å²	109.4	50%	0.497	56%	0.555	S	S	.	*			trans	-116.6	92.4	174	175.9	0	0	0	0	108.9	G234	V205-G234 WeakPolarHBondContact CG2-O 3.29Å
206	Y	55.1	Low	62.8	Low	226 Å²	226	103.7 Å²	103.7	89%	0.886	53%	0.529	S	S	*	.			trans	-149.2	117.4	164	-88	-79.3	0	0	0	108.2
207	E	46.5	Very low	63.9	Low	180 Å²	180	101.5 Å²	101.5	84%	0.841	51%	0.511	S	S	*	.			trans	-84.3	166	153.4	-68.6	178.1	131.5	0	0	108.2
208	D	32.3	Very low	64.6	Low	152 Å²	152	98.5 Å²	98.5	81%	0.813	49%	0.491	S	S	*	.	S	Bend	trans	62.9	73.2	179.6	-62.2	-19.1	0	0	0	117.9
209	V	40	Very low	64.8	Low	133 Å²	133	97.3 Å²	97.3	81%	0.806	48%	0.481	S	S	*	.				52.9	137.5	113.4	176.4	0	0	0	0	118.9
210	P	41.7	Very low	64.7	Low	114 Å²	114	101 Å²	101	74%	0.74	50%	0.5	S	S	*	.			cis	-128	173.9	16.8	27.2	-4.5	0	0	0	116.9	R212	P210-R212 PolarHBondContact O-N 3.49Å; P210-R212 VanDerWaalsContact O-N 3.12Å
211	A	47.4	Very low	64.5	Low	99 Å²	99	102.3 Å²	102.3	82%	0.818	51%	0.51	S	S	*	.			trans	-25.3	98.4	171.3	0	0	0	0	0	118.1
212	R	40.1	Very low	64.4	Low	236 Å²	236	107.8 Å²	107.8	89%	0.891	53%	0.533	S	S	*	.			trans	-168.8	72.1	149.7	-107.7	163.6	-161.2	-144.3	4.2	113.1	P210	P210-R212 PolarHBondContact O-N 3.49Å; P210-R212 VanDerWaalsContact O-N 3.12Å
213	N	40.7	Very low	64.5	Low	136 Å²	136	115.8 Å²	115.8	73%	0.727	57%	0.568	S	S	*	*			trans	172.4	100.5	146.2	-92.8	-33.5	0	0	0	110.9	R215	N213-R215 PolarHBondContact O-N 2.89Å
214	E	49	Very low	64.5	Low	183 Å²	183	119.7 Å²	119.7	86%	0.855	59%	0.586	S	S	*	*			trans	-77.7	29.2	174.2	-59.3	-174.3	117	0	0	113.3	I216	E214-I216 PolarHBondContact O-N 3.27Å; E214-I216 VanDerWaalsContact O-N 3.09Å
215	R	61.6	Low	64.8	Low	189 Å²	189	117.3 Å²	117.3	71%	0.713	57%	0.57	S	S	*	*			trans	-79.8	96.2	-179.8	-69	-171.5	178.2	-166.5	-1	109.6	N213 H217	N213-R215 PolarHBondContact O-N 2.89Å; R215-H217 PolarHBondContact O-CE1 2.92Å; R215-H217 PolarHBondContact O-N 3.32Å; R215-H217 PolarHBondContact O-ND1 3.48Å
216	I	74.6	Confident	65.6	Low	54 Å²	54	117 Å²	117	28%	0.277	57%	0.565	S	S	.	*			trans	-68.8	124.9	169.8	-33	168.2	0	0	0	108.3	E214 V218 E247 A250 R251	E214-I216 PolarHBondContact O-N 3.27Å; E214-I216 VanDerWaalsContact O-N 3.09Å; I216-V218 HydrophobicContact CG2-CG2 4.21Å; I216-V218 PolarHBondContact O-N 2.99Å; I216-E247 HydrophobicContact CD1-CG 4.35Å; I216-E247 WeakPolarHBondContact CD1-OE2 3.35Å; I216-E247 HydrophobicContact CG2-CB 3.96Å; I216-E247 HydrophobicContact CG2-CG 3.89Å; I216-A250 HydrophobicContact CG2-CB 3.79Å; I216-R251 HydrophobicContact CG2-CG 4.25Å
217	H	81.1	Confident	67	Low	48 Å²	48	112.5 Å²	112.5	22%	0.222	55%	0.552	C	S	.	*			trans	-96.2	80.5	-178.1	-66.1	76.9	0	0	0	110.1	V202 R215 Y219	V202-H217 HydrophobicContact CB-CB 3.99Å; V202-H217 PolarHBondContact N-O 2.91Å; R215-H217 PolarHBondContact O-CE1 2.92Å; R215-H217 PolarHBondContact O-N 3.32Å; R215-H217 PolarHBondContact O-ND1 3.48Å; H217-Y219 HydrophobicContact CB-CE2 4.07Å; H217-Y219 PolarHBondContact CD2-OH 3.28Å
218	V	86.1	Confident	68.7	Low	17 Å²	17	104.4 Å²	104.4	10%	0.103	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.3	174.6	172.5	0	0	0	0	110.6	Y200 I216 R243 A246 E247 A250	Y200-V218 WeakPolarHBondContact O-CA 3.17Å; I216-V218 HydrophobicContact CG2-CG2 4.21Å; I216-V218 PolarHBondContact O-N 2.99Å; V218-R243 HydrophobicContact CG1-CG 4.31Å; V218-A246 HydrophobicContact CG1-CB 3.83Å; V218-A246 VanDerWaalsContact CG2-C 3.41Å; V218-A246 HydrophobicContact CG2-CB 3.82Å; V218-A246 WeakPolarHBondContact CG2-O 3.27Å; V218-E247 HydrophobicContact CB-CG 4.09Å; V218-E247 HydrophobicContact CG1-CG 4.44Å; V218-E247 HydrophobicContact CG2-CB 4.26Å; V218-E247 HydrophobicContact CG2-CG 3.56Å; V218-A250 HydrophobicContact CG2-CB 3.97Å
219	Y	87.4	Confident	71.1	Confident	55 Å²	55	98.8 Å²	98.8	22%	0.216	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.2	-175	-55	-88.1	0	0	0	110.7	Y200 V202 H217 E224 A225 A228	Y200-Y219 WeakPolarHBondContact CD2-O 3.23Å; Y200-Y219 PolarHBondContact N-O 2.92Å; Y200-Y219 PolarHBondContact O-N 3.33Å; V202-Y219 HydrophobicContact CG2-CD2 4.21Å; V202-Y219 HydrophobicContact CG2-CE2 4.05Å; H217-Y219 HydrophobicContact CB-CE2 4.07Å; H217-Y219 PolarHBondContact CD2-OH 3.28Å; Y219-E224 HydrophobicContact CD1-CB 3.65Å; Y219-E224 HydrophobicContact CE1-CB 4.28Å; Y219-E224 HydrophobicContact CG-CB 4.18Å; Y219-A225 HydrophobicContact CD2-CB 3.87Å; Y219-A225 HydrophobicContact CG-CB 4.21Å; Y219-A228 HydrophobicContact CE2-CB 3.59Å; Y219-A228 WeakPolarHBondContact OH-CB 3.12Å
220	E	85.8	Confident	73.3	Confident	123 Å²	123	100.9 Å²	100.9	58%	0.575	49%	0.486	S	S	*	.	S	Bend	trans	-87.6	-17.4	171	-74.6	152.8	-144.3	0	0	111.6	Y199 R243	Y199-E220 HydrophobicContact CD1-CG 3.59Å; Y199-E220 HydrophobicContact CE1-CG 3.5Å; E220-R243 IonicContact OE1-NH1 2.82Å; E220-R243 PolarHBondContact OE1-NH1 3Å
221	N	83.8	Confident	75	Confident	63 Å²	63	102.7 Å²	102.7	34%	0.337	49%	0.486	S	S	.	.	S	Bend	trans	-106.2	120.2	178.1	-176.6	-3.6	0	0	0	111.6	K223 E224 A225	N221-K223 PolarHBondContact O-N 3.38Å; N221-K223 VanDerWaalsContact O-N 3.12Å; N221-K223 WeakPolarHBondContact OD1-CB 3.12Å; N221-K223 PolarHBondContact OD1-N 3.33Å; N221-E224 HydrophobicContact CB-CB 4.37Å; N221-E224 HydrophobicContact CB-CG 4.2Å; N221-E224 VanDerWaalsContact CB-OE1 3.29Å; N221-E224 WeakPolarHBondContact CB-OE1 3.42Å; N221-E224 PolarHBondContact ND2-OE1 2.94Å; N221-E224 PolarHBondContact O-N 3.13Å; N221-E224 VanDerWaalsContact O-N 3.11Å; N221-A225 PolarHBondContact O-N 3.05Å; N221-A225 VanDerWaalsContact O-N 3.16Å
222	K	85.8	Confident	76.6	Confident	115 Å²	115	100 Å²	100	50%	0.5	46%	0.458	S	S	.	.	H	α-helix	trans	-54.6	-31.6	177.3	-168.9	177.2	178.8	-179.7	0	113.4	Y200 L226	Y200-K222 HydrophobicContact CD1-CG 4.46Å; Y200-K222 HydrophobicContact CD2-CB 4.29Å; Y200-K222 HydrophobicContact CE1-CB 4.12Å; Y200-K222 HydrophobicContact CE1-CD 4.31Å; Y200-K222 HydrophobicContact CE1-CG 3.99Å; Y200-K222 HydrophobicContact CE2-CB 3.75Å; K222-L226 HydrophobicContact CG-CD1 4.21Å; K222-L226 WeakPolarHBondContact O-CB 3.49Å; K222-L226 VanDerWaalsContact O-CG 3.3Å; K222-L226 WeakPolarHBondContact O-CG 3.44Å; K222-L226 PolarHBondContact O-N 3.05Å; K222-L226 VanDerWaalsContact O-N 3.09Å
223	K	85.9	Confident	78.1	Confident	167 Å²	167	98 Å²	98	73%	0.726	46%	0.455	S	S	*	.	H	α-helix	trans	-68.8	-41.8	179.6	-66.8	-180	177.8	177.6	0	111.8	N221 L226 Q227	N221-K223 PolarHBondContact O-N 3.38Å; N221-K223 VanDerWaalsContact O-N 3.12Å; N221-K223 WeakPolarHBondContact OD1-CB 3.12Å; N221-K223 PolarHBondContact OD1-N 3.33Å; K223-L226 PolarHBondContact O-N 3.31Å; K223-Q227 WeakPolarHBondContact O-CB 3.29Å; K223-Q227 PolarHBondContact O-N 3.15Å
224	E	84.2	Confident	79.5	Confident	91 Å²	91	94.5 Å²	94.5	43%	0.425	45%	0.451	S	S	.	.	H	α-helix	trans	-69.2	-40.7	178.1	-69.3	155.8	-140.3	0	0	111.1	Y219 N221 L226 Q227 A228	Y219-E224 HydrophobicContact CD1-CB 3.65Å; Y219-E224 HydrophobicContact CE1-CB 4.28Å; Y219-E224 HydrophobicContact CG-CB 4.18Å; N221-E224 HydrophobicContact CB-CB 4.37Å; N221-E224 HydrophobicContact CB-CG 4.2Å; N221-E224 VanDerWaalsContact CB-OE1 3.29Å; N221-E224 WeakPolarHBondContact CB-OE1 3.42Å; N221-E224 PolarHBondContact ND2-OE1 2.94Å; N221-E224 PolarHBondContact O-N 3.13Å; N221-E224 VanDerWaalsContact O-N 3.11Å; E224-L226 PolarHBondContact O-N 3.04Å; E224-Q227 WeakPolarHBondContact O-CB 3.5Å; E224-Q227 PolarHBondContact O-N 3.04Å; E224-A228 PolarHBondContact O-N 3.42Å
225	A	84.8	Confident	81.1	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-58.6	-44.9	172.5	0	0	0	0	0	112.4	Y200 V202 Y219 N221 Q227 A228 V229	Y200-A225 HydrophobicContact CG-CB 4.19Å; V202-A225 HydrophobicContact CG2-CB 4.26Å; Y219-A225 HydrophobicContact CD2-CB 3.87Å; Y219-A225 HydrophobicContact CG-CB 4.21Å; N221-A225 PolarHBondContact O-N 3.05Å; N221-A225 VanDerWaalsContact O-N 3.16Å; A225-Q227 VanDerWaalsContact C-N 3.35Å; A225-A228 WeakPolarHBondContact O-CB 3.37Å; A225-A228 PolarHBondContact O-N 2.99Å; A225-V229 WeakPolarHBondContact O-CG2 3.47Å; A225-V229 PolarHBondContact O-N 2.76Å
226	L	83	Confident	81.9	Confident	75 Å²	75	85 Å²	85	39%	0.393	41%	0.41	S	S	.	.	H	α-helix	trans	-68.5	-32.4	176.8	-71.5	170.6	0	0	0	112.6	K222 K223 E224 V229 K230 F237	K222-L226 HydrophobicContact CG-CD1 4.21Å; K222-L226 WeakPolarHBondContact O-CB 3.49Å; K222-L226 VanDerWaalsContact O-CG 3.3Å; K222-L226 WeakPolarHBondContact O-CG 3.44Å; K222-L226 PolarHBondContact O-N 3.05Å; K222-L226 VanDerWaalsContact O-N 3.09Å; K223-L226 PolarHBondContact O-N 3.31Å; E224-L226 PolarHBondContact O-N 3.04Å; L226-V229 PolarHBondContact O-N 3.31Å; L226-K230 WeakPolarHBondContact O-CB 3.18Å; L226-K230 PolarHBondContact O-N 3.09Å; L226-F237 HydrophobicContact CD2-CE1 3.99Å; L226-F237 HydrophobicContact CD2-CE2 4.26Å; L226-F237 HydrophobicContact CD2-CZ 3.84Å
227	Q	85.4	Confident	82.5	Confident	132 Å²	132	87 Å²	87	62%	0.617	42%	0.416	S	S	*	.	H	α-helix	trans	-65.9	-43.3	171.3	-173.9	173.4	-3	0	0	111.1	K223 E224 A225 V229 K230 M231	K223-Q227 WeakPolarHBondContact O-CB 3.29Å; K223-Q227 PolarHBondContact O-N 3.15Å; E224-Q227 WeakPolarHBondContact O-CB 3.5Å; E224-Q227 PolarHBondContact O-N 3.04Å; A225-Q227 VanDerWaalsContact C-N 3.35Å; Q227-V229 PolarHBondContact O-N 2.94Å; Q227-K230 PolarHBondContact O-N 3.11Å; Q227-M231 VanDerWaalsContact O-CG 3.29Å; Q227-M231 WeakPolarHBondContact O-CG 3.37Å; Q227-M231 PolarHBondContact O-N 2.91Å
228	A	81.8	Confident	82.8	Confident	10 Å²	10	88.8 Å²	88.8	8%	0.083	42%	0.423	C	S	.	.	H	α-helix	trans	-61	-42.6	174.1	0	0	0	0	0	111.9	V202 Y219 E224 A225 K230 M231 I232	V202-A228 HydrophobicContact CG2-CB 4.44Å; Y219-A228 HydrophobicContact CE2-CB 3.59Å; Y219-A228 WeakPolarHBondContact OH-CB 3.12Å; E224-A228 PolarHBondContact O-N 3.42Å; A225-A228 WeakPolarHBondContact O-CB 3.37Å; A225-A228 PolarHBondContact O-N 2.99Å; A228-K230 VanDerWaalsContact C-N 3.34Å; A228-K230 PolarHBondContact O-N 3.45Å; A228-M231 PolarHBondContact O-N 3.11Å; A228-I232 WeakPolarHBondContact O-CB 3.32Å; A228-I232 WeakPolarHBondContact O-CG1 3.47Å; A228-I232 PolarHBondContact O-N 3.22Å
229	V	83.8	Confident	82.8	Confident	34 Å²	34	90 Å²	90	21%	0.206	44%	0.435	C	S	.	.	H	α-helix	trans	-61.7	-39.5	173.7	172.7	0	0	0	0	112.1	V202 A225 L226 Q227 M231 I232 S235 F237	V202-V229 HydrophobicContact CG1-CG2 3.8Å; V202-V229 HydrophobicContact CG2-CG2 3.94Å; A225-V229 WeakPolarHBondContact O-CG2 3.47Å; A225-V229 PolarHBondContact O-N 2.76Å; L226-V229 PolarHBondContact O-N 3.31Å; Q227-V229 PolarHBondContact O-N 2.94Å; V229-M231 VanDerWaalsContact C-N 3.31Å; V229-M231 PolarHBondContact O-N 2.91Å; V229-I232 CarbonylContact O-C 3.6Å; V229-I232 PolarHBondContact O-N 2.93Å; V229-I232 VanDerWaalsContact O-O 3.13Å; V229-S235 WeakPolarHBondContact CA-OG 3.16Å; V229-F237 HydrophobicContact CG2-CB 3.71Å; V229-F237 HydrophobicContact CG2-CD1 3.98Å; V229-F237 HydrophobicContact CG2-CG 4.09Å
230	K	84.8	Confident	82.8	Confident	178 Å²	178	89 Å²	89	77%	0.774	43%	0.432	S	S	*	.	H	α-helix	trans	-65.6	-33.2	176.5	-171.6	177.7	178.9	-177.2	0	112.4	L226 Q227 A228	L226-K230 WeakPolarHBondContact O-CB 3.18Å; L226-K230 PolarHBondContact O-N 3.09Å; Q227-K230 PolarHBondContact O-N 3.11Å; A228-K230 VanDerWaalsContact C-N 3.34Å; A228-K230 PolarHBondContact O-N 3.45Å
231	M	78.9	Confident	82.8	Confident	152 Å²	152	87.4 Å²	87.4	75%	0.749	44%	0.435	S	S	*	.	H	α-helix	trans	-79.2	-41.2	176.7	-62.6	-68	-81.5	0	0	111.9	Q227 A228 V229 K233	Q227-M231 VanDerWaalsContact O-CG 3.29Å; Q227-M231 WeakPolarHBondContact O-CG 3.37Å; Q227-M231 PolarHBondContact O-N 2.91Å; A228-M231 PolarHBondContact O-N 3.11Å; V229-M231 VanDerWaalsContact C-N 3.31Å; V229-M231 PolarHBondContact O-N 2.91Å; M231-K233 PolarHBondContact O-N 2.69Å
232	I	80.2	Confident	82.9	Confident	43 Å²	43	86.7 Å²	86.7	22%	0.221	43%	0.433	C	S	.	.	S	Bend	trans	-95	79.1	-179	-51.5	169.9	0	0	0	108.9	P204 A228 V229 G234 S235	P204-I232 HydrophobicContact CB-CG2 4Å; P204-I232 HydrophobicContact CG-CG2 4.28Å; A228-I232 WeakPolarHBondContact O-CB 3.32Å; A228-I232 WeakPolarHBondContact O-CG1 3.47Å; A228-I232 PolarHBondContact O-N 3.22Å; V229-I232 CarbonylContact O-C 3.6Å; V229-I232 PolarHBondContact O-N 2.93Å; V229-I232 VanDerWaalsContact O-O 3.13Å; I232-G234 PolarHBondContact O-N 2.68Å; I232-S235 VanDerWaalsContact O-CB 3.24Å; I232-S235 WeakPolarHBondContact O-CB 3.44Å; I232-S235 PolarHBondContact O-N 3.07Å; I232-S235 PolarHBondContact O-OG 3.01Å
233	K	72	Confident	82.9	Confident	194 Å²	194	85.1 Å²	85.1	84%	0.843	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	132	179.4	-70.1	-178.1	177.7	178	0	111.4	M231 S235	M231-K233 PolarHBondContact O-N 2.69Å; K233-S235 VanDerWaalsContact C-N 3.32Å
234	G	70.2	Confident	82.8	Confident	62 Å²	62	82.7 Å²	82.7	64%	0.639	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	-8.8	-178.6	0	0	0	0	0	115.3	V205 I232	V205-G234 WeakPolarHBondContact CG2-O 3.29Å; I232-G234 PolarHBondContact O-N 2.68Å
235	S	81.2	Confident	82.7	Confident	14 Å²	14	81 Å²	81	10%	0.098	41%	0.408	C	S	.	.			trans	-63.4	146	179.1	58.9	0	0	0	0	113.6	C203 V229 I232 K233	C203-S235 CarbonylContact O-C 3.55Å; C203-S235 WeakPolarHBondContact O-CA 3.34Å; C203-S235 WeakPolarHBondContact O-CB 3.2Å; V229-S235 WeakPolarHBondContact CA-OG 3.16Å; I232-S235 VanDerWaalsContact O-CB 3.24Å; I232-S235 WeakPolarHBondContact O-CB 3.44Å; I232-S235 PolarHBondContact O-N 3.07Å; I232-S235 PolarHBondContact O-OG 3.01Å; K233-S235 VanDerWaalsContact C-N 3.32Å
236	R	79.9	Confident	82.8	Confident	159 Å²	159	81 Å²	81	60%	0.6	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	139.6	175	-62.2	-179.8	-71.5	-172.8	-2.1	108.9	V202 C203 F249	V202-R236 WeakPolarHBondContact CA-O 3.31Å; C203-R236 HydrophobicContact CB-CB 4.49Å; C203-R236 PolarHBondContact N-O 3.07Å; C203-R236 PolarHBondContact O-N 3.42Å; R236-F249 HydrophobicContact CB-CZ 4.11Å; R236-F249 WeakPolarHBondContact O-CE1 3.46Å
237	F	86.5	Confident	82.8	Confident	95 Å²	95	79.6 Å²	79.6	42%	0.417	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.3	174.2	82.4	-83.3	0	0	0	112.4	G201 V202 L226 V229	G201-F237 VanDerWaalsContact O-CA 3.26Å; G201-F237 WeakPolarHBondContact O-CA 3.41Å; V202-F237 HydrophobicContact CG2-CB 4.14Å; L226-F237 HydrophobicContact CD2-CE1 3.99Å; L226-F237 HydrophobicContact CD2-CE2 4.26Å; L226-F237 HydrophobicContact CD2-CZ 3.84Å; V229-F237 HydrophobicContact CG2-CB 3.71Å; V229-F237 HydrophobicContact CG2-CD1 3.98Å; V229-F237 HydrophobicContact CG2-CG 4.09Å
238	K	86.9	Confident	82.7	Confident	85 Å²	85	78.3 Å²	78.3	37%	0.37	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	149.7	175.9	-174.4	170.5	-179.3	-177.8	0	110.6	Y200 G201 F240 F249 S259	Y200-K238 WeakPolarHBondContact CA-O 3.42Å; G201-K238 PolarHBondContact N-O 3.29Å; G201-K238 PolarHBondContact O-N 3.38Å; K238-F240 HydrophobicContact CB-CE2 3.62Å; K238-F240 HydrophobicContact CB-CZ 3.83Å; K238-F240 HydrophobicContact CD-CE1 4.1Å; K238-F240 HydrophobicContact CD-CE2 4.29Å; K238-F240 HydrophobicContact CD-CZ 3.67Å; K238-F240 HydrophobicContact CG-CD2 4.49Å; K238-F240 HydrophobicContact CG-CE1 4.36Å; K238-F240 HydrophobicContact CG-CE2 3.8Å; K238-F240 HydrophobicContact CG-CZ 3.72Å; K238-F240 WeakPolarHBondContact O-CD2 3.48Å; K238-F240 WeakPolarHBondContact O-CE2 3.49Å; K238-F249 HydrophobicContact CB-CD1 4.33Å; K238-F249 HydrophobicContact CB-CD2 4.42Å; K238-F249 HydrophobicContact CB-CE1 3.93Å; K238-F249 HydrophobicContact CB-CE2 4.01Å; K238-F249 HydrophobicContact CB-CZ 3.74Å; K238-F249 HydrophobicContact CD-CE2 4.45Å; K238-S259 PolarHBondContact NZ-OG 3.45Å
239	A	87.4	Confident	82.8	Confident	43 Å²	43	79.9 Å²	79.9	36%	0.355	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	143.5	175.6	0	0	0	0	0	110.9	Y199 Y200	Y199-A239 CarbonylContact O-C 3.56Å; Y199-A239 WeakPolarHBondContact O-CA 3.48Å; Y200-A239 HydrophobicContact CD1-CB 3.66Å; Y200-A239 HydrophobicContact CE1-CB 3.54Å
240	F	86.7	Confident	82.8	Confident	35 Å²	35	78.8 Å²	78.8	15%	0.154	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	150.3	-176.8	-59.1	-94.9	0	0	0	110.2	L198 Y199 K238 T242 D245 A246 F249	L198-F240 CarbonylContact C-O 3.54Å; L198-F240 WeakPolarHBondContact CA-O 3.39Å; Y199-F240 PolarHBondContact N-O 2.78Å; Y199-F240 PolarHBondContact O-N 2.88Å; K238-F240 HydrophobicContact CB-CE2 3.62Å; K238-F240 HydrophobicContact CB-CZ 3.83Å; K238-F240 HydrophobicContact CD-CE1 4.1Å; K238-F240 HydrophobicContact CD-CE2 4.29Å; K238-F240 HydrophobicContact CD-CZ 3.67Å; K238-F240 HydrophobicContact CG-CD2 4.49Å; K238-F240 HydrophobicContact CG-CE1 4.36Å; K238-F240 HydrophobicContact CG-CE2 3.8Å; K238-F240 HydrophobicContact CG-CZ 3.72Å; K238-F240 WeakPolarHBondContact O-CD2 3.48Å; K238-F240 WeakPolarHBondContact O-CE2 3.49Å; F240-T242 WeakPolarHBondContact CB-O 3.42Å; F240-T242 PolarHBondContact O-N 2.77Å; F240-D245 HydrophobicContact CB-CB 4.5Å; F240-D245 HydrophobicContact CD1-CB 3.71Å; F240-D245 HydrophobicContact CE1-CB 4.25Å; F240-D245 HydrophobicContact CG-CB 4.28Å; F240-A246 HydrophobicContact CB-CB 4.23Å; F240-A246 VanDerWaalsContact CD2-CA 3.47Å; F240-A246 HydrophobicContact CD2-CB 3.62Å; F240-A246 HydrophobicContact CE2-CB 4.31Å; F240-A246 HydrophobicContact CG-CB 4.15Å; F240-F249 HydrophobicContact CE1-CB 4.38Å; F240-F249 HydrophobicContact CE2-CB 3.72Å; F240-F249 AromaticContact CE2-CD1 3.99Å; F240-F249 HydrophobicContact CE2-CD1 3.99Å; F240-F249 HydrophobicContact CE2-CD2 4.41Å; F240-F249 AromaticContact CE2-CG 3.79Å; F240-F249 HydrophobicContact CE2-CG 3.79Å; F240-F249 HydrophobicContact CZ-CB 3.43Å; F240-F249 VanDerWaalsContact CZ-CB 3.43Å; F240-F249 HydrophobicContact CZ-CD1 4.22Å; F240-F249 AromaticContact CZ-CD2 3.83Å; F240-F249 HydrophobicContact CZ-CD2 3.83Å; F240-F249 AromaticContact CZ-CG 3.56Å; F240-F249 HydrophobicContact CZ-CG 3.56Å
241	S	85.3	Confident	82.5	Confident	89 Å²	89	77 Å²	77	62%	0.622	38%	0.38	S	S	*	.	S	Bend	trans	-78.3	-7.6	173.2	47.2	0	0	0	0	113.9
242	T	86	Confident	81.9	Confident	48 Å²	48	72 Å²	72	29%	0.294	37%	0.368	S	S	.	.	S	Bend	trans	-133.1	137.7	-170.4	33.5	0	0	0	0	108.3	F240 E244 D245 A246	F240-T242 WeakPolarHBondContact CB-O 3.42Å; F240-T242 PolarHBondContact O-N 2.77Å; T242-E244 VanDerWaalsContact C-N 3.33Å; T242-D245 WeakPolarHBondContact CB-OD2 3.4Å; T242-D245 PolarHBondContact OG1-OD2 3.18Å; T242-A246 PolarHBondContact O-N 3.11Å
243	R	85.2	Confident	80.9	Confident	82 Å²	82	75.9 Å²	75.9	31%	0.309	39%	0.388	S	S	.	.	H	α-helix	trans	-71.7	-36.7	-177.3	-173.7	176.6	169	99	19.3	110.8	Y199 V218 E220 D245 A246 E247	Y199-R243 HydrophobicContact CD1-CB 3.74Å; Y199-R243 HydrophobicContact CD1-CG 3.77Å; Y199-R243 HydrophobicContact CD2-CB 4.05Å; Y199-R243 HydrophobicContact CE1-CB 3.79Å; Y199-R243 HydrophobicContact CE1-CG 3.98Å; Y199-R243 HydrophobicContact CE2-CB 4.09Å; Y199-R243 HydrophobicContact CG-CB 3.88Å; Y199-R243 HydrophobicContact CG-CG 4.26Å; V218-R243 HydrophobicContact CG1-CG 4.31Å; E220-R243 IonicContact OE1-NH1 2.82Å; E220-R243 PolarHBondContact OE1-NH1 3Å; R243-D245 VanDerWaalsContact C-N 3.32Å; R243-D245 PolarHBondContact O-N 3Å; R243-A246 WeakPolarHBondContact O-CB 3.41Å; R243-A246 PolarHBondContact O-N 2.74Å; R243-E247 HydrophobicContact CG-CG 4.47Å; R243-E247 IonicContact CZ-OE1 3.81Å; R243-E247 VanDerWaalsContact CZ-OE1 3.31Å; R243-E247 IonicContact NE-OE1 3.93Å; R243-E247 PolarHBondContact NE-OE1 2.82Å; R243-E247 IonicContact NH2-OE1 2.7Å; R243-E247 PolarHBondContact NH2-OE1 3.42Å; R243-E247 WeakPolarHBondContact O-CG 3.23Å; R243-E247 PolarHBondContact O-N 2.9Å
244	E	83.9	Confident	79.7	Confident	115 Å²	115	71.1 Å²	71.1	54%	0.537	38%	0.378	S	S	.	.	H	α-helix	trans	-61.9	-39.1	-176.5	-58.4	67.3	-147.3	0	0	111.2	T242 E247 K248	T242-E244 VanDerWaalsContact C-N 3.33Å; E244-E247 PolarHBondContact O-N 3.19Å; E244-K248 VanDerWaalsContact O-CG 3.3Å; E244-K248 WeakPolarHBondContact O-CG 3.36Å; E244-K248 PolarHBondContact O-N 3.14Å
245	D	82.8	Confident	78	Confident	55 Å²	55	75 Å²	75	29%	0.294	38%	0.384	S	S	.	.	H	α-helix	trans	-79.4	-30.7	179.2	-60.2	-48.8	0	0	0	112.3	F240 T242 R243 E247 K248 F249	F240-D245 HydrophobicContact CB-CB 4.5Å; F240-D245 HydrophobicContact CD1-CB 3.71Å; F240-D245 HydrophobicContact CE1-CB 4.25Å; F240-D245 HydrophobicContact CG-CB 4.28Å; T242-D245 WeakPolarHBondContact CB-OD2 3.4Å; T242-D245 PolarHBondContact OG1-OD2 3.18Å; R243-D245 VanDerWaalsContact C-N 3.32Å; R243-D245 PolarHBondContact O-N 3Å; D245-E247 VanDerWaalsContact C-N 3.32Å; D245-K248 WeakPolarHBondContact OD1-CE 3.17Å; D245-K248 IonicContact OD1-NZ 2.78Å; D245-K248 PolarHBondContact OD1-NZ 3.11Å; D245-F249 WeakPolarHBondContact O-CB 3.44Å; D245-F249 PolarHBondContact O-N 3.26Å
246	A	86.2	Confident	75.7	Confident	0 Å²	0	85.2 Å²	85.2	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-63.6	-38.5	166.5	0	0	0	0	0	111.6	V218 F240 T242 R243 F249 A250	V218-A246 HydrophobicContact CG1-CB 3.83Å; V218-A246 VanDerWaalsContact CG2-C 3.41Å; V218-A246 HydrophobicContact CG2-CB 3.82Å; V218-A246 WeakPolarHBondContact CG2-O 3.27Å; F240-A246 HydrophobicContact CB-CB 4.23Å; F240-A246 VanDerWaalsContact CD2-CA 3.47Å; F240-A246 HydrophobicContact CD2-CB 3.62Å; F240-A246 HydrophobicContact CE2-CB 4.31Å; F240-A246 HydrophobicContact CG-CB 4.15Å; T242-A246 PolarHBondContact O-N 3.11Å; R243-A246 WeakPolarHBondContact O-CB 3.41Å; R243-A246 PolarHBondContact O-N 2.74Å; A246-F249 PolarHBondContact O-N 3.39Å; A246-A250 WeakPolarHBondContact O-CB 3.37Å; A246-A250 PolarHBondContact O-N 3.42Å
247	E	84.8	Confident	73.4	Confident	47 Å²	47	86.4 Å²	86.4	22%	0.22	43%	0.432	C	S	.	.	H	α-helix	trans	-72.2	-39.9	178.1	-71.9	-170.1	-170.2	0	0	112.3	I216 V218 R243 E244 D245 A250 R251	I216-E247 HydrophobicContact CD1-CG 4.35Å; I216-E247 WeakPolarHBondContact CD1-OE2 3.35Å; I216-E247 HydrophobicContact CG2-CB 3.96Å; I216-E247 HydrophobicContact CG2-CG 3.89Å; V218-E247 HydrophobicContact CB-CG 4.09Å; V218-E247 HydrophobicContact CG1-CG 4.44Å; V218-E247 HydrophobicContact CG2-CB 4.26Å; V218-E247 HydrophobicContact CG2-CG 3.56Å; R243-E247 HydrophobicContact CG-CG 4.47Å; R243-E247 IonicContact CZ-OE1 3.81Å; R243-E247 VanDerWaalsContact CZ-OE1 3.31Å; R243-E247 IonicContact NE-OE1 3.93Å; R243-E247 PolarHBondContact NE-OE1 2.82Å; R243-E247 IonicContact NH2-OE1 2.7Å; R243-E247 PolarHBondContact NH2-OE1 3.42Å; R243-E247 WeakPolarHBondContact O-CG 3.23Å; R243-E247 PolarHBondContact O-N 2.9Å; E244-E247 PolarHBondContact O-N 3.19Å; D245-E247 VanDerWaalsContact C-N 3.32Å; E247-A250 PolarHBondContact O-N 3.45Å; E247-R251 WeakPolarHBondContact O-CB 3.28Å; E247-R251 VanDerWaalsContact O-CG 3.22Å; E247-R251 WeakPolarHBondContact O-CG 3.17Å; E247-R251 PolarHBondContact O-N 3.47Å
248	K	83.1	Confident	70.8	Confident	104 Å²	104	87 Å²	87	45%	0.452	45%	0.445	S	S	.	.	H	α-helix	trans	-57.1	-48.1	169.4	-70.9	167.6	-157.5	165.4	0	111.6	E244 D245 R251 G252 I253	E244-K248 VanDerWaalsContact O-CG 3.3Å; E244-K248 WeakPolarHBondContact O-CG 3.36Å; E244-K248 PolarHBondContact O-N 3.14Å; D245-K248 WeakPolarHBondContact OD1-CE 3.17Å; D245-K248 IonicContact OD1-NZ 2.78Å; D245-K248 PolarHBondContact OD1-NZ 3.11Å; K248-R251 CarbonylContact O-C 3.57Å; K248-R251 PolarHBondContact O-N 2.84Å; K248-G252 PolarHBondContact O-N 2.95Å; K248-I253 PolarHBondContact O-N 3.36Å
249	F	82.8	Confident	67.9	Low	43 Å²	43	86.6 Å²	86.6	19%	0.189	45%	0.453	C	S	.	.	H	α-helix	trans	-62.7	-44.4	178.4	177.5	-92.6	0	0	0	112.3	G201 C203 R236 K238 F240 D245 A246 R251 G252	G201-F249 WeakPolarHBondContact O-CE1 3.27Å; C203-F249 HydrophobicContact CB-CD1 4.33Å; C203-F249 HydrophobicContact CB-CE1 3.98Å; C203-F249 HydrophobicContact CB-CZ 4.35Å; C203-F249 WeakPolarHBondContact CB-O 3.41Å; R236-F249 HydrophobicContact CB-CZ 4.11Å; R236-F249 WeakPolarHBondContact O-CE1 3.46Å; K238-F249 HydrophobicContact CB-CD1 4.33Å; K238-F249 HydrophobicContact CB-CD2 4.42Å; K238-F249 HydrophobicContact CB-CE1 3.93Å; K238-F249 HydrophobicContact CB-CE2 4.01Å; K238-F249 HydrophobicContact CB-CZ 3.74Å; K238-F249 HydrophobicContact CD-CE2 4.45Å; F240-F249 HydrophobicContact CE1-CB 4.38Å; F240-F249 HydrophobicContact CE2-CB 3.72Å; F240-F249 AromaticContact CE2-CD1 3.99Å; F240-F249 HydrophobicContact CE2-CD1 3.99Å; F240-F249 HydrophobicContact CE2-CD2 4.41Å; F240-F249 AromaticContact CE2-CG 3.79Å; F240-F249 HydrophobicContact CE2-CG 3.79Å; F240-F249 HydrophobicContact CZ-CB 3.43Å; F240-F249 VanDerWaalsContact CZ-CB 3.43Å; F240-F249 HydrophobicContact CZ-CD1 4.22Å; F240-F249 AromaticContact CZ-CD2 3.83Å; F240-F249 HydrophobicContact CZ-CD2 3.83Å; F240-F249 AromaticContact CZ-CG 3.56Å; F240-F249 HydrophobicContact CZ-CG 3.56Å; D245-F249 WeakPolarHBondContact O-CB 3.44Å; D245-F249 PolarHBondContact O-N 3.26Å; A246-F249 PolarHBondContact O-N 3.39Å; F249-R251 PolarHBondContact O-N 3.41Å; F249-G252 PolarHBondContact O-N 3.24Å
250	A	83.5	Confident	65.4	Low	11 Å²	11	90.8 Å²	90.8	9%	0.091	48%	0.477	C	S	.	.	H	α-helix	trans	-65.6	-25.1	176.7	0	0	0	0	0	113.3	V202 I216 V218 A246 E247	V202-A250 WeakPolarHBondContact O-CA 3.46Å; V202-A250 WeakPolarHBondContact O-CB 3.42Å; I216-A250 HydrophobicContact CG2-CB 3.79Å; V218-A250 HydrophobicContact CG2-CB 3.97Å; A246-A250 WeakPolarHBondContact O-CB 3.37Å; A246-A250 PolarHBondContact O-N 3.42Å; E247-A250 PolarHBondContact O-N 3.45Å
251	R	78.2	Confident	62.6	Low	140 Å²	140	94.5 Å²	94.5	53%	0.528	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-6.7	171.8	-70.1	170.5	-179.3	-85.5	11.5	114	I216 E247 K248 F249 I253	I216-R251 HydrophobicContact CG2-CG 4.25Å; E247-R251 WeakPolarHBondContact O-CB 3.28Å; E247-R251 VanDerWaalsContact O-CG 3.22Å; E247-R251 WeakPolarHBondContact O-CG 3.17Å; E247-R251 PolarHBondContact O-N 3.47Å; K248-R251 CarbonylContact O-C 3.57Å; K248-R251 PolarHBondContact O-N 2.84Å; F249-R251 PolarHBondContact O-N 3.41Å; R251-I253 VanDerWaalsContact C-N 3.25Å; R251-I253 HydrophobicContact CB-CD1 4.31Å; R251-I253 HydrophobicContact CB-CG1 4.35Å; R251-I253 PolarHBondContact O-N 3.29Å
252	G	68	Low	59.9	Low	48 Å²	48	101.6 Å²	101.6	50%	0.495	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	3.1	-177.3	0	0	0	0	0	115.5	K248 F249 C254	K248-G252 PolarHBondContact O-N 2.95Å; F249-G252 PolarHBondContact O-N 3.24Å; G252-C254 PolarHBondContact O-N 3.38Å
253	I	58.8	Low	57.2	Low	124 Å²	124	105.7 Å²	105.7	64%	0.636	55%	0.548	S	S	*	.			trans	-94.2	90	-176.7	-53.7	169.1	0	0	0	108.7	K248 R251	K248-I253 PolarHBondContact O-N 3.36Å; R251-I253 VanDerWaalsContact C-N 3.25Å; R251-I253 HydrophobicContact CB-CD1 4.31Å; R251-I253 HydrophobicContact CB-CG1 4.35Å; R251-I253 PolarHBondContact O-N 3.29Å
254	C	45.4	Very low	54.6	Low	95 Å²	95	106.7 Å²	106.7	64%	0.642	57%	0.568	S	S	*	*			trans	-158	113	173.1	-163.6	0	0	0	0	112	G252	G252-C254 PolarHBondContact O-N 3.38Å
255	D	34.9	Very low	52	Low	144 Å²	144	109.3 Å²	109.3	77%	0.77	58%	0.584	S	S	*	*			trans	-67.5	159.3	170.5	-67.3	-64.2	0	0	0	112.4	F257	D255-F257 PolarHBondContact O-N 3.24Å
256	Y	32.7	Very low	49.7	Very low	228 Å²	228	111.4 Å²	111.4	89%	0.894	60%	0.601	S	S	*	*			trans	-79	83	-155.6	-158.1	-93.8	0	0	0	114.5	P258	Y256-P258 WeakPolarHBondContact O-CD 3.34Å
257	F	31.4	Very low	47	Very low	184 Å²	184	120 Å²	120	81%	0.807	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-92.1	116.2	169.1	-81.4	-82.8	0	0	0	112.7	D255 S259	D255-F257 PolarHBondContact O-N 3.24Å; F257-S259 PolarHBondContact O-N 3.36Å
258	P	33.6	Very low	44.3	Very low	107 Å²	107	122.6 Å²	122.6	70%	0.695	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-64.7	131.9	174.2	-20.6	33.5	0	0	0	111.9	Y256	Y256-P258 WeakPolarHBondContact O-CD 3.34Å
259	S	25.6	Very low	42.2	Very low	77 Å²	77	122.7 Å²	122.7	54%	0.538	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-82.9	130.9	175.6	-61.1	0	0	0	0	111.2	K238 F257	K238-S259 PolarHBondContact NZ-OG 3.45Å; F257-S259 PolarHBondContact O-N 3.36Å
260	P	35.3	Very low	39.5	Very low	131 Å²	131	126.8 Å²	126.8	85%	0.851	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-88.1	116.4	-169.5	32.5	-34.4	0	0	0	113.2
261	S	26.3	Very low	36.8	Very low	113 Å²	113	136 Å²	136	79%	0.79	75%	0.746	S	S	*	*			trans	-158.1	59.5	170.3	70.1	0	0	0	0	115.5
262	R	30.3	Very low	34.3	Very low	237 Å²	237	135.5 Å²	135.5	89%	0.894	76%	0.759	S	S	*	*	S	Bend	trans	-165.4	143.9	149.6	-110.7	169.9	-173.8	-167.7	0.9	110.6
263	P	29.2	Very low	32.2	Very low	134 Å²	134	137.6 Å²	137.6	87%	0.87	77%	0.772	S	S	*	*			trans	-76.9	135.4	-177	30.5	-34.1	0	0	0	111.9
264	S	30.5	Very low	31.1	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	77%	0.774	S	S	*	*			trans	-141.9	107.8	175.9	57.1	0	0	0	0	110.6
265	L	28.4	Very low	30.1	Very low	169 Å²	169	138.8 Å²	138.8	89%	0.885	78%	0.778	S	S	*	*			trans	-151.3	154.9	171.2	-75.6	-178.7	0	0	0	109.3
266	P	35.3	Very low	29.7	Very low	99 Å²	99	141.7 Å²	141.7	64%	0.643	79%	0.785	S	S	*	*			cis	-128.8	158.8	-20.5	36	-20.9	0	0	0	113.8
267	L	29.8	Very low	29.2	Very low	182 Å²	182	135 Å²	135	95%	0.953	77%	0.771	S	S	*	*			trans	-120	133	149.3	-80	174.4	0	0	0	108
268	S	28.1	Very low	28.9	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	77%	0.773	S	S	*	*			trans	-165.7	167.4	-177.6	64.4	0	0	0	0	110.3
269	P	38	Very low	28.6	Very low	106 Å²	106	136 Å²	136	69%	0.688	78%	0.779	S	S	*	*			cis	-135.7	155.6	-47.8	36.2	-21.8	0	0	0	114.3
270	V	26.5	Very low	28.6	Very low	129 Å²	129	135.9 Å²	135.9	78%	0.782	79%	0.789	S	S	*	*			trans	33.9	120.4	140.8	-175.8	0	0	0	0	120.1
271	K	25.6	Very low	28.2	Very low	204 Å²	204	136.9 Å²	136.9	89%	0.887	79%	0.787	S	S	*	*				-163.5	160.5	126	-113.9	170.9	-176.4	177.9	0	114.2
272	T	25.7	Very low	28.4	Very low	130 Å²	130	139.4 Å²	139.4	80%	0.798	78%	0.784	S	S	*	*			trans	-143.4	173.1	-165.4	44.1	0	0	0	0	113.2
273	A	24.9	Very low	28.2	Very low	92 Å²	92	135.1 Å²	135.1	76%	0.76	78%	0.778	S	S	*	*			trans	80.3	165.3	161.2	0	0	0	0	0	117.1
274	P	35.6	Very low	28.2	Very low	106 Å²	106	131.8 Å²	131.8	69%	0.688	77%	0.769	S	S	*	*			cis	-138.6	164.1	3.8	42	-25.1	0	0	0	118.5
275	L	24.1	Very low	28.2	Very low	138 Å²	138	135.8 Å²	135.8	72%	0.723	78%	0.781	S	S	*	*			trans	63.6	153.9	148.7	-69.6	164.8	0	0	0	118.6
276	F	26.1	Very low	28	Very low	206 Å²	206	133.1 Å²	133.1	90%	0.904	78%	0.775	S	S	*	*			cis	-123.4	-176.6	36.3	-74.7	-94.1	0	0	0	115.8
277	S	23.8	Very low	27.7	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	79%	0.788	S	S	*	*			trans	-137.5	180	-167	-51.6	0	0	0	0	113
278	N	25.2	Very low	27.6	Very low	157 Å²	157	132.8 Å²	132.8	84%	0.84	78%	0.776	S	S	*	*			trans	87.3	141.5	169.6	-56.9	8.3	0	0	0	116
279	D	26.3	Very low	27.5	Very low	156 Å²	156	137.2 Å²	137.2	83%	0.834	79%	0.786	S	S	*	*			cis	-160.6	157.6	-19.3	-176.3	24.4	0	0	0	108.6
280	G	25.9	Very low	27.1	Very low	73 Å²	73	136.7 Å²	136.7	75%	0.753	78%	0.784	S	S	*	*			trans	161.8	107	-179.9	0	0	0	0	0	113.3
281	L	27.8	Very low	27.1	Very low	152 Å²	152	139.5 Å²	139.5	80%	0.796	79%	0.789	S	S	*	*			trans	-123.7	147.8	-164.1	169.8	63.1	0	0	0	112.6
282	K	28.5	Very low	27.3	Very low	167 Å²	167	136 Å²	136	73%	0.726	79%	0.785	S	S	*	*			trans	79.1	146.5	176.6	-74.2	172.4	173	-168.8	0	116.7
283	D	27.1	Very low	27.6	Very low	146 Å²	146	135.6 Å²	135.6	78%	0.781	78%	0.782	S	S	*	*			cis	-152.3	159.8	-1.4	-119.9	-36.5	0	0	0	110.5
284	G	28.4	Very low	28.2	Very low	65 Å²	65	138.2 Å²	138.2	67%	0.67	78%	0.783	S	S	*	*			trans	116.7	96.8	153.8	0	0	0	0	0	120.1
285	L	30.4	Very low	28.3	Very low	187 Å²	187	142.3 Å²	142.3	98%	0.979	79%	0.79	S	S	*	*			trans	71.9	152.1	151.8	-56.2	178.4	0	0	0	119.7
286	C	24.2	Very low	29.2	Very low	114 Å²	114	141.2 Å²	141.2	77%	0.77	78%	0.781	S	S	*	*			trans	-130.9	132.4	-172.1	171.8	0	0	0	0	110.5
287	L	29.3	Very low	30.3	Very low	174 Å²	174	140.9 Å²	140.9	91%	0.911	77%	0.774	S	S	*	*			trans	-132.7	137.3	153.2	-75.4	175.7	0	0	0	107.2	E289	L287-E289 PolarHBondContact O-N 2.84Å
288	S	27.5	Very low	31.8	Very low	99 Å²	99	140.8 Å²	140.8	69%	0.692	78%	0.778	S	S	*	*			trans	-80.2	119	-173.9	-165.5	0	0	0	0	110.8	S290	S288-S290 PolarHBondContact O-N 3.43Å; S288-S290 PolarHBondContact O-OG 2.79Å
289	E	27.2	Very low	33.8	Very low	194 Å²	194	134.6 Å²	134.6	91%	0.907	75%	0.745	S	S	*	*			trans	-55.1	136.5	155.2	-65.5	-173.9	136.5	0	0	108.3	L287	L287-E289 PolarHBondContact O-N 2.84Å
290	S	28.6	Very low	36.1	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	74%	0.744	S	S	*	*			trans	-134.1	125.9	-179.5	-61.2	0	0	0	0	107.1	S288 T292	S288-S290 PolarHBondContact O-N 3.43Å; S288-S290 PolarHBondContact O-OG 2.79Å; S290-T292 PolarHBondContact O-N 3.22Å
291	E	28.1	Very low	38.9	Very low	188 Å²	188	132.5 Å²	132.5	88%	0.879	72%	0.721	S	S	*	*			trans	-57	126.8	-170.1	-62.3	171.5	119	0	0	111.6	V293	E291-V293 VanDerWaalsContact C-N 3.3Å; E291-V293 PolarHBondContact O-N 2.67Å
292	T	28.6	Very low	41.7	Very low	131 Å²	131	133.6 Å²	133.6	80%	0.804	72%	0.719	S	S	*	*			trans	-73	83.3	179.8	51.3	0	0	0	0	110.6	S290 N294	S290-T292 PolarHBondContact O-N 3.22Å; T292-N294 PolarHBondContact O-N 2.67Å; T292-N294 VanDerWaalsContact O-N 3.15Å
293	V	31.2	Very low	44.5	Very low	120 Å²	120	130.3 Å²	130.3	73%	0.727	71%	0.71	S	S	*	*			trans	-61.8	112.9	167.2	175.5	0	0	0	0	108.5	E291 K295	E291-V293 VanDerWaalsContact C-N 3.3Å; E291-V293 PolarHBondContact O-N 2.67Å; V293-K295 PolarHBondContact O-N 2.96Å
294	N	37.5	Very low	47.4	Very low	147 Å²	147	124.6 Å²	124.6	79%	0.786	68%	0.68	S	S	*	*			trans	-58.3	99.5	177.7	-72.2	-16.1	0	0	0	111	T292 E296	T292-N294 PolarHBondContact O-N 2.67Å; T292-N294 VanDerWaalsContact O-N 3.15Å; N294-E296 PolarHBondContact O-N 2.9Å; N294-E296 VanDerWaalsContact O-N 3.09Å
295	K	38	Very low	50.2	Low	192 Å²	192	129 Å²	129	84%	0.835	68%	0.677	S	S	*	*			trans	-82.1	56	166.7	-71.1	-177.8	177.4	175.1	0	110.3	V293 R297	V293-K295 PolarHBondContact O-N 2.96Å; K295-R297 PolarHBondContact O-N 3.36Å
296	E	44.3	Very low	52.9	Low	116 Å²	116	123.1 Å²	123.1	54%	0.542	65%	0.649	S	S	.	*			trans	-63.2	106.4	172.7	-166.2	177.7	-123.3	0	0	107.9	N294 A298 R395	N294-E296 PolarHBondContact O-N 2.9Å; N294-E296 VanDerWaalsContact O-N 3.09Å; E296-A298 VanDerWaalsContact C-N 3.29Å; E296-A298 PolarHBondContact O-N 2.96Å; E296-R395 IonicContact OE1-CZ 2.88Å; E296-R395 IonicContact OE1-NH1 3.31Å; E296-R395 PolarHBondContact OE1-NH1 2.84Å; E296-R395 IonicContact OE1-NH2 2.83Å; E296-R395 PolarHBondContact OE1-NH2 2.85Å
297	R	48	Very low	55.8	Low	198 Å²	198	124.6 Å²	124.6	75%	0.747	65%	0.645	S	S	*	*			trans	-76.4	81.8	-172.2	-172.6	-174.6	-178.1	168.8	1.7	109.9	K295 N299 D386	K295-R297 PolarHBondContact O-N 3.36Å; R297-N299 PolarHBondContact O-N 2.85Å; R297-N299 VanDerWaalsContact O-N 3.11Å; R297-D386 WeakPolarHBondContact CB-OD2 3.4Å
298	A	56.8	Low	58.6	Low	85 Å²	85	117.2 Å²	117.2	70%	0.702	61%	0.606	S	S	*	*			trans	-39.1	115.2	-173.8	0	0	0	0	0	113.4	E296	E296-A298 VanDerWaalsContact C-N 3.29Å; E296-A298 PolarHBondContact O-N 2.96Å
299	N	66.2	Low	61.5	Low	28 Å²	28	113.3 Å²	113.3	15%	0.15	58%	0.577	C	S	.	*			trans	-59.8	142.5	-169	-40.6	-67	0	0	0	112	R297 Y301 M383 P385	R297-N299 PolarHBondContact O-N 2.85Å; R297-N299 VanDerWaalsContact O-N 3.11Å; N299-Y301 HydrophobicContact CB-CD2 4Å; N299-Y301 PolarHBondContact O-N 3.01Å; N299-M383 HydrophobicContact CB-SD 4.41Å; N299-M383 WeakPolarHBondContact ND2-CA 3.46Å; N299-M383 PolarHBondContact ND2-O 3.11Å; N299-M383 PolarHBondContact OD1-O 3.29Å; N299-M383 VanDerWaalsContact OD1-O 3.08Å; N299-P385 WeakPolarHBondContact OD1-CD 3.37Å
300	S	74.1	Confident	64.3	Low	114 Å²	114	106.9 Å²	106.9	80%	0.797	55%	0.551	S	S	*	*	S	Bend	trans	-61.4	-13.8	-177.2	54.2	0	0	0	0	114.8
301	Y	85.6	Confident	67.1	Low	71 Å²	71	105.5 Å²	105.5	28%	0.278	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-59.2	134.3	172.5	-65.7	-71.4	0	0	0	112.3	N299 N332 P333 R334 L382	N299-Y301 HydrophobicContact CB-CD2 4Å; N299-Y301 PolarHBondContact O-N 3.01Å; Y301-N332 HydrophobicContact CD1-CB 4.33Å; Y301-P333 HydrophobicContact CD1-CG 4.46Å; Y301-P333 HydrophobicContact CD2-CG 3.87Å; Y301-P333 HydrophobicContact CE1-CG 4.47Å; Y301-P333 HydrophobicContact CE2-CG 3.9Å; Y301-P333 HydrophobicContact CG-CG 4.17Å; Y301-R334 WeakPolarHBondContact O-CD 3.45Å; Y301-R334 PolarHBondContact O-NE 3.1Å; Y301-L382 HydrophobicContact CE2-CB 4.14Å; Y301-L382 VanDerWaalsContact CE2-O 3.29Å; Y301-L382 WeakPolarHBondContact CE2-O 3.49Å
302	K	86.4	Confident	70.1	Confident	174 Å²	174	101.3 Å²	101.3	76%	0.757	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-93.5	142.2	177.2	-63.5	177.7	-177.9	175.3	0	110.4	N332	K302-N332 PolarHBondContact O-ND2 3.02Å
303	N	86.5	Confident	73.1	Confident	99 Å²	99	95.1 Å²	95.1	53%	0.529	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-56.9	128.3	172.3	-71.3	-15.2	0	0	0	110.1	R334	N303-R334 WeakPolarHBondContact OD1-CD 3.44Å; N303-R334 PolarHBondContact OD1-NH1 3.18Å
304	P	88.1	Confident	76.1	Confident	25 Å²	25	92.1 Å²	92.1	16%	0.162	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-58.9	149.1	170.2	-22.6	33.2	0	0	0	111.4	L309 R334 Y335	P304-L309 HydrophobicContact CB-CD2 3.72Å; P304-L309 HydrophobicContact CB-CG 4.09Å; P304-L309 HydrophobicContact CG-CD2 4.14Å; P304-R334 HydrophobicContact CG-CB 4.47Å; P304-Y335 HydrophobicContact CB-CD1 4.04Å; P304-Y335 HydrophobicContact CB-CE1 3.69Å; P304-Y335 HydrophobicContact CG-CD1 3.78Å; P304-Y335 HydrophobicContact CG-CD2 4.09Å; P304-Y335 HydrophobicContact CG-CE1 3.84Å; P304-Y335 HydrophobicContact CG-CE2 4.17Å; P304-Y335 HydrophobicContact CG-CG 3.91Å
305	R	88.1	Confident	78.8	Confident	158 Å²	158	90.6 Å²	90.6	60%	0.596	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-74.8	147	173.8	-58.9	173.2	-64.4	-178.3	3.4	109.2	Q307 D308 L309	R305-Q307 PolarHBondContact O-N 3.34Å; R305-D308 IonicContact CZ-OD2 3.42Å; R305-D308 IonicContact NE-OD2 3.65Å; R305-D308 PolarHBondContact NE-OD2 3.29Å; R305-D308 IonicContact NH2-OD1 2.67Å; R305-D308 PolarHBondContact NH2-OD1 2.65Å; R305-D308 IonicContact NH2-OD2 3.88Å; R305-D308 PolarHBondContact NH2-OD2 2.79Å; R305-D308 WeakPolarHBondContact O-CA 3.31Å; R305-D308 PolarHBondContact O-N 2.87Å; R305-L309 PolarHBondContact O-N 3.16Å
306	T	85.6	Confident	81.5	Confident	64 Å²	64	81.6 Å²	81.6	39%	0.393	41%	0.41	S	S	.	.	H	α-helix	trans	-48.1	-39.1	173	-55.3	0	0	0	0	112.4	D308 L309 T310 E348	T306-D308 PolarHBondContact O-N 3.44Å; T306-L309 PolarHBondContact O-N 2.86Å; T306-T310 PolarHBondContact O-N 2.68Å; T306-T310 PolarHBondContact O-OG1 2.8Å; T306-E348 WeakPolarHBondContact CB-OE1 3.35Å; T306-E348 HydrophobicContact CG2-CG 4.19Å; T306-E348 WeakPolarHBondContact CG2-OE1 3.43Å; T306-E348 PolarHBondContact OG1-OE1 3.12Å
307	Q	85.8	Confident	83.9	Confident	145 Å²	145	76.1 Å²	76.1	68%	0.678	38%	0.384	S	S	*	.	H	α-helix	trans	-60.7	-42	175.3	-69.3	178.9	-13.3	0	0	113.3	R305 A311	R305-Q307 PolarHBondContact O-N 3.34Å; Q307-A311 WeakPolarHBondContact O-CB 3.48Å; Q307-A311 PolarHBondContact O-N 3.47Å
308	D	87.5	Confident	86.1	Confident	19 Å²	19	69.3 Å²	69.3	10%	0.102	36%	0.361	C	S	.	.	H	α-helix	trans	-70.4	-38.3	176	-67.1	-74.3	0	0	0	111.2	R305 T306 K312 L313 Y335	R305-D308 IonicContact CZ-OD2 3.42Å; R305-D308 IonicContact NE-OD2 3.65Å; R305-D308 PolarHBondContact NE-OD2 3.29Å; R305-D308 IonicContact NH2-OD1 2.67Å; R305-D308 PolarHBondContact NH2-OD1 2.65Å; R305-D308 IonicContact NH2-OD2 3.88Å; R305-D308 PolarHBondContact NH2-OD2 2.79Å; R305-D308 WeakPolarHBondContact O-CA 3.31Å; R305-D308 PolarHBondContact O-N 2.87Å; T306-D308 PolarHBondContact O-N 3.44Å; D308-K312 HydrophobicContact CB-CD 4.35Å; D308-K312 WeakPolarHBondContact O-CA 3.15Å; D308-K312 VanDerWaalsContact O-CB 3.27Å; D308-K312 WeakPolarHBondContact O-CB 3.44Å; D308-K312 PolarHBondContact O-N 3.41Å; D308-K312 WeakPolarHBondContact OD1-CE 3.25Å; D308-K312 IonicContact OD1-NZ 3.48Å; D308-K312 PolarHBondContact OD1-NZ 2.95Å; D308-L313 PolarHBondContact O-N 2.89Å; D308-Y335 HydrophobicContact CB-CE1 4.47Å
309	L	88.9	Confident	87.8	Confident	17 Å²	17	70.5 Å²	70.5	9%	0.089	35%	0.35	C	S	.	.	I	π-helix	trans	-60.1	-46.5	174.3	-63.3	-179.9	0	0	0	111.9	P304 R305 T306 L313 R314 Y335 T344	P304-L309 HydrophobicContact CB-CD2 3.72Å; P304-L309 HydrophobicContact CB-CG 4.09Å; P304-L309 HydrophobicContact CG-CD2 4.14Å; R305-L309 PolarHBondContact O-N 3.16Å; T306-L309 PolarHBondContact O-N 2.86Å; L309-L313 HydrophobicContact CD2-CD2 4.26Å; L309-L313 PolarHBondContact O-N 3.16Å; L309-R314 PolarHBondContact O-N 3.11Å; L309-Y335 HydrophobicContact CD2-CD1 3.63Å; L309-Y335 HydrophobicContact CD2-CE1 4.03Å; L309-T344 HydrophobicContact CD1-CG2 3.74Å; L309-T344 HydrophobicContact CD2-CG2 3.61Å; L309-T344 HydrophobicContact CG-CG2 4.32Å
310	T	86.6	Confident	89.1	Confident	58 Å²	58	70.1 Å²	70.1	36%	0.356	35%	0.353	S	S	.	.	I	π-helix	trans	-80.2	-37.6	-177.7	-54.6	0	0	0	0	113.1	T306	T306-T310 PolarHBondContact O-N 2.68Å; T306-T310 PolarHBondContact O-OG1 2.8Å
311	A	86.9	Confident	90.1	Very high	66 Å²	66	68.4 Å²	68.4	55%	0.545	33%	0.332	S	S	.	.	I	π-helix	trans	-87.4	-25	-175.2	0	0	0	0	0	114.2	Q307 K315	Q307-A311 WeakPolarHBondContact O-CB 3.48Å; Q307-A311 PolarHBondContact O-N 3.47Å; A311-K315 WeakPolarHBondContact O-CB 3.34Å; A311-K315 WeakPolarHBondContact O-CD 3.47Å
312	K	90.3	Very high	90.5	Very high	101 Å²	101	69.3 Å²	69.3	44%	0.439	34%	0.339	S	S	.	.	I	π-helix	trans	-109.1	-70.9	178.7	-58	170.1	176.3	164.2	0	111	D308 R314 K315 A316 L328	D308-K312 HydrophobicContact CB-CD 4.35Å; D308-K312 WeakPolarHBondContact O-CA 3.15Å; D308-K312 VanDerWaalsContact O-CB 3.27Å; D308-K312 WeakPolarHBondContact O-CB 3.44Å; D308-K312 PolarHBondContact O-N 3.41Å; D308-K312 WeakPolarHBondContact OD1-CE 3.25Å; D308-K312 IonicContact OD1-NZ 3.48Å; D308-K312 PolarHBondContact OD1-NZ 2.95Å; K312-R314 PolarHBondContact O-N 2.89Å; K312-K315 PolarHBondContact O-N 3.37Å; K312-K315 VanDerWaalsContact O-N 3.13Å; K312-A316 PolarHBondContact O-N 3.16Å; K312-L328 HydrophobicContact CB-CD1 3.97Å; K312-L328 HydrophobicContact CB-CD2 4.34Å; K312-L328 HydrophobicContact CD-CD2 4.32Å
313	L	92.6	Very high	90.8	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.337	C	S	.	.	I	π-helix	trans	-59.2	-55	-170.6	-174.8	70	0	0	0	111.7	D308 L309 K315 A316 V317 F325 L328 I329 Y335 V346 V354	D308-L313 PolarHBondContact O-N 2.89Å; L309-L313 HydrophobicContact CD2-CD2 4.26Å; L309-L313 PolarHBondContact O-N 3.16Å; L313-K315 VanDerWaalsContact C-N 3.27Å; L313-K315 PolarHBondContact O-N 2.69Å; L313-A316 PolarHBondContact O-N 2.87Å; L313-V317 VanDerWaalsContact O-CG2 3.24Å; L313-V317 WeakPolarHBondContact O-CG2 3.3Å; L313-V317 PolarHBondContact O-N 3.37Å; L313-F325 HydrophobicContact CD1-CD2 3.66Å; L313-F325 HydrophobicContact CD1-CE2 3.62Å; L313-L328 HydrophobicContact CD1-CD1 4.46Å; L313-I329 HydrophobicContact CD1-CG2 4.27Å; L313-Y335 HydrophobicContact CB-CD1 4.13Å; L313-Y335 HydrophobicContact CD2-CD1 4.06Å; L313-Y335 WeakPolarHBondContact CD2-O 3.39Å; L313-Y335 HydrophobicContact CG-CD1 4.48Å; L313-V346 HydrophobicContact CD2-CG1 3.73Å; L313-V346 HydrophobicContact CG-CG1 4.29Å; L313-V354 HydrophobicContact CD2-CG2 4.16Å
314	R	93.9	Very high	91.2	Very high	57 Å²	57	65.2 Å²	65.2	22%	0.215	33%	0.328	C	S	.	.	H	α-helix	trans	-56.9	-40.6	177.1	-172.3	-177.8	155.6	-157.4	-14.7	112.3	L309 K312 V317 E318 V346 V357	L309-R314 PolarHBondContact O-N 3.11Å; K312-R314 PolarHBondContact O-N 2.89Å; R314-V317 PolarHBondContact O-N 3.47Å; R314-E318 HydrophobicContact CG-CG 4.27Å; R314-E318 IonicContact CZ-OE1 3.83Å; R314-E318 IonicContact NE-OE1 2.72Å; R314-E318 PolarHBondContact NE-OE1 3.35Å; R314-E318 IonicContact NE-OE2 3.74Å; R314-E318 IonicContact NH2-OE1 3.91Å; R314-E318 PolarHBondContact NH2-OE1 3.13Å; R314-E318 IonicContact NH2-OE2 2.62Å; R314-E318 WeakPolarHBondContact O-CB 3.46Å; R314-E318 WeakPolarHBondContact O-CG 3.34Å; R314-E318 PolarHBondContact O-N 3.11Å; R314-V346 HydrophobicContact CB-CB 4.16Å; R314-V357 HydrophobicContact CG-CG1 4.18Å
315	K	93.9	Very high	91.6	Very high	116 Å²	116	64 Å²	64	50%	0.504	32%	0.32	S	S	.	.	H	α-helix	trans	-69.9	-36.8	-177.6	-170.8	176.3	-178.7	178.9	0	112.6	A311 K312 L313 K319	A311-K315 WeakPolarHBondContact O-CB 3.34Å; A311-K315 WeakPolarHBondContact O-CD 3.47Å; K312-K315 PolarHBondContact O-N 3.37Å; K312-K315 VanDerWaalsContact O-N 3.13Å; L313-K315 VanDerWaalsContact C-N 3.27Å; L313-K315 PolarHBondContact O-N 2.69Å; K315-K319 WeakPolarHBondContact O-CG 3.17Å; K315-K319 PolarHBondContact O-N 3.14Å
316	A	94.6	Very high	91.9	Very high	3 Å²	3	58 Å²	58	3%	0.025	30%	0.302	C	S	.	.	H	α-helix	trans	-64.8	-44.9	171.6	0	0	0	0	0	110.8	K312 L313 K319 G320 E321 T324 F325	K312-A316 PolarHBondContact O-N 3.16Å; L313-A316 PolarHBondContact O-N 2.87Å; A316-K319 PolarHBondContact O-N 3.34Å; A316-G320 PolarHBondContact O-N 3.06Å; A316-E321 HydrophobicContact CB-CB 4.4Å; A316-E321 PolarHBondContact O-N 2.85Å; A316-T324 WeakPolarHBondContact CB-OG1 3.35Å; A316-F325 HydrophobicContact CB-CB 4.49Å
317	V	95.6	Very high	92.3	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.006	31%	0.313	C	S	.	.	H	α-helix	trans	-60	-50.8	175.6	175.9	0	0	0	0	111.5	L313 R314 K319 G320 F325 V354 V357 A358 Q363 I366	L313-V317 VanDerWaalsContact O-CG2 3.24Å; L313-V317 WeakPolarHBondContact O-CG2 3.3Å; L313-V317 PolarHBondContact O-N 3.37Å; R314-V317 PolarHBondContact O-N 3.47Å; V317-K319 VanDerWaalsContact C-N 3.26Å; V317-K319 PolarHBondContact O-N 3.03Å; V317-G320 PolarHBondContact O-N 2.98Å; V317-F325 HydrophobicContact CG2-CD2 3.64Å; V317-F325 HydrophobicContact CG2-CE2 3.51Å; V317-V354 HydrophobicContact CG1-CG1 4.19Å; V317-V354 HydrophobicContact CG2-CG1 3.79Å; V317-V357 HydrophobicContact CB-CG1 4.47Å; V317-V357 HydrophobicContact CG1-CB 4.04Å; V317-V357 HydrophobicContact CG1-CG1 3.85Å; V317-A358 HydrophobicContact CG1-CB 3.93Å; V317-Q363 WeakPolarHBondContact O-CG 3.39Å; V317-I366 HydrophobicContact CB-CG2 4.44Å; V317-I366 HydrophobicContact CG1-CG2 4.13Å; V317-I366 HydrophobicContact CG2-CG2 4.05Å
318	E	94.3	Very high	92.6	Very high	55 Å²	55	54.9 Å²	54.9	26%	0.257	29%	0.287	S	S	.	.	H	α-helix	trans	-61	-32.9	-177.9	-75.3	178	152.6	0	0	112.8	R314 V357 E361 Q363	R314-E318 HydrophobicContact CG-CG 4.27Å; R314-E318 IonicContact CZ-OE1 3.83Å; R314-E318 IonicContact NE-OE1 2.72Å; R314-E318 PolarHBondContact NE-OE1 3.35Å; R314-E318 IonicContact NE-OE2 3.74Å; R314-E318 IonicContact NH2-OE1 3.91Å; R314-E318 PolarHBondContact NH2-OE1 3.13Å; R314-E318 IonicContact NH2-OE2 2.62Å; R314-E318 WeakPolarHBondContact O-CB 3.46Å; R314-E318 WeakPolarHBondContact O-CG 3.34Å; R314-E318 PolarHBondContact O-N 3.11Å; E318-V357 HydrophobicContact CG-CG1 3.4Å; E318-V357 VanDerWaalsContact CG-CG1 3.4Å; E318-E361 HydrophobicContact CB-CG 4.32Å; E318-E361 HydrophobicContact CG-CG 4.2Å; E318-Q363 PolarHBondContact O-NE2 3.47Å
319	K	93.2	Very high	93	Very high	110 Å²	110	54 Å²	54	48%	0.478	28%	0.283	S	S	.	.	H	α-helix	trans	-83.8	-28.7	176	-72.2	176.1	172.3	-176.7	0	114.8	K315 A316 V317 E321 Q363	K315-K319 WeakPolarHBondContact O-CG 3.17Å; K315-K319 PolarHBondContact O-N 3.14Å; A316-K319 PolarHBondContact O-N 3.34Å; V317-K319 VanDerWaalsContact C-N 3.26Å; V317-K319 PolarHBondContact O-N 3.03Å; K319-E321 HydrophobicContact CB-CG 3.93Å; K319-E321 HydrophobicContact CD-CG 3.79Å; K319-E321 VanDerWaalsContact CD-OE1 3.32Å; K319-E321 WeakPolarHBondContact CD-OE1 2.89Å; K319-E321 WeakPolarHBondContact CD-OE2 3.29Å; K319-E321 IonicContact NZ-OE1 2.81Å; K319-E321 PolarHBondContact NZ-OE1 2.85Å; K319-E321 IonicContact NZ-OE2 2.65Å; K319-E321 PolarHBondContact NZ-OE2 3.09Å; K319-Q363 PolarHBondContact O-NE2 2.77Å
320	G	92.8	Very high	93.2	Very high	20 Å²	20	58.1 Å²	58.1	21%	0.206	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	33.7	-166.9	0	0	0	0	0	113.8	A316 V317 E322	A316-G320 PolarHBondContact O-N 3.06Å; V317-G320 PolarHBondContact O-N 2.98Å; G320-E322 VanDerWaalsContact C-N 3.31Å; G320-E322 PolarHBondContact O-N 3.18Å
321	E	93.9	Very high	93.5	Very high	77 Å²	77	59.2 Å²	59.2	36%	0.36	31%	0.307	S	S	.	.			trans	-81.7	73.6	177.7	-70.7	-179.4	154.7	0	0	111.2	A316 K319 D323 T324 F325	A316-E321 HydrophobicContact CB-CB 4.4Å; A316-E321 PolarHBondContact O-N 2.85Å; K319-E321 HydrophobicContact CB-CG 3.93Å; K319-E321 HydrophobicContact CD-CG 3.79Å; K319-E321 VanDerWaalsContact CD-OE1 3.32Å; K319-E321 WeakPolarHBondContact CD-OE1 2.89Å; K319-E321 WeakPolarHBondContact CD-OE2 3.29Å; K319-E321 IonicContact NZ-OE1 2.81Å; K319-E321 PolarHBondContact NZ-OE1 2.85Å; K319-E321 IonicContact NZ-OE2 2.65Å; K319-E321 PolarHBondContact NZ-OE2 3.09Å; E321-D323 PolarHBondContact O-N 3.34Å; E321-T324 HydrophobicContact CB-CG2 4.22Å; E321-T324 WeakPolarHBondContact CB-OG1 3.19Å; E321-T324 PolarHBondContact O-N 2.7Å; E321-T324 VanDerWaalsContact O-N 3.1Å; E321-T324 PolarHBondContact O-OG1 3.2Å; E321-F325 PolarHBondContact O-N 2.84Å
322	E	94.2	Very high	93.7	Very high	90 Å²	90	57.1 Å²	57.1	42%	0.421	29%	0.287	S	S	.	.	H	α-helix	trans	-48.1	-48.1	-175.4	-66.8	173.6	-148	0	0	114.1	G320 T324 F325 S326 S365 I366 L369	G320-E322 VanDerWaalsContact C-N 3.31Å; G320-E322 PolarHBondContact O-N 3.18Å; E322-T324 PolarHBondContact O-N 2.92Å; E322-F325 PolarHBondContact O-N 2.69Å; E322-S326 WeakPolarHBondContact O-CB 3.44Å; E322-S326 PolarHBondContact O-N 2.91Å; E322-S326 PolarHBondContact O-OG 3.1Å; E322-S365 WeakPolarHBondContact OE1-CB 3.44Å; E322-S365 PolarHBondContact OE1-OG 3.35Å; E322-I366 HydrophobicContact CB-CD1 4.46Å; E322-I366 HydrophobicContact CG-CD1 3.91Å; E322-L369 HydrophobicContact CB-CD2 4.35Å
323	D	93.8	Very high	93.8	Very high	132 Å²	132	52.3 Å²	52.3	71%	0.706	27%	0.266	S	S	*	.	H	α-helix	trans	-58.5	-49.6	178.3	-58.3	-50.4	0	0	0	111	E321 F325 S326 D327	E321-D323 PolarHBondContact O-N 3.34Å; D323-F325 VanDerWaalsContact C-N 3.33Å; D323-F325 PolarHBondContact O-N 2.87Å; D323-S326 WeakPolarHBondContact O-CB 3.32Å; D323-S326 PolarHBondContact O-N 2.77Å; D323-D327 PolarHBondContact O-N 3.47Å
324	T	94.7	Very high	93.8	Very high	56 Å²	56	54 Å²	54	34%	0.344	27%	0.272	S	S	.	.	H	α-helix	trans	-71.3	-29.2	-177	73	0	0	0	0	112.8	A316 E321 E322 L328	A316-T324 WeakPolarHBondContact CB-OG1 3.35Å; E321-T324 HydrophobicContact CB-CG2 4.22Å; E321-T324 WeakPolarHBondContact CB-OG1 3.19Å; E321-T324 PolarHBondContact O-N 2.7Å; E321-T324 VanDerWaalsContact O-N 3.1Å; E321-T324 PolarHBondContact O-OG1 3.2Å; E322-T324 PolarHBondContact O-N 2.92Å; T324-L328 WeakPolarHBondContact O-CB 3.48Å; T324-L328 WeakPolarHBondContact O-CD1 3.29Å; T324-L328 WeakPolarHBondContact O-CG 3.48Å; T324-L328 PolarHBondContact O-N 3.42Å
325	F	95.3	Very high	93.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-44.4	171.9	-178.9	-97.3	0	0	0	110.1	L313 A316 V317 E321 E322 D323 L328 I329 L336 V354 I366 L369 T370	L313-F325 HydrophobicContact CD1-CD2 3.66Å; L313-F325 HydrophobicContact CD1-CE2 3.62Å; A316-F325 HydrophobicContact CB-CB 4.49Å; V317-F325 HydrophobicContact CG2-CD2 3.64Å; V317-F325 HydrophobicContact CG2-CE2 3.51Å; E321-F325 PolarHBondContact O-N 2.84Å; E322-F325 PolarHBondContact O-N 2.69Å; D323-F325 VanDerWaalsContact C-N 3.33Å; D323-F325 PolarHBondContact O-N 2.87Å; F325-L328 PolarHBondContact O-N 2.82Å; F325-I329 HydrophobicContact CD1-CD1 3.86Å; F325-I329 HydrophobicContact CE1-CD1 3.65Å; F325-I329 HydrophobicContact CE1-CG2 4.35Å; F325-I329 HydrophobicContact CE2-CG2 4.44Å; F325-I329 HydrophobicContact CZ-CD1 4.44Å; F325-I329 HydrophobicContact CZ-CG2 4.24Å; F325-I329 WeakPolarHBondContact O-CG1 3.23Å; F325-I329 WeakPolarHBondContact O-CG2 3.45Å; F325-I329 PolarHBondContact O-N 2.95Å; F325-L336 HydrophobicContact CZ-CD2 4.14Å; F325-V354 HydrophobicContact CE2-CG1 3.94Å; F325-V354 HydrophobicContact CE2-CG2 4.43Å; F325-V354 HydrophobicContact CZ-CG1 4.02Å; F325-I366 HydrophobicContact CB-CD1 4.12Å; F325-I366 HydrophobicContact CD1-CD1 4.4Å; F325-I366 HydrophobicContact CD1-CG2 4.41Å; F325-I366 HydrophobicContact CD2-CG2 4.22Å; F325-I366 HydrophobicContact CE1-CG2 4.21Å; F325-I366 HydrophobicContact CE2-CG2 4.03Å; F325-I366 HydrophobicContact CG-CD1 4.19Å; F325-I366 HydrophobicContact CG-CG2 4.41Å; F325-I366 HydrophobicContact CZ-CG2 4.02Å; F325-L369 HydrophobicContact CD1-CD2 3.69Å; F325-L369 HydrophobicContact CD1-CG 4.07Å; F325-L369 HydrophobicContact CE1-CD2 4.32Å; F325-L369 HydrophobicContact CE1-CG 4.23Å; F325-T370 VanDerWaalsContact CZ-OG1 3.29Å; F325-T370 WeakPolarHBondContact CZ-OG1 3.35Å
326	S	94.9	Very high	93.6	Very high	31 Å²	31	46.7 Å²	46.7	22%	0.217	24%	0.242	C	C	.	.	H	α-helix	trans	-59.4	-50.9	175.1	-55.1	0	0	0	0	112	E322 D323 L328 I329 W330	E322-S326 WeakPolarHBondContact O-CB 3.44Å; E322-S326 PolarHBondContact O-N 2.91Å; E322-S326 PolarHBondContact O-OG 3.1Å; D323-S326 WeakPolarHBondContact O-CB 3.32Å; D323-S326 PolarHBondContact O-N 2.77Å; S326-L328 VanDerWaalsContact C-N 3.27Å; S326-L328 PolarHBondContact O-N 3.31Å; S326-I329 WeakPolarHBondContact O-CG1 3.38Å; S326-I329 PolarHBondContact O-N 3.36Å; S326-W330 WeakPolarHBondContact O-CB 3.41Å; S326-W330 VanDerWaalsContact O-CD1 3.31Å; S326-W330 PolarHBondContact O-N 2.95Å
327	D	94.4	Very high	93.5	Very high	117 Å²	117	46.6 Å²	46.6	63%	0.626	24%	0.24	S	C	*	.	H	α-helix	trans	-57.4	-39.5	178	-75.6	-23.5	0	0	0	112.1	D323 S331	D323-D327 PolarHBondContact O-N 3.47Å; D327-S331 WeakPolarHBondContact O-CB 3.22Å; D327-S331 PolarHBondContact O-N 2.85Å; D327-S331 VanDerWaalsContact O-N 3.13Å; D327-S331 PolarHBondContact O-OG 3.19Å
328	L	93.3	Very high	93.1	Very high	27 Å²	27	47.1 Å²	47.1	14%	0.141	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-51	178.2	-73.5	167.9	0	0	0	111.9	K312 L313 T324 F325 S326 S331 N332 Y335	K312-L328 HydrophobicContact CB-CD1 3.97Å; K312-L328 HydrophobicContact CB-CD2 4.34Å; K312-L328 HydrophobicContact CD-CD2 4.32Å; L313-L328 HydrophobicContact CD1-CD1 4.46Å; T324-L328 WeakPolarHBondContact O-CB 3.48Å; T324-L328 WeakPolarHBondContact O-CD1 3.29Å; T324-L328 WeakPolarHBondContact O-CG 3.48Å; T324-L328 PolarHBondContact O-N 3.42Å; F325-L328 PolarHBondContact O-N 2.82Å; S326-L328 VanDerWaalsContact C-N 3.27Å; S326-L328 PolarHBondContact O-N 3.31Å; L328-S331 PolarHBondContact O-OG 3.03Å; L328-S331 VanDerWaalsContact O-OG 3.06Å; L328-N332 PolarHBondContact O-N 2.96Å; L328-Y335 HydrophobicContact CB-CD2 4.36Å; L328-Y335 HydrophobicContact CB-CE2 4.47Å; L328-Y335 HydrophobicContact CD2-CE1 4.46Å; L328-Y335 HydrophobicContact CD2-CE2 4.12Å; L328-Y335 WeakPolarHBondContact O-CD2 3.41Å
329	I	94.2	Very high	92.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70.2	-39.8	-175.3	66.8	-168.8	0	0	0	112.2	L313 F325 S326 N332 P333 L336 V373	L313-I329 HydrophobicContact CD1-CG2 4.27Å; F325-I329 HydrophobicContact CD1-CD1 3.86Å; F325-I329 HydrophobicContact CE1-CD1 3.65Å; F325-I329 HydrophobicContact CE1-CG2 4.35Å; F325-I329 HydrophobicContact CE2-CG2 4.44Å; F325-I329 HydrophobicContact CZ-CD1 4.44Å; F325-I329 HydrophobicContact CZ-CG2 4.24Å; F325-I329 WeakPolarHBondContact O-CG1 3.23Å; F325-I329 WeakPolarHBondContact O-CG2 3.45Å; F325-I329 PolarHBondContact O-N 2.95Å; S326-I329 WeakPolarHBondContact O-CG1 3.38Å; S326-I329 PolarHBondContact O-N 3.36Å; I329-N332 CarbonylContact O-C 3.49Å; I329-N332 PolarHBondContact O-N 3.14Å; I329-P333 WeakPolarHBondContact O-CA 3.41Å; I329-L336 HydrophobicContact CB-CD1 4.22Å; I329-L336 HydrophobicContact CB-CG 4.28Å; I329-L336 HydrophobicContact CD1-CD1 4.32Å; I329-L336 HydrophobicContact CG2-CD1 3.99Å; I329-L336 HydrophobicContact CG2-CD2 3.98Å; I329-L336 HydrophobicContact CG2-CG 3.71Å; I329-V373 HydrophobicContact CD1-CB 4.24Å; I329-V373 HydrophobicContact CD1-CG1 3.95Å; I329-V373 HydrophobicContact CD1-CG2 4.02Å; I329-V373 HydrophobicContact CG1-CG1 4.44Å
330	W	93.4	Very high	91.9	Very high	104 Å²	104	46.1 Å²	46.1	39%	0.394	27%	0.268	S	S	.	.	H	α-helix	trans	-75.7	-27.3	179	-74.3	99.8	0	0	0	113.4	S326 N332 V373 F379 L382	S326-W330 WeakPolarHBondContact O-CB 3.41Å; S326-W330 VanDerWaalsContact O-CD1 3.31Å; S326-W330 PolarHBondContact O-N 2.95Å; W330-N332 VanDerWaalsContact C-N 3.33Å; W330-V373 HydrophobicContact CZ2-CG1 4.27Å; W330-V373 HydrophobicContact CZ2-CG2 4.2Å; W330-F379 HydrophobicContact CD2-CD2 4.05Å; W330-F379 AromaticContact CE3-CD2 3.86Å; W330-F379 HydrophobicContact CE3-CD2 3.86Å; W330-F379 HydrophobicContact CH2-CB 3.72Å; W330-F379 HydrophobicContact CH2-CD2 4.03Å; W330-F379 HydrophobicContact CH2-CG 4.35Å; W330-F379 HydrophobicContact CZ2-CB 4.3Å; W330-F379 HydrophobicContact CZ2-CD2 4.19Å; W330-F379 HydrophobicContact CZ3-CB 4.03Å; W330-F379 AromaticContact CZ3-CD2 3.85Å; W330-F379 HydrophobicContact CZ3-CD2 3.85Å; W330-F379 HydrophobicContact CZ3-CG 4.45Å; W330-L382 HydrophobicContact CE3-CD1 4.18Å; W330-L382 HydrophobicContact CZ3-CD1 4.26Å
331	S	92.6	Very high	91.5	Very high	80 Å²	80	46.5 Å²	46.5	56%	0.559	27%	0.265	S	S	*	.	H	α-helix	trans	-73.2	-23.9	171.6	62.7	0	0	0	0	113.5	D327 L328	D327-S331 WeakPolarHBondContact O-CB 3.22Å; D327-S331 PolarHBondContact O-N 2.85Å; D327-S331 VanDerWaalsContact O-N 3.13Å; D327-S331 PolarHBondContact O-OG 3.19Å; L328-S331 PolarHBondContact O-OG 3.03Å; L328-S331 VanDerWaalsContact O-OG 3.06Å
332	N	92.4	Very high	91.3	Very high	23 Å²	23	46.8 Å²	46.8	12%	0.123	27%	0.27	C	S	.	.			trans	-158.1	104.5	173.9	-179.1	2	0	0	0	111.4	Y301 K302 L328 I329 W330 R334 Y335	Y301-N332 HydrophobicContact CD1-CB 4.33Å; K302-N332 PolarHBondContact O-ND2 3.02Å; L328-N332 PolarHBondContact O-N 2.96Å; I329-N332 CarbonylContact O-C 3.49Å; I329-N332 PolarHBondContact O-N 3.14Å; W330-N332 VanDerWaalsContact C-N 3.33Å; N332-R334 PolarHBondContact O-N 2.75Å; N332-R334 WeakPolarHBondContact OD1-CB 3.45Å; N332-R334 PolarHBondContact OD1-N 2.87Å; N332-R334 VanDerWaalsContact OD1-N 3.16Å; N332-Y335 HydrophobicContact CB-CD2 3.88Å; N332-Y335 HydrophobicContact CB-CE2 4.06Å; N332-Y335 WeakPolarHBondContact O-CD2 3.43Å; N332-Y335 PolarHBondContact O-N 3.31Å
333	P	92.1	Very high	91.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-60.8	-17.4	-176.6	24.7	-35.6	0	0	0	113.7	Y301 I329 Y335 L336 I337 F379 L382 M383	Y301-P333 HydrophobicContact CD1-CG 4.46Å; Y301-P333 HydrophobicContact CD2-CG 3.87Å; Y301-P333 HydrophobicContact CE1-CG 4.47Å; Y301-P333 HydrophobicContact CE2-CG 3.9Å; Y301-P333 HydrophobicContact CG-CG 4.17Å; I329-P333 WeakPolarHBondContact O-CA 3.41Å; P333-Y335 PolarHBondContact O-N 3.02Å; P333-Y335 VanDerWaalsContact O-N 3.15Å; P333-L336 PolarHBondContact O-N 2.77Å; P333-I337 PolarHBondContact O-N 3.35Å; P333-F379 HydrophobicContact CB-CE1 4.1Å; P333-F379 HydrophobicContact CB-CE2 3.84Å; P333-F379 HydrophobicContact CB-CZ 3.53Å; P333-L382 HydrophobicContact CG-CB 4.01Å; P333-M383 HydrophobicContact CB-CG 3.72Å; P333-M383 HydrophobicContact CG-CG 3.57Å; P333-M383 HydrophobicContact CG-SD 3.98Å
334	R	91.4	Very high	91.1	Very high	34 Å²	34	37.6 Å²	37.6	13%	0.128	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-67.2	-7.2	173.7	-60.9	-178.9	173.2	-71.5	-0.6	114.8	Y301 N303 P304 N332 L336 I337 T344 M383	Y301-R334 WeakPolarHBondContact O-CD 3.45Å; Y301-R334 PolarHBondContact O-NE 3.1Å; N303-R334 WeakPolarHBondContact OD1-CD 3.44Å; N303-R334 PolarHBondContact OD1-NH1 3.18Å; P304-R334 HydrophobicContact CG-CB 4.47Å; N332-R334 PolarHBondContact O-N 2.75Å; N332-R334 WeakPolarHBondContact OD1-CB 3.45Å; N332-R334 PolarHBondContact OD1-N 2.87Å; N332-R334 VanDerWaalsContact OD1-N 3.16Å; R334-L336 PolarHBondContact O-N 2.89Å; R334-I337 VanDerWaalsContact CA-O 3.29Å; R334-I337 WeakPolarHBondContact CA-O 3.47Å; R334-T344 PolarHBondContact O-OG1 2.93Å; R334-T344 VanDerWaalsContact O-OG1 3.09Å; R334-M383 HydrophobicContact CG-CE 4.13Å; R334-M383 HydrophobicContact CG-SD 3.84Å
335	Y	92.8	Very high	91	Very high	21 Å²	21	37 Å²	37	8%	0.082	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-65.5	-25.2	164.8	-83	-72.1	0	0	0	112.7	P304 D308 L309 L313 L328 N332 P333 T344	P304-Y335 HydrophobicContact CB-CD1 4.04Å; P304-Y335 HydrophobicContact CB-CE1 3.69Å; P304-Y335 HydrophobicContact CG-CD1 3.78Å; P304-Y335 HydrophobicContact CG-CD2 4.09Å; P304-Y335 HydrophobicContact CG-CE1 3.84Å; P304-Y335 HydrophobicContact CG-CE2 4.17Å; P304-Y335 HydrophobicContact CG-CG 3.91Å; D308-Y335 HydrophobicContact CB-CE1 4.47Å; L309-Y335 HydrophobicContact CD2-CD1 3.63Å; L309-Y335 HydrophobicContact CD2-CE1 4.03Å; L313-Y335 HydrophobicContact CB-CD1 4.13Å; L313-Y335 HydrophobicContact CD2-CD1 4.06Å; L313-Y335 WeakPolarHBondContact CD2-O 3.39Å; L313-Y335 HydrophobicContact CG-CD1 4.48Å; L328-Y335 HydrophobicContact CB-CD2 4.36Å; L328-Y335 HydrophobicContact CB-CE2 4.47Å; L328-Y335 HydrophobicContact CD2-CE1 4.46Å; L328-Y335 HydrophobicContact CD2-CE2 4.12Å; L328-Y335 WeakPolarHBondContact O-CD2 3.41Å; N332-Y335 HydrophobicContact CB-CD2 3.88Å; N332-Y335 HydrophobicContact CB-CE2 4.06Å; N332-Y335 WeakPolarHBondContact O-CD2 3.43Å; N332-Y335 PolarHBondContact O-N 3.31Å; P333-Y335 PolarHBondContact O-N 3.02Å; P333-Y335 VanDerWaalsContact O-N 3.15Å; Y335-T344 VanDerWaalsContact O-CB 3.31Å; Y335-T344 WeakPolarHBondContact O-CB 3.21Å; Y335-T344 VanDerWaalsContact O-CG2 3.29Å; Y335-T344 WeakPolarHBondContact O-CG2 3.1Å
336	L	92.9	Very high	90.8	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-43.2	170.9	-60.1	-179.2	0	0	0	112.2	F325 I329 P333 R334 T344 V354 T370 V373 L374 F379 Y403	F325-L336 HydrophobicContact CZ-CD2 4.14Å; I329-L336 HydrophobicContact CB-CD1 4.22Å; I329-L336 HydrophobicContact CB-CG 4.28Å; I329-L336 HydrophobicContact CD1-CD1 4.32Å; I329-L336 HydrophobicContact CG2-CD1 3.99Å; I329-L336 HydrophobicContact CG2-CD2 3.98Å; I329-L336 HydrophobicContact CG2-CG 3.71Å; P333-L336 PolarHBondContact O-N 2.77Å; R334-L336 PolarHBondContact O-N 2.89Å; L336-T344 WeakPolarHBondContact O-CB 3.44Å; L336-T344 PolarHBondContact O-N 3.41Å; L336-T344 PolarHBondContact O-OG1 2.63Å; L336-V354 HydrophobicContact CD2-CG2 4.01Å; L336-T370 HydrophobicContact CD2-CG2 4.43Å; L336-V373 HydrophobicContact CD1-CG1 4.38Å; L336-L374 HydrophobicContact CB-CD2 4.21Å; L336-L374 HydrophobicContact CD1-CD2 4.1Å; L336-L374 HydrophobicContact CD1-CG 4.2Å; L336-F379 HydrophobicContact CD1-CE1 4.37Å; L336-F379 HydrophobicContact CD1-CZ 4.21Å; L336-Y403 WeakPolarHBondContact CA-OH 3.33Å; L336-Y403 HydrophobicContact CB-CE2 4.49Å; L336-Y403 PolarHBondContact O-OH 3.45Å
337	I	92.1	Very high	90.4	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-100.5	103.3	-170.2	-51.7	-178.7	0	0	0	110.5	P333 R334 L374 F379 M380 M383 Y384	P333-I337 PolarHBondContact O-N 3.35Å; R334-I337 VanDerWaalsContact CA-O 3.29Å; R334-I337 WeakPolarHBondContact CA-O 3.47Å; I337-L374 HydrophobicContact CD1-CD2 4.36Å; I337-L374 HydrophobicContact CG1-CD2 4.19Å; I337-F379 HydrophobicContact CD1-CE1 4.07Å; I337-M380 HydrophobicContact CD1-CE 4.38Å; I337-M380 HydrophobicContact CD1-SD 3.4Å; I337-M380 WeakPolarHBondContact CD1-SD 3.43Å; I337-M383 HydrophobicContact CB-CE 4.22Å; I337-M383 HydrophobicContact CD1-CB 4.47Å; I337-M383 HydrophobicContact CD1-CG 4.24Å; I337-M383 HydrophobicContact CG2-CE 3.87Å; I337-Y384 HydrophobicContact CD1-CE2 4.45Å; I337-Y384 VanDerWaalsContact CG2-OH 3.29Å; I337-Y384 WeakPolarHBondContact CG2-OH 3.33Å
338	G	87	Confident	89.8	Confident	13 Å²	13	37.9 Å²	37.9	13%	0.134	22%	0.216	C	C	.	.			trans	-69	-176.8	179.1	0	0	0	0	0	113.7	G340 N342 T344	G338-G340 PolarHBondContact O-N 3.01Å; G338-N342 VanDerWaalsContact CA-O 3.31Å; G338-N342 WeakPolarHBondContact CA-O 3.38Å; G338-N342 PolarHBondContact N-O 3.07Å; G338-T344 PolarHBondContact N-OG1 3Å
339	S	79.9	Confident	89.4	Confident	87 Å²	87	39.3 Å²	39.3	61%	0.608	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	124.7	172.1	54.1	0	0	0	0	111.1
340	G	81.3	Confident	89	Confident	57 Å²	57	40.6 Å²	40.6	59%	0.588	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	45.7	-178	0	0	0	0	0	112.4	G338 N342	G338-G340 PolarHBondContact O-N 3.01Å; G340-N342 PolarHBondContact O-N 3.14Å; G340-N342 PolarHBondContact O-ND2 3.18Å
341	D	85.4	Confident	88.8	Confident	27 Å²	27	42.4 Å²	42.4	14%	0.144	25%	0.252	C	S	.	.	S	Bend	trans	59.8	19.8	165.3	-53.9	8.7	0	0	0	115.3	Y384 R395 Y398 V399	D341-Y384 PolarHBondContact OD1-OH 2.93Å; D341-R395 IonicContact OD1-NH1 2.63Å; D341-R395 VanDerWaalsContact OD2-CD 3.28Å; D341-R395 WeakPolarHBondContact OD2-CD 3.28Å; D341-R395 WeakPolarHBondContact OD2-CG 3.33Å; D341-R395 IonicContact OD2-CZ 2.67Å; D341-R395 IonicContact OD2-NE 3.86Å; D341-R395 IonicContact OD2-NH1 3.34Å; D341-R395 PolarHBondContact OD2-NH1 3.08Å; D341-Y398 HydrophobicContact CB-CE1 4.48Å; D341-V399 HydrophobicContact CB-CG2 4.27Å
342	N	89.4	Confident	88.8	Confident	84 Å²	84	40.1 Å²	40.1	45%	0.449	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-88.8	142.4	176.8	-78.9	-97.6	0	0	0	111.2	G338 G340 T344	G338-N342 VanDerWaalsContact CA-O 3.31Å; G338-N342 WeakPolarHBondContact CA-O 3.38Å; G338-N342 PolarHBondContact N-O 3.07Å; G340-N342 PolarHBondContact O-N 3.14Å; G340-N342 PolarHBondContact O-ND2 3.18Å; N342-T344 PolarHBondContact O-N 3.49Å
343	P	91.9	Very high	88.9	Confident	16 Å²	16	39.2 Å²	39.2	10%	0.104	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-52.6	130.1	170.7	-29.2	35.5	0	0	0	113.4	I345 N353 L402 Y403	P343-I345 PolarHBondContact O-N 3.18Å; P343-N353 HydrophobicContact CB-CB 4.02Å; P343-L402 HydrophobicContact CG-CB 3.57Å; P343-Y403 HydrophobicContact CB-CD1 4.23Å; P343-Y403 HydrophobicContact CB-CD2 3.78Å; P343-Y403 HydrophobicContact CB-CE1 4.04Å; P343-Y403 HydrophobicContact CB-CE2 3.56Å; P343-Y403 HydrophobicContact CB-CG 4.13Å; P343-Y403 HydrophobicContact CG-CD2 3.72Å; P343-Y403 HydrophobicContact CG-CE2 3.97Å; P343-Y403 HydrophobicContact CG-CG 4.1Å
344	T	92.1	Very high	89	Confident	12 Å²	12	39.2 Å²	39.2	7%	0.074	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-65.8	125.3	178.1	-78	0	0	0	0	110.9	L309 R334 Y335 L336 G338 N342 Y403	L309-T344 HydrophobicContact CD1-CG2 3.74Å; L309-T344 HydrophobicContact CD2-CG2 3.61Å; L309-T344 HydrophobicContact CG-CG2 4.32Å; R334-T344 PolarHBondContact O-OG1 2.93Å; R334-T344 VanDerWaalsContact O-OG1 3.09Å; Y335-T344 VanDerWaalsContact O-CB 3.31Å; Y335-T344 WeakPolarHBondContact O-CB 3.21Å; Y335-T344 VanDerWaalsContact O-CG2 3.29Å; Y335-T344 WeakPolarHBondContact O-CG2 3.1Å; L336-T344 WeakPolarHBondContact O-CB 3.44Å; L336-T344 PolarHBondContact O-N 3.41Å; L336-T344 PolarHBondContact O-OG1 2.63Å; G338-T344 PolarHBondContact N-OG1 3Å; N342-T344 PolarHBondContact O-N 3.49Å; T344-Y403 PolarHBondContact N-OH 2.93Å
345	I	91.7	Very high	89.1	Confident	43 Å²	43	37.7 Å²	37.7	22%	0.221	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-84.7	118	-176.9	-67	169.2	0	0	0	109.7	P343 R351 Y352	P343-I345 PolarHBondContact O-N 3.18Å; I345-R351 HydrophobicContact CD1-CB 4.03Å; I345-R351 HydrophobicContact CD1-CG 4.15Å; I345-R351 VanDerWaalsContact CD1-CZ 3.42Å; I345-Y352 CarbonylContact C-O 3.5Å; I345-Y352 WeakPolarHBondContact CA-O 3.35Å
346	V	90.8	Very high	89.2	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.006	22%	0.217	C	C	.	.	S	Bend	trans	-92.7	-12.8	-179.7	-66.2	0	0	0	0	113.5	L313 R314 Y352 V354 V357	L313-V346 HydrophobicContact CD2-CG1 3.73Å; L313-V346 HydrophobicContact CG-CG1 4.29Å; R314-V346 HydrophobicContact CB-CB 4.16Å; V346-Y352 WeakPolarHBondContact CG2-O 3.43Å; V346-Y352 PolarHBondContact N-O 2.73Å; V346-V354 HydrophobicContact CG1-CG2 4.07Å; V346-V357 HydrophobicContact CG2-CG2 3.59Å
347	Q	87.5	Confident	89.3	Confident	51 Å²	51	36.8 Å²	36.8	24%	0.238	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-142	96	173.2	-176.1	175	-27.9	0	0	111	G349 R351 Y352	Q347-G349 PolarHBondContact O-N 3.25Å; Q347-R351 WeakPolarHBondContact O-CA 3.35Å; Q347-R351 PolarHBondContact O-N 3.34Å; Q347-Y352 HydrophobicContact CB-CD2 4.09Å; Q347-Y352 HydrophobicContact CB-CG 4.44Å; Q347-Y352 HydrophobicContact CG-CD2 4.31Å; Q347-Y352 PolarHBondContact N-O 3.49Å; Q347-Y352 PolarHBondContact O-N 2.91Å
348	E	82.6	Confident	89.5	Confident	116 Å²	116	36.8 Å²	36.8	54%	0.542	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-41.1	-169.4	-64.3	-178.4	169.6	0	0	114.8	T306 C350 R351	T306-E348 WeakPolarHBondContact CB-OE1 3.35Å; T306-E348 HydrophobicContact CG2-CG 4.19Å; T306-E348 WeakPolarHBondContact CG2-OE1 3.43Å; T306-E348 PolarHBondContact OG1-OE1 3.12Å; E348-C350 PolarHBondContact O-N 3.49Å; E348-R351 WeakPolarHBondContact O-CG 3.21Å; E348-R351 PolarHBondContact O-N 3.36Å
349	G	83.5	Confident	89.9	Confident	56 Å²	56	36.2 Å²	36.2	58%	0.577	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-43.5	-173.5	0	0	0	0	0	114.2	Q347	Q347-G349 PolarHBondContact O-N 3.25Å
350	C	86.1	Confident	90.5	Very high	27 Å²	27	35.1 Å²	35.1	18%	0.182	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-7.5	177.2	-52.8	0	0	0	0	112.9	E348 Y352 K409 M410	E348-C350 PolarHBondContact O-N 3.49Å; C350-Y352 HydrophobicContact CB-CD1 3.68Å; C350-Y352 HydrophobicContact CB-CD2 4.3Å; C350-Y352 HydrophobicContact CB-CE1 3.27Å; C350-Y352 HydrophobicContact CB-CE2 3.97Å; C350-Y352 HydrophobicContact CB-CG 4.17Å; C350-Y352 VanDerWaalsContact CB-CZ 3.45Å; C350-K409 WeakPolarHBondContact O-CB 3.34Å; C350-K409 PolarHBondContact O-N 2.84Å; C350-K409 VanDerWaalsContact O-N 3.12Å; C350-M410 HydrophobicContact CB-CG 4.44Å
351	R	89.2	Confident	91.1	Very high	143 Å²	143	36.1 Å²	36.1	54%	0.54	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	38	-173.3	-59	-175.6	69.9	97.6	-7.9	114.7	I345 Q347 E348 N353 K409	I345-R351 HydrophobicContact CD1-CB 4.03Å; I345-R351 HydrophobicContact CD1-CG 4.15Å; I345-R351 VanDerWaalsContact CD1-CZ 3.42Å; Q347-R351 WeakPolarHBondContact O-CA 3.35Å; Q347-R351 PolarHBondContact O-N 3.34Å; E348-R351 WeakPolarHBondContact O-CG 3.21Å; E348-R351 PolarHBondContact O-N 3.36Å; R351-N353 PolarHBondContact O-N 3.38Å; R351-K409 HydrophobicContact CB-CB 4.32Å; R351-K409 HydrophobicContact CG-CB 4.3Å; R351-K409 HydrophobicContact CG-CD 4.14Å
352	Y	93	Very high	91.5	Very high	31 Å²	31	37.4 Å²	37.4	12%	0.122	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-68.5	130.7	175.2	-59.1	-21.9	0	0	0	111.3	I345 V346 Q347 C350 H356 V357 D408 F418	I345-Y352 CarbonylContact C-O 3.5Å; I345-Y352 WeakPolarHBondContact CA-O 3.35Å; V346-Y352 WeakPolarHBondContact CG2-O 3.43Å; V346-Y352 PolarHBondContact N-O 2.73Å; Q347-Y352 HydrophobicContact CB-CD2 4.09Å; Q347-Y352 HydrophobicContact CB-CG 4.44Å; Q347-Y352 HydrophobicContact CG-CD2 4.31Å; Q347-Y352 PolarHBondContact N-O 3.49Å; Q347-Y352 PolarHBondContact O-N 2.91Å; C350-Y352 HydrophobicContact CB-CD1 3.68Å; C350-Y352 HydrophobicContact CB-CD2 4.3Å; C350-Y352 HydrophobicContact CB-CE1 3.27Å; C350-Y352 HydrophobicContact CB-CE2 3.97Å; C350-Y352 HydrophobicContact CB-CG 4.17Å; C350-Y352 VanDerWaalsContact CB-CZ 3.45Å; Y352-H356 HydrophobicContact CD1-CB 4.14Å; Y352-H356 HydrophobicContact CG-CB 4.02Å; Y352-V357 HydrophobicContact CD2-CG2 4.46Å; Y352-D408 HydrophobicContact CD1-CB 4.21Å; Y352-D408 HydrophobicContact CE1-CB 3.96Å; Y352-F418 HydrophobicContact CD1-CZ 4.21Å; Y352-F418 AromaticContact CE1-CE1 3.93Å; Y352-F418 HydrophobicContact CE1-CE1 3.93Å; Y352-F418 HydrophobicContact CE1-CE2 4.28Å; Y352-F418 AromaticContact CE1-CZ 3.4Å; Y352-F418 HydrophobicContact CE1-CZ 3.4Å; Y352-F418 HydrophobicContact CE2-CE1 4.34Å; Y352-F418 AromaticContact CZ-CE1 3.78Å; Y352-F418 AromaticContact CZ-CZ 3.62Å
353	N	93.4	Very high	91.8	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.027	18%	0.18	C	C	.	.			trans	-82.5	-179.6	162.2	73.6	9.9	0	0	0	110.3	P343 R351 M355 H356 Y403	P343-N353 HydrophobicContact CB-CB 4.02Å; R351-N353 PolarHBondContact O-N 3.38Å; N353-M355 VanDerWaalsContact C-N 3.34Å; N353-M355 PolarHBondContact O-N 2.97Å; N353-M355 PolarHBondContact OD1-N 3.04Å; N353-H356 PolarHBondContact O-N 2.68Å; N353-H356 PolarHBondContact OD1-N 2.68Å; N353-H356 PolarHBondContact OD1-ND1 3.16Å; N353-Y403 HydrophobicContact CB-CD1 4.24Å; N353-Y403 HydrophobicContact CB-CE1 3.94Å; N353-Y403 PolarHBondContact ND2-O 2.95Å
354	V	94.3	Very high	91.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-55	-45.5	177.4	171.8	0	0	0	0	112.4	L313 V317 F325 L336 V346 H356 V357 A358 I366 T370 Y403	L313-V354 HydrophobicContact CD2-CG2 4.16Å; V317-V354 HydrophobicContact CG1-CG1 4.19Å; V317-V354 HydrophobicContact CG2-CG1 3.79Å; F325-V354 HydrophobicContact CE2-CG1 3.94Å; F325-V354 HydrophobicContact CE2-CG2 4.43Å; F325-V354 HydrophobicContact CZ-CG1 4.02Å; L336-V354 HydrophobicContact CD2-CG2 4.01Å; V346-V354 HydrophobicContact CG1-CG2 4.07Å; V354-H356 PolarHBondContact O-N 3.46Å; V354-V357 PolarHBondContact O-N 3.24Å; V354-A358 PolarHBondContact O-N 2.87Å; V354-I366 HydrophobicContact CG1-CG2 4.24Å; V354-T370 HydrophobicContact CG1-CG2 4.48Å; V354-Y403 HydrophobicContact CB-CE1 4.11Å; V354-Y403 HydrophobicContact CG2-CE1 4.49Å
355	M	95.1	Very high	92	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-36.5	-175.3	-62.8	-64	-110.5	0	0	113	N353 V357 A359 C367 T370 L371 Y403 L404 P415 L431	N353-M355 VanDerWaalsContact C-N 3.34Å; N353-M355 PolarHBondContact O-N 2.97Å; N353-M355 PolarHBondContact OD1-N 3.04Å; M355-V357 VanDerWaalsContact C-N 3.31Å; M355-V357 PolarHBondContact O-N 3.21Å; M355-A359 WeakPolarHBondContact O-CB 3.48Å; M355-A359 PolarHBondContact O-N 3.45Å; M355-C367 HydrophobicContact CE-CB 4.27Å; M355-C367 HydrophobicContact SD-CB 4.14Å; M355-T370 HydrophobicContact SD-CG2 4.17Å; M355-L371 HydrophobicContact CE-CD1 3.94Å; M355-L371 HydrophobicContact CE-CD2 3.93Å; M355-L371 HydrophobicContact CE-CG 3.72Å; M355-Y403 HydrophobicContact CG-CD1 3.82Å; M355-L404 HydrophobicContact CE-CD2 3.9Å; M355-P415 HydrophobicContact CB-CB 4.03Å; M355-P415 HydrophobicContact CB-CG 4.07Å; M355-L431 HydrophobicContact CE-CD2 3.81Å
356	H	95.1	Very high	92.2	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-37.8	173	-72	81.7	0	0	0	112.5	Y352 N353 V354 K360 T406 D408 D413 F418	Y352-H356 HydrophobicContact CD1-CB 4.14Å; Y352-H356 HydrophobicContact CG-CB 4.02Å; N353-H356 PolarHBondContact O-N 2.68Å; N353-H356 PolarHBondContact OD1-N 2.68Å; N353-H356 PolarHBondContact OD1-ND1 3.16Å; V354-H356 PolarHBondContact O-N 3.46Å; H356-K360 WeakPolarHBondContact O-CB 3.39Å; H356-K360 PolarHBondContact O-N 3.46Å; H356-K360 VanDerWaalsContact O-N 3.17Å; H356-T406 PolarHBondContact CE1-O 3.21Å; H356-D408 PolarHBondContact NE2-N 2.94Å; H356-D413 PolarHBondContact NE2-O 3.34Å; H356-F418 AromaticContact CD2-CD2 3.74Å; H356-F418 AromaticContact CD2-CE2 3.67Å
357	V	94.9	Very high	92.4	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-75.6	-44.7	-179.8	180	0	0	0	0	110.6	R314 V317 E318 V346 Y352 V354 M355 A359 K360 E361	R314-V357 HydrophobicContact CG-CG1 4.18Å; V317-V357 HydrophobicContact CB-CG1 4.47Å; V317-V357 HydrophobicContact CG1-CB 4.04Å; V317-V357 HydrophobicContact CG1-CG1 3.85Å; E318-V357 HydrophobicContact CG-CG1 3.4Å; E318-V357 VanDerWaalsContact CG-CG1 3.4Å; V346-V357 HydrophobicContact CG2-CG2 3.59Å; Y352-V357 HydrophobicContact CD2-CG2 4.46Å; V354-V357 PolarHBondContact O-N 3.24Å; M355-V357 VanDerWaalsContact C-N 3.31Å; M355-V357 PolarHBondContact O-N 3.21Å; V357-A359 VanDerWaalsContact C-N 3.34Å; V357-A359 PolarHBondContact O-N 3.11Å; V357-K360 WeakPolarHBondContact O-CB 3.19Å; V357-K360 PolarHBondContact O-N 3.34Å; V357-K360 VanDerWaalsContact O-N 3.14Å; V357-E361 PolarHBondContact O-N 3.31Å
358	A	95.8	Very high	92.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.9	-41	175.6	0	0	0	0	0	111.9	V317 V354 K360 E361 N362 Q363 C367	V317-A358 HydrophobicContact CG1-CB 3.93Å; V354-A358 PolarHBondContact O-N 2.87Å; A358-K360 VanDerWaalsContact C-N 3.32Å; A358-K360 PolarHBondContact O-N 3.33Å; A358-E361 PolarHBondContact O-N 2.88Å; A358-N362 PolarHBondContact O-N 3.34Å; A358-Q363 HydrophobicContact CB-CB 4.17Å; A358-Q363 PolarHBondContact O-N 3.19Å; A358-C367 WeakPolarHBondContact CB-SG 3.45Å
359	A	95.3	Very high	93.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-32.2	173.2	0	0	0	0	0	113.9	M355 V357 F418 A419 S424 V427	M355-A359 WeakPolarHBondContact O-CB 3.48Å; M355-A359 PolarHBondContact O-N 3.45Å; V357-A359 VanDerWaalsContact C-N 3.34Å; V357-A359 PolarHBondContact O-N 3.11Å; A359-F418 HydrophobicContact CB-CB 3.92Å; A359-A419 HydrophobicContact CB-CB 3.98Å; A359-S424 VanDerWaalsContact O-CB 3.29Å; A359-S424 WeakPolarHBondContact O-CB 3.31Å; A359-S424 PolarHBondContact O-OG 3.29Å; A359-V427 HydrophobicContact CB-CG1 3.96Å
360	K	93.1	Very high	93.8	Very high	64 Å²	64	27.7 Å²	27.7	28%	0.278	13%	0.132	S	C	.	.	H	α-helix	trans	-72.4	-33.7	177.3	176.4	174.6	162	-74.8	0	113.3	H356 V357 A358 F418 F422	H356-K360 WeakPolarHBondContact O-CB 3.39Å; H356-K360 PolarHBondContact O-N 3.46Å; H356-K360 VanDerWaalsContact O-N 3.17Å; V357-K360 WeakPolarHBondContact O-CB 3.19Å; V357-K360 PolarHBondContact O-N 3.34Å; V357-K360 VanDerWaalsContact O-N 3.14Å; A358-K360 VanDerWaalsContact C-N 3.32Å; A358-K360 PolarHBondContact O-N 3.33Å; K360-F418 HydrophobicContact CB-CD1 4.35Å; K360-F422 HydrophobicContact CB-CD2 4.16Å; K360-F422 HydrophobicContact CB-CE2 4.19Å; K360-F422 HydrophobicContact CD-CE2 4.37Å; K360-F422 HydrophobicContact CD-CZ 4.33Å; K360-F422 HydrophobicContact CG-CD2 4.14Å; K360-F422 HydrophobicContact CG-CE1 4.43Å; K360-F422 HydrophobicContact CG-CE2 3.91Å; K360-F422 HydrophobicContact CG-CZ 4.06Å
361	E	93.3	Very high	94.2	Very high	78 Å²	78	26.8 Å²	26.8	36%	0.364	13%	0.125	S	C	.	.	H	α-helix	trans	-103.6	7.9	-178.6	-56.2	-54.8	148.6	0	0	114.1	E318 V357 A358 Q363	E318-E361 HydrophobicContact CB-CG 4.32Å; E318-E361 HydrophobicContact CG-CG 4.2Å; V357-E361 PolarHBondContact O-N 3.31Å; A358-E361 PolarHBondContact O-N 2.88Å; E361-Q363 HydrophobicContact CB-CG 3.82Å
362	N	93.8	Very high	94.5	Very high	54 Å²	54	23.7 Å²	23.7	29%	0.289	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	41.3	-175.4	-164.9	48.5	0	0	0	115.1	A358 A364 S424 D426 V427	A358-N362 PolarHBondContact O-N 3.34Å; N362-A364 PolarHBondContact O-N 3.34Å; N362-A364 VanDerWaalsContact O-N 3.17Å; N362-S424 WeakPolarHBondContact OD1-CA 3.37Å; N362-S424 VanDerWaalsContact OD1-CB 3.23Å; N362-S424 WeakPolarHBondContact OD1-CB 3.32Å; N362-S424 PolarHBondContact OD1-O 3.02Å; N362-D426 PolarHBondContact ND2-OD2 2.83Å; N362-V427 PolarHBondContact OD1-N 2.96Å
363	Q	95.3	Very high	94.6	Very high	41 Å²	41	22.5 Å²	22.5	19%	0.192	12%	0.115	C	C	.	.			trans	-92.6	68.2	-174.1	-61.9	-73.4	9.7	0	0	111.8	V317 E318 K319 A358 E361 S365 I366 C367	V317-Q363 WeakPolarHBondContact O-CG 3.39Å; E318-Q363 PolarHBondContact O-NE2 3.47Å; K319-Q363 PolarHBondContact O-NE2 2.77Å; A358-Q363 HydrophobicContact CB-CB 4.17Å; A358-Q363 PolarHBondContact O-N 3.19Å; E361-Q363 HydrophobicContact CB-CG 3.82Å; Q363-S365 PolarHBondContact O-N 2.99Å; Q363-I366 HydrophobicContact CB-CB 4.36Å; Q363-I366 HydrophobicContact CB-CG1 4.24Å; Q363-I366 PolarHBondContact O-N 2.96Å; Q363-C367 PolarHBondContact O-N 3.28Å
364	A	94.3	Very high	94.6	Very high	12 Å²	12	22.2 Å²	22.2	10%	0.099	11%	0.114	C	C	.	.	H	α-helix	trans	-61.9	-33.3	-171.8	0	0	0	0	0	114.7	N362 C367 R368 D426 V427 V430	N362-A364 PolarHBondContact O-N 3.34Å; N362-A364 VanDerWaalsContact O-N 3.17Å; A364-C367 PolarHBondContact O-N 3.37Å; A364-R368 PolarHBondContact O-N 3.13Å; A364-R368 VanDerWaalsContact O-N 3.11Å; A364-R368 PolarHBondContact O-NH1 3.43Å; A364-D426 HydrophobicContact CB-CB 3.7Å; A364-V427 HydrophobicContact CB-CG2 4.12Å; A364-V430 HydrophobicContact CB-CG2 4.24Å
365	S	93.9	Very high	94.5	Very high	45 Å²	45	25.9 Å²	25.9	32%	0.315	13%	0.131	S	C	.	.	H	α-helix	trans	-62.1	-44.8	174.2	-49.7	0	0	0	0	112	E322 Q363 C367 R368 L369	E322-S365 WeakPolarHBondContact OE1-CB 3.44Å; E322-S365 PolarHBondContact OE1-OG 3.35Å; Q363-S365 PolarHBondContact O-N 2.99Å; S365-C367 VanDerWaalsContact C-N 3.27Å; S365-C367 PolarHBondContact O-N 2.88Å; S365-R368 PolarHBondContact O-N 3.27Å; S365-L369 VanDerWaalsContact O-CB 3.31Å; S365-L369 WeakPolarHBondContact O-CB 3.43Å; S365-L369 PolarHBondContact O-N 3.2Å
366	I	95.1	Very high	94.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.9	-34.4	179.1	-56.2	-64.1	0	0	0	110.5	V317 E322 F325 V354 Q363 T370	V317-I366 HydrophobicContact CB-CG2 4.44Å; V317-I366 HydrophobicContact CG1-CG2 4.13Å; V317-I366 HydrophobicContact CG2-CG2 4.05Å; E322-I366 HydrophobicContact CB-CD1 4.46Å; E322-I366 HydrophobicContact CG-CD1 3.91Å; F325-I366 HydrophobicContact CB-CD1 4.12Å; F325-I366 HydrophobicContact CD1-CD1 4.4Å; F325-I366 HydrophobicContact CD1-CG2 4.41Å; F325-I366 HydrophobicContact CD2-CG2 4.22Å; F325-I366 HydrophobicContact CE1-CG2 4.21Å; F325-I366 HydrophobicContact CE2-CG2 4.03Å; F325-I366 HydrophobicContact CG-CD1 4.19Å; F325-I366 HydrophobicContact CG-CG2 4.41Å; F325-I366 HydrophobicContact CZ-CG2 4.02Å; V354-I366 HydrophobicContact CG1-CG2 4.24Å; Q363-I366 HydrophobicContact CB-CB 4.36Å; Q363-I366 HydrophobicContact CB-CG1 4.24Å; Q363-I366 PolarHBondContact O-N 2.96Å; I366-T370 VanDerWaalsContact O-CB 3.29Å; I366-T370 WeakPolarHBondContact O-CB 3.21Å; I366-T370 PolarHBondContact O-N 3.24Å; I366-T370 PolarHBondContact O-OG1 3.31Å
367	C	95.6	Very high	94.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.6	-45.2	172.4	-67.9	0	0	0	0	112.8	M355 A358 Q363 A364 S365 L371 V427 V430	M355-C367 HydrophobicContact CE-CB 4.27Å; M355-C367 HydrophobicContact SD-CB 4.14Å; A358-C367 WeakPolarHBondContact CB-SG 3.45Å; Q363-C367 PolarHBondContact O-N 3.28Å; A364-C367 PolarHBondContact O-N 3.37Å; S365-C367 VanDerWaalsContact C-N 3.27Å; S365-C367 PolarHBondContact O-N 2.88Å; C367-L371 WeakPolarHBondContact O-CG 3.38Å; C367-L371 PolarHBondContact O-N 3.06Å; C367-V427 VanDerWaalsContact SG-CG1 3.59Å; C367-V430 HydrophobicContact CB-CG1 3.92Å
368	R	93.9	Very high	94.2	Very high	44 Å²	44	34.3 Å²	34.3	17%	0.166	18%	0.178	C	C	.	.	H	α-helix	trans	-60.8	-58.5	174.4	-67.3	-173.5	-170.3	80.8	-3.8	110.2	A364 S365 T370 L371 D372 V430 H725	A364-R368 PolarHBondContact O-N 3.13Å; A364-R368 VanDerWaalsContact O-N 3.11Å; A364-R368 PolarHBondContact O-NH1 3.43Å; S365-R368 PolarHBondContact O-N 3.27Å; R368-T370 PolarHBondContact O-N 2.87Å; R368-L371 CarbonylContact O-C 3.59Å; R368-L371 WeakPolarHBondContact O-CA 3.45Å; R368-L371 WeakPolarHBondContact O-CB 3.32Å; R368-L371 PolarHBondContact O-N 2.98Å; R368-D372 VanDerWaalsContact C-CG 3.46Å; R368-D372 PolarHBondContact O-N 3.05Å; R368-D372 VanDerWaalsContact O-OD1 3.04Å; R368-V430 HydrophobicContact CG-CB 4.46Å; R368-V430 HydrophobicContact CG-CG1 3.79Å; R368-V430 HydrophobicContact CG-CG2 3.73Å; R368-V430 VanDerWaalsContact CZ-CG2 3.47Å; R368-H725 PolarHBondContact NH2-O 3.11Å
369	L	95.1	Very high	94.1	Very high	34 Å²	34	34.3 Å²	34.3	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-54.9	-29.8	-179.4	-179.3	60.5	0	0	0	114.1	E322 F325 S365 D372 V373	E322-L369 HydrophobicContact CB-CD2 4.35Å; F325-L369 HydrophobicContact CD1-CD2 3.69Å; F325-L369 HydrophobicContact CD1-CG 4.07Å; F325-L369 HydrophobicContact CE1-CD2 4.32Å; F325-L369 HydrophobicContact CE1-CG 4.23Å; S365-L369 VanDerWaalsContact O-CB 3.31Å; S365-L369 WeakPolarHBondContact O-CB 3.43Å; S365-L369 PolarHBondContact O-N 3.2Å; L369-D372 PolarHBondContact N-OD2 3.33Å; L369-V373 HydrophobicContact CD1-CG2 4.09Å; L369-V373 WeakPolarHBondContact O-CB 3.28Å; L369-V373 WeakPolarHBondContact O-CG2 3.38Å; L369-V373 PolarHBondContact O-N 3.18Å
370	T	95.3	Very high	93.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-71.8	-38.2	173.2	-57.8	0	0	0	0	112	F325 L336 V354 M355 I366 R368 L374 Y403	F325-T370 VanDerWaalsContact CZ-OG1 3.29Å; F325-T370 WeakPolarHBondContact CZ-OG1 3.35Å; L336-T370 HydrophobicContact CD2-CG2 4.43Å; V354-T370 HydrophobicContact CG1-CG2 4.48Å; M355-T370 HydrophobicContact SD-CG2 4.17Å; I366-T370 VanDerWaalsContact O-CB 3.29Å; I366-T370 WeakPolarHBondContact O-CB 3.21Å; I366-T370 PolarHBondContact O-N 3.24Å; I366-T370 PolarHBondContact O-OG1 3.31Å; R368-T370 PolarHBondContact O-N 2.87Å; T370-L374 HydrophobicContact CG2-CD1 3.98Å; T370-L374 WeakPolarHBondContact O-CB 3.44Å; T370-L374 WeakPolarHBondContact O-CD1 3.38Å; T370-L374 WeakPolarHBondContact O-CG 3.43Å; T370-L374 PolarHBondContact O-N 3.29Å; T370-Y403 HydrophobicContact CG2-CD1 4.48Å; T370-Y403 HydrophobicContact CG2-CE1 4.44Å
371	L	94.6	Very high	93.8	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-72	-52.6	175.2	-67.5	170.8	0	0	0	110.6	M355 C367 R368 V373 L374 E375 V400 L404 V430 H434	M355-L371 HydrophobicContact CE-CD1 3.94Å; M355-L371 HydrophobicContact CE-CD2 3.93Å; M355-L371 HydrophobicContact CE-CG 3.72Å; C367-L371 WeakPolarHBondContact O-CG 3.38Å; C367-L371 PolarHBondContact O-N 3.06Å; R368-L371 CarbonylContact O-C 3.59Å; R368-L371 WeakPolarHBondContact O-CA 3.45Å; R368-L371 WeakPolarHBondContact O-CB 3.32Å; R368-L371 PolarHBondContact O-N 2.98Å; L371-V373 PolarHBondContact O-N 3.32Å; L371-L374 PolarHBondContact O-N 3.45Å; L371-E375 WeakPolarHBondContact O-CB 3.46Å; L371-E375 WeakPolarHBondContact O-CG 3.15Å; L371-E375 PolarHBondContact O-N 2.78Å; L371-V400 HydrophobicContact CD2-CG1 3.85Å; L371-L404 HydrophobicContact CD1-CD2 4.41Å; L371-L404 HydrophobicContact CD2-CD1 4.23Å; L371-L404 HydrophobicContact CD2-CD2 4.02Å; L371-L404 HydrophobicContact CD2-CG 4.18Å; L371-V430 HydrophobicContact CD1-CG1 4.4Å; L371-H434 HydrophobicContact CD1-CB 4.42Å
372	D	93.6	Very high	93.7	Very high	77 Å²	77	35.1 Å²	35.1	41%	0.412	18%	0.18	S	C	.	.	H	α-helix	trans	-49.4	-37.5	178.6	-50	-17.8	0	0	0	112.2	R368 L369 N376	R368-D372 VanDerWaalsContact C-CG 3.46Å; R368-D372 PolarHBondContact O-N 3.05Å; R368-D372 VanDerWaalsContact O-OD1 3.04Å; L369-D372 PolarHBondContact N-OD2 3.33Å; D372-N376 WeakPolarHBondContact O-CB 3.36Å; D372-N376 PolarHBondContact O-N 3.29Å
373	V	95.1	Very high	93.4	Very high	6 Å²	6	32.8 Å²	32.8	4%	0.036	17%	0.168	C	C	.	.	H	α-helix	trans	-84.1	-32.2	179.3	173.4	0	0	0	0	113.2	I329 W330 L336 L369 L371 F379	I329-V373 HydrophobicContact CD1-CB 4.24Å; I329-V373 HydrophobicContact CD1-CG1 3.95Å; I329-V373 HydrophobicContact CD1-CG2 4.02Å; I329-V373 HydrophobicContact CG1-CG1 4.44Å; W330-V373 HydrophobicContact CZ2-CG1 4.27Å; W330-V373 HydrophobicContact CZ2-CG2 4.2Å; L336-V373 HydrophobicContact CD1-CG1 4.38Å; L369-V373 HydrophobicContact CD1-CG2 4.09Å; L369-V373 WeakPolarHBondContact O-CB 3.28Å; L369-V373 WeakPolarHBondContact O-CG2 3.38Å; L369-V373 PolarHBondContact O-N 3.18Å; L371-V373 PolarHBondContact O-N 3.32Å; V373-F379 HydrophobicContact CG1-CB 4.22Å; V373-F379 HydrophobicContact CG1-CD1 3.68Å; V373-F379 HydrophobicContact CG1-CD2 3.47Å; V373-F379 VanDerWaalsContact CG1-CD2 3.47Å; V373-F379 HydrophobicContact CG1-CE1 3.8Å; V373-F379 HydrophobicContact CG1-CE2 3.59Å; V373-F379 HydrophobicContact CG1-CG 3.51Å; V373-F379 HydrophobicContact CG1-CZ 3.75Å; V373-F379 WeakPolarHBondContact O-CB 3.14Å; V373-F379 WeakPolarHBondContact O-CD1 3.43Å; V373-F379 WeakPolarHBondContact O-CG 3.21Å
374	L	93.8	Very high	93.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-78.6	-27.6	176.6	-72.3	173	0	0	0	113.2	L336 I337 T370 L371 F379 V399 V400 Y403	L336-L374 HydrophobicContact CB-CD2 4.21Å; L336-L374 HydrophobicContact CD1-CD2 4.1Å; L336-L374 HydrophobicContact CD1-CG 4.2Å; I337-L374 HydrophobicContact CD1-CD2 4.36Å; I337-L374 HydrophobicContact CG1-CD2 4.19Å; T370-L374 HydrophobicContact CG2-CD1 3.98Å; T370-L374 WeakPolarHBondContact O-CB 3.44Å; T370-L374 WeakPolarHBondContact O-CD1 3.38Å; T370-L374 WeakPolarHBondContact O-CG 3.43Å; T370-L374 PolarHBondContact O-N 3.29Å; L371-L374 PolarHBondContact O-N 3.45Å; L374-F379 HydrophobicContact CD2-CE1 4.33Å; L374-V399 HydrophobicContact CD2-CG1 3.94Å; L374-V400 HydrophobicContact CB-CG2 3.77Å; L374-Y403 HydrophobicContact CD1-CD2 3.39Å; L374-Y403 HydrophobicContact CD1-CE2 3.77Å; L374-Y403 HydrophobicContact CD1-CG 3.81Å
375	E	93.6	Very high	92.8	Very high	77 Å²	77	34.3 Å²	34.3	36%	0.36	18%	0.179	S	C	.	.	H	α-helix	trans	-79.9	-20.2	173.9	-68.1	177.9	-123.9	0	0	112.3	L371 P377 V400 H434	L371-E375 WeakPolarHBondContact O-CB 3.46Å; L371-E375 WeakPolarHBondContact O-CG 3.15Å; L371-E375 PolarHBondContact O-N 2.78Å; E375-P377 WeakPolarHBondContact O-CD 3.39Å; E375-V400 HydrophobicContact CG-CG2 4Å; E375-H434 IonicContact OE1-CD2 2.71Å; E375-H434 PolarHBondContact OE1-CD2 3.11Å; E375-H434 VanDerWaalsContact OE1-CD2 3.32Å; E375-H434 IonicContact OE1-NE2 3.77Å; E375-H434 PolarHBondContact OE1-NE2 2.71Å
376	N	93.4	Very high	92.4	Very high	51 Å²	51	37.3 Å²	37.3	27%	0.273	19%	0.191	S	C	.	.			trans	-68.8	117.2	178.6	-174.2	-36	0	0	0	111.7	D372 D378 F379 M380	D372-N376 WeakPolarHBondContact O-CB 3.36Å; D372-N376 PolarHBondContact O-N 3.29Å; N376-D378 VanDerWaalsContact C-N 3.3Å; N376-D378 PolarHBondContact O-N 3.38Å; N376-D378 WeakPolarHBondContact OD1-CB 3.29Å; N376-D378 PolarHBondContact OD1-N 3Å; N376-F379 HydrophobicContact CB-CB 4.17Å; N376-F379 PolarHBondContact O-N 3Å; N376-F379 PolarHBondContact OD1-N 2.87Å; N376-M380 PolarHBondContact O-N 2.96Å
377	P	92.8	Very high	92.1	Very high	38 Å²	38	39 Å²	39	25%	0.247	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-29.9	-178.1	27.7	-34.8	0	0	0	112.9	E375 M380 R381 L392 I396	E375-P377 WeakPolarHBondContact O-CD 3.39Å; P377-M380 PolarHBondContact O-N 2.89Å; P377-R381 WeakPolarHBondContact O-CB 3.43Å; P377-R381 VanDerWaalsContact O-CG 3.22Å; P377-R381 WeakPolarHBondContact O-CG 3.4Å; P377-R381 PolarHBondContact O-N 3.19Å; P377-L392 HydrophobicContact CB-CD2 3.89Å; P377-I396 HydrophobicContact CB-CD1 4.38Å
378	D	91.8	Very high	91.9	Very high	92 Å²	92	44.2 Å²	44.2	49%	0.492	23%	0.228	S	C	.	.	H	α-helix	trans	-73.8	-31.7	179.2	-67.4	-40.4	0	0	0	112.4	N376 R381	N376-D378 VanDerWaalsContact C-N 3.3Å; N376-D378 PolarHBondContact O-N 3.38Å; N376-D378 WeakPolarHBondContact OD1-CB 3.29Å; N376-D378 PolarHBondContact OD1-N 3Å; D378-R381 IonicContact OD1-CZ 3.68Å; D378-R381 IonicContact OD1-NH1 3.96Å; D378-R381 PolarHBondContact OD1-NH1 3.43Å
379	F	92.9	Very high	91.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-44.9	168.3	-179.8	-100.5	0	0	0	111	W330 P333 L336 I337 V373 L374 N376 R381 L382	W330-F379 HydrophobicContact CD2-CD2 4.05Å; W330-F379 AromaticContact CE3-CD2 3.86Å; W330-F379 HydrophobicContact CE3-CD2 3.86Å; W330-F379 HydrophobicContact CH2-CB 3.72Å; W330-F379 HydrophobicContact CH2-CD2 4.03Å; W330-F379 HydrophobicContact CH2-CG 4.35Å; W330-F379 HydrophobicContact CZ2-CB 4.3Å; W330-F379 HydrophobicContact CZ2-CD2 4.19Å; W330-F379 HydrophobicContact CZ3-CB 4.03Å; W330-F379 AromaticContact CZ3-CD2 3.85Å; W330-F379 HydrophobicContact CZ3-CD2 3.85Å; W330-F379 HydrophobicContact CZ3-CG 4.45Å; P333-F379 HydrophobicContact CB-CE1 4.1Å; P333-F379 HydrophobicContact CB-CE2 3.84Å; P333-F379 HydrophobicContact CB-CZ 3.53Å; L336-F379 HydrophobicContact CD1-CE1 4.37Å; L336-F379 HydrophobicContact CD1-CZ 4.21Å; I337-F379 HydrophobicContact CD1-CE1 4.07Å; V373-F379 HydrophobicContact CG1-CB 4.22Å; V373-F379 HydrophobicContact CG1-CD1 3.68Å; V373-F379 HydrophobicContact CG1-CD2 3.47Å; V373-F379 VanDerWaalsContact CG1-CD2 3.47Å; V373-F379 HydrophobicContact CG1-CE1 3.8Å; V373-F379 HydrophobicContact CG1-CE2 3.59Å; V373-F379 HydrophobicContact CG1-CG 3.51Å; V373-F379 HydrophobicContact CG1-CZ 3.75Å; V373-F379 WeakPolarHBondContact O-CB 3.14Å; V373-F379 WeakPolarHBondContact O-CD1 3.43Å; V373-F379 WeakPolarHBondContact O-CG 3.21Å; L374-F379 HydrophobicContact CD2-CE1 4.33Å; N376-F379 HydrophobicContact CB-CB 4.17Å; N376-F379 PolarHBondContact O-N 3Å; N376-F379 PolarHBondContact OD1-N 2.87Å; F379-R381 VanDerWaalsContact C-N 3.34Å; F379-R381 PolarHBondContact O-N 2.9Å; F379-L382 HydrophobicContact CD2-CD1 4.17Å; F379-L382 VanDerWaalsContact O-CB 3.23Å; F379-L382 WeakPolarHBondContact O-CB 3.26Å; F379-L382 WeakPolarHBondContact O-CG 3.47Å; F379-L382 PolarHBondContact O-N 3.18Å; F379-L382 VanDerWaalsContact O-N 3.11Å
380	M	92.1	Very high	91.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.6	-34.3	179.9	-71.1	-72.2	-71.4	0	0	112.4	I337 N376 P377 L382 M383 Y384 L392 R395 I396 V399	I337-M380 HydrophobicContact CD1-CE 4.38Å; I337-M380 HydrophobicContact CD1-SD 3.4Å; I337-M380 WeakPolarHBondContact CD1-SD 3.43Å; N376-M380 PolarHBondContact O-N 2.96Å; P377-M380 PolarHBondContact O-N 2.89Å; M380-L382 PolarHBondContact O-N 3.33Å; M380-M383 CarbonylContact O-C 3.58Å; M380-M383 WeakPolarHBondContact O-CA 3.24Å; M380-M383 PolarHBondContact O-N 3.49Å; M380-Y384 HydrophobicContact CE-CD2 4.05Å; M380-Y384 HydrophobicContact CE-CE2 3.76Å; M380-Y384 VanDerWaalsContact O-CD2 3.26Å; M380-Y384 WeakPolarHBondContact O-CD2 3.33Å; M380-Y384 PolarHBondContact O-N 2.75Å; M380-Y384 HydrophobicContact SD-CE2 4.4Å; M380-L392 HydrophobicContact CB-CD1 3.78Å; M380-L392 HydrophobicContact CB-CG 4.45Å; M380-R395 HydrophobicContact CE-CB 4.39Å; M380-R395 HydrophobicContact CE-CG 4.42Å; M380-I396 HydrophobicContact CB-CG1 4.29Å; M380-I396 HydrophobicContact CE-CG1 4.1Å; M380-I396 HydrophobicContact CG-CD1 4.41Å; M380-I396 HydrophobicContact CG-CG1 3.73Å; M380-V399 HydrophobicContact CE-CG2 4.32Å
381	R	91.3	Very high	91.4	Very high	102 Å²	102	52 Å²	52	39%	0.385	28%	0.278	S	S	.	.	H	α-helix	trans	-61.6	-20.4	171.7	-74.5	164.5	-173.4	163.2	-2.2	113.8	P377 D378 F379 M383 Y384 P385 E389 L392	P377-R381 WeakPolarHBondContact O-CB 3.43Å; P377-R381 VanDerWaalsContact O-CG 3.22Å; P377-R381 WeakPolarHBondContact O-CG 3.4Å; P377-R381 PolarHBondContact O-N 3.19Å; D378-R381 IonicContact OD1-CZ 3.68Å; D378-R381 IonicContact OD1-NH1 3.96Å; D378-R381 PolarHBondContact OD1-NH1 3.43Å; F379-R381 VanDerWaalsContact C-N 3.34Å; F379-R381 PolarHBondContact O-N 2.9Å; R381-M383 PolarHBondContact O-N 3.03Å; R381-Y384 CarbonylContact O-C 3.54Å; R381-Y384 PolarHBondContact O-N 2.97Å; R381-P385 WeakPolarHBondContact O-CA 3.45Å; R381-E389 IonicContact CZ-OE2 2.74Å; R381-E389 IonicContact NE-OE2 2.82Å; R381-E389 IonicContact NH2-OE2 3.87Å; R381-E389 PolarHBondContact NH2-OE2 2.92Å; R381-L392 HydrophobicContact CG-CD1 4.46Å; R381-L392 HydrophobicContact CG-CD2 3.83Å
382	L	90.6	Very high	91.4	Very high	56 Å²	56	51.6 Å²	51.6	29%	0.293	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-24.4	169.5	-55	176.6	0	0	0	112.4	Y301 W330 P333 F379 M380	Y301-L382 HydrophobicContact CE2-CB 4.14Å; Y301-L382 VanDerWaalsContact CE2-O 3.29Å; Y301-L382 WeakPolarHBondContact CE2-O 3.49Å; W330-L382 HydrophobicContact CE3-CD1 4.18Å; W330-L382 HydrophobicContact CZ3-CD1 4.26Å; P333-L382 HydrophobicContact CG-CB 4.01Å; F379-L382 HydrophobicContact CD2-CD1 4.17Å; F379-L382 VanDerWaalsContact O-CB 3.23Å; F379-L382 WeakPolarHBondContact O-CB 3.26Å; F379-L382 WeakPolarHBondContact O-CG 3.47Å; F379-L382 PolarHBondContact O-N 3.18Å; F379-L382 VanDerWaalsContact O-N 3.11Å; M380-L382 PolarHBondContact O-N 3.33Å
383	M	87.8	Confident	91.3	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.03	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-17	175.7	-78.3	-70.5	-69.3	0	0	113.5	N299 P333 R334 I337 M380 R381	N299-M383 HydrophobicContact CB-SD 4.41Å; N299-M383 WeakPolarHBondContact ND2-CA 3.46Å; N299-M383 PolarHBondContact ND2-O 3.11Å; N299-M383 PolarHBondContact OD1-O 3.29Å; N299-M383 VanDerWaalsContact OD1-O 3.08Å; P333-M383 HydrophobicContact CB-CG 3.72Å; P333-M383 HydrophobicContact CG-CG 3.57Å; P333-M383 HydrophobicContact CG-SD 3.98Å; R334-M383 HydrophobicContact CG-CE 4.13Å; R334-M383 HydrophobicContact CG-SD 3.84Å; I337-M383 HydrophobicContact CB-CE 4.22Å; I337-M383 HydrophobicContact CD1-CB 4.47Å; I337-M383 HydrophobicContact CD1-CG 4.24Å; I337-M383 HydrophobicContact CG2-CE 3.87Å; M380-M383 CarbonylContact O-C 3.58Å; M380-M383 WeakPolarHBondContact O-CA 3.24Å; M380-M383 PolarHBondContact O-N 3.49Å; R381-M383 PolarHBondContact O-N 3.03Å
384	Y	89.1	Confident	91.2	Very high	8 Å²	8	56.9 Å²	56.9	3%	0.031	30%	0.296	C	S	.	.			trans	-142.2	68.6	-177.8	-46.6	-72.7	0	0	0	109.8	I337 D341 M380 R381 D386 D387 R395	I337-Y384 HydrophobicContact CD1-CE2 4.45Å; I337-Y384 VanDerWaalsContact CG2-OH 3.29Å; I337-Y384 WeakPolarHBondContact CG2-OH 3.33Å; D341-Y384 PolarHBondContact OD1-OH 2.93Å; M380-Y384 HydrophobicContact CE-CD2 4.05Å; M380-Y384 HydrophobicContact CE-CE2 3.76Å; M380-Y384 VanDerWaalsContact O-CD2 3.26Å; M380-Y384 WeakPolarHBondContact O-CD2 3.33Å; M380-Y384 PolarHBondContact O-N 2.75Å; M380-Y384 HydrophobicContact SD-CE2 4.4Å; R381-Y384 CarbonylContact O-C 3.54Å; R381-Y384 PolarHBondContact O-N 2.97Å; Y384-D386 VanDerWaalsContact C-N 3.26Å; Y384-D386 PolarHBondContact O-N 3.21Å; Y384-D387 PolarHBondContact O-N 2.88Å; Y384-R395 VanDerWaalsContact CD2-CD 3.46Å; Y384-R395 VanDerWaalsContact CE1-CZ 3.4Å; Y384-R395 VanDerWaalsContact CE2-CD 3.41Å; Y384-R395 HydrophobicContact CE2-CG 4.47Å; Y384-R395 VanDerWaalsContact CZ-CD 3.43Å
385	P	86.9	Confident	91.1	Very high	77 Å²	77	58.7 Å²	58.7	50%	0.5	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-20.8	-175.2	30	-36.6	0	0	0	113.2	N299 R381	N299-P385 WeakPolarHBondContact OD1-CD 3.37Å; R381-P385 WeakPolarHBondContact O-CA 3.45Å
386	D	86.3	Confident	91.1	Very high	107 Å²	107	55.5 Å²	55.5	57%	0.572	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	5.4	-178.1	-54.1	-52.8	0	0	0	112.6	R297 Y384	R297-D386 WeakPolarHBondContact CB-OD2 3.4Å; Y384-D386 VanDerWaalsContact C-N 3.26Å; Y384-D386 PolarHBondContact O-N 3.21Å
387	D	88.8	Confident	91.1	Very high	35 Å²	35	59.9 Å²	59.9	19%	0.187	30%	0.301	C	S	.	.			trans	-79.5	129	179.6	-96.5	28.7	0	0	0	111.8	Y384 L392 R395	Y384-D387 PolarHBondContact O-N 2.88Å; D387-L392 HydrophobicContact CB-CB 4.21Å; D387-L392 HydrophobicContact CB-CD1 4.26Å; D387-R395 VanDerWaalsContact CG-NH2 3.35Å; D387-R395 IonicContact OD1-CZ 2.68Å; D387-R395 IonicContact OD1-NE 2.69Å; D387-R395 IonicContact OD1-NH2 2.7Å; D387-R395 PolarHBondContact OD1-NH2 2.97Å; D387-R395 IonicContact OD2-CZ 3.23Å; D387-R395 IonicContact OD2-NE 2.79Å; D387-R395 PolarHBondContact OD2-NE 3.46Å; D387-R395 IonicContact OD2-NH2 2.96Å; D387-R395 PolarHBondContact OD2-NH2 3.11Å; D387-R395 VanDerWaalsContact OD2-NH2 3.17Å
388	D	91.6	Very high	91.2	Very high	110 Å²	110	63.9 Å²	63.9	59%	0.588	31%	0.312	S	S	*	.			trans	-57.1	144.2	164.5	-72.3	-40.5	0	0	0	110.8	A390 M391 L392	D388-A390 PolarHBondContact O-N 2.95Å; D388-A390 VanDerWaalsContact O-N 3.09Å; D388-M391 HydrophobicContact CB-CE 3.9Å; D388-M391 CarbonylContact O-C 3.54Å; D388-M391 WeakPolarHBondContact O-CA 2.92Å; D388-M391 WeakPolarHBondContact O-CB 3.49Å; D388-M391 PolarHBondContact O-N 3.23Å; D388-M391 WeakPolarHBondContact OD2-CE 3.29Å; D388-L392 PolarHBondContact O-N 2.99Å
389	E	91.2	Very high	91.3	Very high	79 Å²	79	59.6 Å²	59.6	37%	0.369	29%	0.289	S	S	.	.	H	α-helix	trans	-53.5	-38.5	-179.1	-169.8	60.5	-142.4	0	0	112.7	R381 M391 L392 Q393	R381-E389 IonicContact CZ-OE2 2.74Å; R381-E389 IonicContact NE-OE2 2.82Å; R381-E389 IonicContact NH2-OE2 3.87Å; R381-E389 PolarHBondContact NH2-OE2 2.92Å; E389-M391 PolarHBondContact O-N 2.64Å; E389-L392 PolarHBondContact O-N 2.78Å; E389-Q393 HydrophobicContact CG-CG 4.29Å; E389-Q393 VanDerWaalsContact O-CB 3.29Å; E389-Q393 WeakPolarHBondContact O-CB 3.35Å; E389-Q393 WeakPolarHBondContact O-CG 3.15Å; E389-Q393 PolarHBondContact O-N 3.05Å; E389-Q393 WeakPolarHBondContact OE1-CG 3.18Å; E389-Q393 PolarHBondContact OE1-NE2 2.85Å
390	A	91.6	Very high	91.3	Very high	68 Å²	68	59.7 Å²	59.7	56%	0.562	29%	0.289	S	S	*	.	H	α-helix	trans	-71.6	-13.8	177.6	0	0	0	0	0	114.4	D388 K394	D388-A390 PolarHBondContact O-N 2.95Å; D388-A390 VanDerWaalsContact O-N 3.09Å; A390-K394 VanDerWaalsContact O-CD 3.29Å; A390-K394 WeakPolarHBondContact O-CD 3.49Å; A390-K394 WeakPolarHBondContact O-CE 3.47Å; A390-K394 WeakPolarHBondContact O-CG 3.4Å
391	M	91.6	Very high	91.5	Very high	94 Å²	94	62.5 Å²	62.5	46%	0.463	31%	0.305	S	S	.	.	H	α-helix	trans	-95.4	-44.1	170.2	-67.3	-163.8	-78	0	0	110.9	D388 E389 Q393 K394 R395	D388-M391 HydrophobicContact CB-CE 3.9Å; D388-M391 CarbonylContact O-C 3.54Å; D388-M391 WeakPolarHBondContact O-CA 2.92Å; D388-M391 WeakPolarHBondContact O-CB 3.49Å; D388-M391 PolarHBondContact O-N 3.23Å; D388-M391 WeakPolarHBondContact OD2-CE 3.29Å; E389-M391 PolarHBondContact O-N 2.64Å; M391-Q393 VanDerWaalsContact C-N 3.29Å; M391-Q393 PolarHBondContact O-N 3.4Å; M391-K394 WeakPolarHBondContact O-CA 3.47Å; M391-K394 WeakPolarHBondContact O-CB 3.37Å; M391-K394 PolarHBondContact O-N 3.24Å; M391-R395 PolarHBondContact O-N 3.18Å
392	L	92.7	Very high	91.6	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-51.3	-47.7	172.2	-169.9	71.8	0	0	0	111.5	P377 M380 R381 D387 D388 E389 K394 R395 I396	P377-L392 HydrophobicContact CB-CD2 3.89Å; M380-L392 HydrophobicContact CB-CD1 3.78Å; M380-L392 HydrophobicContact CB-CG 4.45Å; R381-L392 HydrophobicContact CG-CD1 4.46Å; R381-L392 HydrophobicContact CG-CD2 3.83Å; D387-L392 HydrophobicContact CB-CB 4.21Å; D387-L392 HydrophobicContact CB-CD1 4.26Å; D388-L392 PolarHBondContact O-N 2.99Å; E389-L392 PolarHBondContact O-N 2.78Å; L392-K394 VanDerWaalsContact C-N 3.29Å; L392-K394 PolarHBondContact O-N 3.37Å; L392-R395 WeakPolarHBondContact O-CB 3.44Å; L392-R395 PolarHBondContact O-N 3.4Å; L392-R395 VanDerWaalsContact O-N 3.11Å; L392-I396 HydrophobicContact CG-CD1 4.23Å; L392-I396 WeakPolarHBondContact O-CG1 3.41Å; L392-I396 PolarHBondContact O-N 2.62Å
393	Q	92.8	Very high	91.8	Very high	57 Å²	57	56.3 Å²	56.3	27%	0.266	28%	0.279	S	S	.	.	H	α-helix	trans	-65.8	-25	177.4	-69.5	-67.9	-30.5	0	0	114.1	E389 M391 R397	E389-Q393 HydrophobicContact CG-CG 4.29Å; E389-Q393 VanDerWaalsContact O-CB 3.29Å; E389-Q393 WeakPolarHBondContact O-CB 3.35Å; E389-Q393 WeakPolarHBondContact O-CG 3.15Å; E389-Q393 PolarHBondContact O-N 3.05Å; E389-Q393 WeakPolarHBondContact OE1-CG 3.18Å; E389-Q393 PolarHBondContact OE1-NE2 2.85Å; M391-Q393 VanDerWaalsContact C-N 3.29Å; M391-Q393 PolarHBondContact O-N 3.4Å; Q393-R397 WeakPolarHBondContact O-CD 3.39Å; Q393-R397 VanDerWaalsContact O-CG 3.3Å; Q393-R397 WeakPolarHBondContact O-CG 3.29Å; Q393-R397 PolarHBondContact O-NE 3.49Å
394	K	92.8	Very high	92	Very high	137 Å²	137	56 Å²	56	60%	0.596	28%	0.278	S	S	*	.	H	α-helix	trans	-77.8	-40.7	170.3	-67	168.1	-172.3	165.8	0	110.6	A390 M391 L392 R397 Y398	A390-K394 VanDerWaalsContact O-CD 3.29Å; A390-K394 WeakPolarHBondContact O-CD 3.49Å; A390-K394 WeakPolarHBondContact O-CE 3.47Å; A390-K394 WeakPolarHBondContact O-CG 3.4Å; M391-K394 WeakPolarHBondContact O-CA 3.47Å; M391-K394 WeakPolarHBondContact O-CB 3.37Å; M391-K394 PolarHBondContact O-N 3.24Å; L392-K394 VanDerWaalsContact C-N 3.29Å; L392-K394 PolarHBondContact O-N 3.37Å; K394-R397 PolarHBondContact O-N 2.92Å; K394-Y398 WeakPolarHBondContact O-CB 3.27Å; K394-Y398 PolarHBondContact O-N 3.44Å
395	R	92	Very high	92.3	Very high	39 Å²	39	56.8 Å²	56.8	15%	0.147	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-41.6	179	-149.5	-171	-74.3	-118.6	24.1	111.3	E296 D341 M380 Y384 D387 M391 L392 Y398 V399	E296-R395 IonicContact OE1-CZ 2.88Å; E296-R395 IonicContact OE1-NH1 3.31Å; E296-R395 PolarHBondContact OE1-NH1 2.84Å; E296-R395 IonicContact OE1-NH2 2.83Å; E296-R395 PolarHBondContact OE1-NH2 2.85Å; D341-R395 IonicContact OD1-NH1 2.63Å; D341-R395 VanDerWaalsContact OD2-CD 3.28Å; D341-R395 WeakPolarHBondContact OD2-CD 3.28Å; D341-R395 WeakPolarHBondContact OD2-CG 3.33Å; D341-R395 IonicContact OD2-CZ 2.67Å; D341-R395 IonicContact OD2-NE 3.86Å; D341-R395 IonicContact OD2-NH1 3.34Å; D341-R395 PolarHBondContact OD2-NH1 3.08Å; M380-R395 HydrophobicContact CE-CB 4.39Å; M380-R395 HydrophobicContact CE-CG 4.42Å; Y384-R395 VanDerWaalsContact CD2-CD 3.46Å; Y384-R395 VanDerWaalsContact CE1-CZ 3.4Å; Y384-R395 VanDerWaalsContact CE2-CD 3.41Å; Y384-R395 HydrophobicContact CE2-CG 4.47Å; Y384-R395 VanDerWaalsContact CZ-CD 3.43Å; D387-R395 VanDerWaalsContact CG-NH2 3.35Å; D387-R395 IonicContact OD1-CZ 2.68Å; D387-R395 IonicContact OD1-NE 2.69Å; D387-R395 IonicContact OD1-NH2 2.7Å; D387-R395 PolarHBondContact OD1-NH2 2.97Å; D387-R395 IonicContact OD2-CZ 3.23Å; D387-R395 IonicContact OD2-NE 2.79Å; D387-R395 PolarHBondContact OD2-NE 3.46Å; D387-R395 IonicContact OD2-NH2 2.96Å; D387-R395 PolarHBondContact OD2-NH2 3.11Å; D387-R395 VanDerWaalsContact OD2-NH2 3.17Å; M391-R395 PolarHBondContact O-N 3.18Å; L392-R395 WeakPolarHBondContact O-CB 3.44Å; L392-R395 PolarHBondContact O-N 3.4Å; L392-R395 VanDerWaalsContact O-N 3.11Å; R395-Y398 PolarHBondContact O-N 3.15Å; R395-V399 WeakPolarHBondContact O-CG2 3.49Å; R395-V399 PolarHBondContact O-N 2.77Å
396	I	93.4	Very high	92.6	Very high	9 Å²	9	55.6 Å²	55.6	5%	0.046	27%	0.274	C	S	.	.	H	α-helix	trans	-50.6	-61	168.6	-75.6	160.2	0	0	0	110.7	P377 M380 L392 Y398 V399 V400	P377-I396 HydrophobicContact CB-CD1 4.38Å; M380-I396 HydrophobicContact CB-CG1 4.29Å; M380-I396 HydrophobicContact CE-CG1 4.1Å; M380-I396 HydrophobicContact CG-CD1 4.41Å; M380-I396 HydrophobicContact CG-CG1 3.73Å; L392-I396 HydrophobicContact CG-CD1 4.23Å; L392-I396 WeakPolarHBondContact O-CG1 3.41Å; L392-I396 PolarHBondContact O-N 2.62Å; I396-Y398 VanDerWaalsContact C-N 3.26Å; I396-Y398 PolarHBondContact O-N 2.87Å; I396-V399 PolarHBondContact O-N 2.67Å; I396-V400 HydrophobicContact CG2-CG2 4.41Å; I396-V400 WeakPolarHBondContact O-CB 3.38Å; I396-V400 WeakPolarHBondContact O-CG2 3.39Å; I396-V400 PolarHBondContact O-N 2.82Å
397	R	93.5	Very high	92.9	Very high	144 Å²	144	53 Å²	53	54%	0.543	26%	0.263	S	S	.	.	H	α-helix	trans	-59.3	-37.5	-176.3	-66.9	169.3	-159.2	177.1	6.1	112.2	Q393 K394 D401 L436	Q393-R397 WeakPolarHBondContact O-CD 3.39Å; Q393-R397 VanDerWaalsContact O-CG 3.3Å; Q393-R397 WeakPolarHBondContact O-CG 3.29Å; Q393-R397 PolarHBondContact O-NE 3.49Å; K394-R397 PolarHBondContact O-N 2.92Å; R397-D401 VanDerWaalsContact O-CB 3.23Å; R397-D401 WeakPolarHBondContact O-CB 3.34Å; R397-D401 PolarHBondContact O-N 3.24Å; R397-L436 HydrophobicContact CB-CD1 4.23Å; R397-L436 WeakPolarHBondContact O-CD1 3.49Å
398	Y	93.8	Very high	93.1	Very high	122 Å²	122	51.6 Å²	51.6	48%	0.478	26%	0.255	S	S	.	.	H	α-helix	trans	-66.1	-48.5	176.3	-179.5	-111.7	0	0	0	112.7	D341 K394 R395 I396 V400 D401 L402	D341-Y398 HydrophobicContact CB-CE1 4.48Å; K394-Y398 WeakPolarHBondContact O-CB 3.27Å; K394-Y398 PolarHBondContact O-N 3.44Å; R395-Y398 PolarHBondContact O-N 3.15Å; I396-Y398 VanDerWaalsContact C-N 3.26Å; I396-Y398 PolarHBondContact O-N 2.87Å; Y398-V400 PolarHBondContact O-N 3.16Å; Y398-D401 PolarHBondContact O-N 3.25Å; Y398-L402 HydrophobicContact CD1-CD1 4.24Å; Y398-L402 HydrophobicContact CE1-CD1 3.66Å; Y398-L402 HydrophobicContact CE1-CG 4.47Å; Y398-L402 HydrophobicContact CE2-CD1 4.24Å; Y398-L402 HydrophobicContact CE2-CD2 4.48Å; Y398-L402 HydrophobicContact CE2-CG 4.28Å; Y398-L402 WeakPolarHBondContact O-CG 3.46Å; Y398-L402 PolarHBondContact O-N 3.02Å
399	V	93.9	Very high	93	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-39.4	179.3	174.6	0	0	0	0	111.3	D341 L374 M380 R395 I396 L402 Y403	D341-V399 HydrophobicContact CB-CG2 4.27Å; L374-V399 HydrophobicContact CD2-CG1 3.94Å; M380-V399 HydrophobicContact CE-CG2 4.32Å; R395-V399 WeakPolarHBondContact O-CG2 3.49Å; R395-V399 PolarHBondContact O-N 2.77Å; I396-V399 PolarHBondContact O-N 2.67Å; V399-L402 PolarHBondContact O-N 2.89Å; V399-Y403 HydrophobicContact CG1-CD2 4.09Å; V399-Y403 HydrophobicContact CG1-CE2 4.41Å; V399-Y403 PolarHBondContact O-N 2.92Å
400	V	94.6	Very high	92.8	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-44.7	177	174.3	0	0	0	0	111.6	L371 L374 E375 I396 Y398 L402 Y403 L404 H434 L436	L371-V400 HydrophobicContact CD2-CG1 3.85Å; L374-V400 HydrophobicContact CB-CG2 3.77Å; E375-V400 HydrophobicContact CG-CG2 4Å; I396-V400 HydrophobicContact CG2-CG2 4.41Å; I396-V400 WeakPolarHBondContact O-CB 3.38Å; I396-V400 WeakPolarHBondContact O-CG2 3.39Å; I396-V400 PolarHBondContact O-N 2.82Å; Y398-V400 PolarHBondContact O-N 3.16Å; V400-L402 PolarHBondContact O-N 3.45Å; V400-Y403 PolarHBondContact O-N 3.16Å; V400-Y403 VanDerWaalsContact O-N 3.09Å; V400-L404 HydrophobicContact CG1-CD1 3.75Å; V400-L404 HydrophobicContact CG1-CG 4.45Å; V400-L404 WeakPolarHBondContact O-CG 3.42Å; V400-L404 PolarHBondContact O-N 2.98Å; V400-H434 VanDerWaalsContact CG1-CE1 3.5Å; V400-H434 WeakPolarHBondContact CG1-CE1 3.33Å; V400-L436 HydrophobicContact CB-CD1 4.42Å; V400-L436 HydrophobicContact CG1-CD1 4.22Å
401	D	94.4	Very high	92.4	Very high	60 Å²	60	51.4 Å²	51.4	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-55.3	-50.2	172	172.2	61.5	0	0	0	111.6	R397 Y398 Y403 L404 N405 L436	R397-D401 VanDerWaalsContact O-CB 3.23Å; R397-D401 WeakPolarHBondContact O-CB 3.34Å; R397-D401 PolarHBondContact O-N 3.24Å; Y398-D401 PolarHBondContact O-N 3.25Å; D401-Y403 PolarHBondContact O-N 3Å; D401-L404 PolarHBondContact O-N 3.15Å; D401-N405 WeakPolarHBondContact O-CB 3.29Å; D401-N405 PolarHBondContact O-N 2.85Å; D401-N405 PolarHBondContact OD1-ND2 2.78Å; D401-L436 HydrophobicContact CB-CD1 4.36Å
402	L	94.3	Very high	92.4	Very high	28 Å²	28	53.3 Å²	53.3	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-59.1	-36.2	176	-70.3	-177.2	0	0	0	112.2	P343 Y398 V399 V400 T406	P343-L402 HydrophobicContact CG-CB 3.57Å; Y398-L402 HydrophobicContact CD1-CD1 4.24Å; Y398-L402 HydrophobicContact CE1-CD1 3.66Å; Y398-L402 HydrophobicContact CE1-CG 4.47Å; Y398-L402 HydrophobicContact CE2-CD1 4.24Å; Y398-L402 HydrophobicContact CE2-CD2 4.48Å; Y398-L402 HydrophobicContact CE2-CG 4.28Å; Y398-L402 WeakPolarHBondContact O-CG 3.46Å; Y398-L402 PolarHBondContact O-N 3.02Å; V399-L402 PolarHBondContact O-N 2.89Å; V400-L402 PolarHBondContact O-N 3.45Å; L402-T406 WeakPolarHBondContact O-CB 3.44Å; L402-T406 PolarHBondContact O-N 2.6Å; L402-T406 PolarHBondContact O-OG1 2.84Å
403	Y	94.4	Very high	92.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-69	-35	178.4	-106	-75.4	0	0	0	113.7	L336 P343 T344 N353 V354 M355 T370 L374 V399 V400 D401	L336-Y403 WeakPolarHBondContact CA-OH 3.33Å; L336-Y403 HydrophobicContact CB-CE2 4.49Å; L336-Y403 PolarHBondContact O-OH 3.45Å; P343-Y403 HydrophobicContact CB-CD1 4.23Å; P343-Y403 HydrophobicContact CB-CD2 3.78Å; P343-Y403 HydrophobicContact CB-CE1 4.04Å; P343-Y403 HydrophobicContact CB-CE2 3.56Å; P343-Y403 HydrophobicContact CB-CG 4.13Å; P343-Y403 HydrophobicContact CG-CD2 3.72Å; P343-Y403 HydrophobicContact CG-CE2 3.97Å; P343-Y403 HydrophobicContact CG-CG 4.1Å; T344-Y403 PolarHBondContact N-OH 2.93Å; N353-Y403 HydrophobicContact CB-CD1 4.24Å; N353-Y403 HydrophobicContact CB-CE1 3.94Å; N353-Y403 PolarHBondContact ND2-O 2.95Å; V354-Y403 HydrophobicContact CB-CE1 4.11Å; V354-Y403 HydrophobicContact CG2-CE1 4.49Å; M355-Y403 HydrophobicContact CG-CD1 3.82Å; T370-Y403 HydrophobicContact CG2-CD1 4.48Å; T370-Y403 HydrophobicContact CG2-CE1 4.44Å; L374-Y403 HydrophobicContact CD1-CD2 3.39Å; L374-Y403 HydrophobicContact CD1-CE2 3.77Å; L374-Y403 HydrophobicContact CD1-CG 3.81Å; V399-Y403 HydrophobicContact CG1-CD2 4.09Å; V399-Y403 HydrophobicContact CG1-CE2 4.41Å; V399-Y403 PolarHBondContact O-N 2.92Å; V400-Y403 PolarHBondContact O-N 3.16Å; V400-Y403 VanDerWaalsContact O-N 3.09Å; D401-Y403 PolarHBondContact O-N 3Å
404	L	93.4	Very high	92.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-86.4	-40	-177.6	-70.1	168	0	0	0	113.8	M355 L371 V400 D401 P415 L431 H434 L436 I437	M355-L404 HydrophobicContact CE-CD2 3.9Å; L371-L404 HydrophobicContact CD1-CD2 4.41Å; L371-L404 HydrophobicContact CD2-CD1 4.23Å; L371-L404 HydrophobicContact CD2-CD2 4.02Å; L371-L404 HydrophobicContact CD2-CG 4.18Å; V400-L404 HydrophobicContact CG1-CD1 3.75Å; V400-L404 HydrophobicContact CG1-CG 4.45Å; V400-L404 WeakPolarHBondContact O-CG 3.42Å; V400-L404 PolarHBondContact O-N 2.98Å; D401-L404 PolarHBondContact O-N 3.15Å; L404-P415 VanDerWaalsContact O-CD 3.31Å; L404-P415 WeakPolarHBondContact O-CD 3.15Å; L404-P415 WeakPolarHBondContact O-CG 3.47Å; L404-L431 HydrophobicContact CD2-CD2 3.58Å; L404-H434 WeakPolarHBondContact CD1-CE1 3.46Å; L404-H434 WeakPolarHBondContact CD1-ND1 3.42Å; L404-L436 HydrophobicContact CD1-CB 4.29Å; L404-I437 HydrophobicContact CB-CD1 3.99Å; L404-I437 HydrophobicContact CD2-CD1 4.22Å
405	N	94.6	Very high	92.7	Very high	24 Å²	24	44.8 Å²	44.8	13%	0.128	21%	0.207	C	C	.	.	H	α-helix	trans	-112.1	-13.3	-165.3	-65.4	-45.3	0	0	0	114.5	D401 P407 T414 L436 V438	D401-N405 WeakPolarHBondContact O-CB 3.29Å; D401-N405 PolarHBondContact O-N 2.85Å; D401-N405 PolarHBondContact OD1-ND2 2.78Å; N405-P407 WeakPolarHBondContact O-CD 3.4Å; N405-T414 WeakPolarHBondContact O-CG2 3.29Å; N405-L436 PolarHBondContact ND2-O 3.18Å; N405-V438 PolarHBondContact OD1-N 2.97Å
406	T	92.9	Very high	92.8	Very high	51 Å²	51	43 Å²	43	31%	0.313	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-60.5	123.8	174.5	-63.9	0	0	0	0	110.3	H356 L402 P415	H356-T406 PolarHBondContact CE1-O 3.21Å; L402-T406 WeakPolarHBondContact O-CB 3.44Å; L402-T406 PolarHBondContact O-N 2.6Å; L402-T406 PolarHBondContact O-OG1 2.84Å; T406-P415 WeakPolarHBondContact O-CD 3.2Å
407	P	92.8	Very high	92.9	Very high	53 Å²	53	42.5 Å²	42.5	34%	0.344	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-84.2	156.9	179	34.6	-35.8	0	0	0	112.8	N405 Y412 T414	N405-P407 WeakPolarHBondContact O-CD 3.4Å; P407-Y412 HydrophobicContact CB-CD1 4.32Å; P407-Y412 HydrophobicContact CG-CD1 3.94Å; P407-T414 HydrophobicContact CB-CG2 4.05Å
408	D	92.6	Very high	93	Very high	5 Å²	5	36 Å²	36	3%	0.027	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-66.4	156.1	175.5	105	-73	0	0	0	113.1	Y352 H356 M410 G411 Y412 D413 F418	Y352-D408 HydrophobicContact CD1-CB 4.21Å; Y352-D408 HydrophobicContact CE1-CB 3.96Å; H356-D408 PolarHBondContact NE2-N 2.94Å; D408-M410 VanDerWaalsContact C-N 3.32Å; D408-M410 PolarHBondContact O-N 3.02Å; D408-M410 WeakPolarHBondContact OD2-CA 3.48Å; D408-M410 VanDerWaalsContact OD2-CB 3.28Å; D408-M410 WeakPolarHBondContact OD2-CB 3.39Å; D408-M410 PolarHBondContact OD2-N 2.81Å; D408-G411 VanDerWaalsContact OD1-CA 3.24Å; D408-G411 WeakPolarHBondContact OD1-CA 3.09Å; D408-G411 PolarHBondContact OD1-N 2.79Å; D408-G411 PolarHBondContact OD2-N 3.49Å; D408-Y412 WeakPolarHBondContact O-CA 3.43Å; D408-Y412 PolarHBondContact O-N 3.31Å; D408-Y412 PolarHBondContact OD1-N 3.32Å; D408-D413 PolarHBondContact N-O 3.23Å; D408-D413 PolarHBondContact OD1-N 2.83Å; D408-F418 HydrophobicContact CB-CE2 3.97Å; D408-F418 HydrophobicContact CB-CZ 4.36Å
409	K	89.9	Confident	93	Very high	130 Å²	130	30.1 Å²	30.1	57%	0.565	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-26.1	-177.1	-175.1	-179.5	172	-169.3	0	114.1	C350 R351	C350-K409 WeakPolarHBondContact O-CB 3.34Å; C350-K409 PolarHBondContact O-N 2.84Å; C350-K409 VanDerWaalsContact O-N 3.12Å; R351-K409 HydrophobicContact CB-CB 4.32Å; R351-K409 HydrophobicContact CG-CB 4.3Å; R351-K409 HydrophobicContact CG-CD 4.14Å
410	M	86.1	Confident	93.1	Very high	116 Å²	116	30.1 Å²	30.1	57%	0.571	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-51.2	-166.1	-58.3	-63.3	-67.6	0	0	112.9	C350 D408	C350-M410 HydrophobicContact CB-CG 4.44Å; D408-M410 VanDerWaalsContact C-N 3.32Å; D408-M410 PolarHBondContact O-N 3.02Å; D408-M410 WeakPolarHBondContact OD2-CA 3.48Å; D408-M410 VanDerWaalsContact OD2-CB 3.28Å; D408-M410 WeakPolarHBondContact OD2-CB 3.39Å; D408-M410 PolarHBondContact OD2-N 2.81Å
411	G	84.4	Confident	93.1	Very high	7 Å²	7	30.3 Å²	30.3	7%	0.072	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-15.1	-178.9	0	0	0	0	0	114.2	D408 D413 K444	D408-G411 VanDerWaalsContact OD1-CA 3.24Å; D408-G411 WeakPolarHBondContact OD1-CA 3.09Å; D408-G411 PolarHBondContact OD1-N 2.79Å; D408-G411 PolarHBondContact OD2-N 3.49Å; G411-D413 PolarHBondContact O-N 3.02Å; G411-K444 WeakPolarHBondContact O-CB 3.48Å; G411-K444 PolarHBondContact O-N 3.31Å
412	Y	91.3	Very high	93	Very high	134 Å²	134	29.9 Å²	29.9	53%	0.525	15%	0.146	S	C	.	.			trans	56.1	29.3	-159.8	-75.1	-113	0	0	0	112	P407 D408 N443 K444	P407-Y412 HydrophobicContact CB-CD1 4.32Å; P407-Y412 HydrophobicContact CG-CD1 3.94Å; D408-Y412 WeakPolarHBondContact O-CA 3.43Å; D408-Y412 PolarHBondContact O-N 3.31Å; D408-Y412 PolarHBondContact OD1-N 3.32Å; Y412-N443 WeakPolarHBondContact O-CA 3.24Å; Y412-N443 WeakPolarHBondContact O-CB 3.34Å; Y412-K444 HydrophobicContact CD2-CB 4.37Å
413	D	93.4	Very high	92.9	Very high	8 Å²	8	29.1 Å²	29.1	4%	0.043	15%	0.145	C	C	.	.			trans	-78.6	122.3	172.8	-72.2	-51.1	0	0	0	108.3	H356 D408 G411 H417 F418 K421 N443	H356-D413 PolarHBondContact NE2-O 3.34Å; D408-D413 PolarHBondContact N-O 3.23Å; D408-D413 PolarHBondContact OD1-N 2.83Å; G411-D413 PolarHBondContact O-N 3.02Å; D413-H417 HydrophobicContact CB-CB 3.75Å; D413-H417 IonicContact OD1-CD2 3.71Å; D413-H417 IonicContact OD1-CG 3.69Å; D413-F418 HydrophobicContact CB-CD2 3.73Å; D413-F418 HydrophobicContact CB-CE2 3.56Å; D413-K421 IonicContact OD1-NZ 2.76Å; D413-K421 PolarHBondContact OD1-NZ 2.93Å; D413-K421 IonicContact OD2-NZ 3.66Å; D413-K421 PolarHBondContact OD2-NZ 3.13Å; D413-N443 PolarHBondContact OD1-ND2 2.82Å
414	T	94.9	Very high	92.8	Very high	8 Å²	8	29.3 Å²	29.3	5%	0.049	15%	0.146	C	C	.	.			trans	-74.1	167.1	172.3	62.3	0	0	0	0	112.1	N405 P407 L416 H417 F418 P441	N405-T414 WeakPolarHBondContact O-CG2 3.29Å; P407-T414 HydrophobicContact CB-CG2 4.05Å; T414-L416 PolarHBondContact O-N 3.34Å; T414-L416 VanDerWaalsContact O-N 3.12Å; T414-H417 PolarHBondContact N-ND1 2.85Å; T414-H417 WeakPolarHBondContact O-CA 3.42Å; T414-H417 WeakPolarHBondContact O-CB 3.38Å; T414-H417 PolarHBondContact O-N 3.04Å; T414-H417 PolarHBondContact OG1-N 2.77Å; T414-H417 PolarHBondContact OG1-ND1 2.94Å; T414-F418 PolarHBondContact O-N 2.73Å; T414-P441 HydrophobicContact CG2-CB 4.25Å; T414-P441 HydrophobicContact CG2-CG 4.16Å
415	P	95.6	Very high	92.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-47.8	-38.3	170.8	-31.1	34.8	0	0	0	114.2	M355 L404 T406 F418 A419 L431	M355-P415 HydrophobicContact CB-CB 4.03Å; M355-P415 HydrophobicContact CB-CG 4.07Å; L404-P415 VanDerWaalsContact O-CD 3.31Å; L404-P415 WeakPolarHBondContact O-CD 3.15Å; L404-P415 WeakPolarHBondContact O-CG 3.47Å; T406-P415 WeakPolarHBondContact O-CD 3.2Å; P415-F418 WeakPolarHBondContact O-CB 3.35Å; P415-F418 PolarHBondContact O-N 3.47Å; P415-A419 PolarHBondContact O-N 3.35Å; P415-L431 HydrophobicContact CB-CD1 4.3Å
416	L	95.3	Very high	92.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.3	-40.9	175.1	-172.9	62	0	0	0	112.7	T414 F418 A419 C420 V428 L431 I437 P449 L472	T414-L416 PolarHBondContact O-N 3.34Å; T414-L416 VanDerWaalsContact O-N 3.12Å; L416-F418 VanDerWaalsContact C-N 3.31Å; L416-F418 PolarHBondContact O-N 2.85Å; L416-A419 PolarHBondContact O-N 3.43Å; L416-C420 PolarHBondContact O-N 2.78Å; L416-C420 PolarHBondContact O-SG 3.41Å; L416-C420 VanDerWaalsContact O-SG 3.41Å; L416-V428 HydrophobicContact CD1-CG1 4.22Å; L416-L431 HydrophobicContact CB-CD1 4.42Å; L416-L431 HydrophobicContact CD1-CB 4.1Å; L416-L431 HydrophobicContact CD1-CD1 4.29Å; L416-I437 HydrophobicContact CB-CD1 4.34Å; L416-I437 HydrophobicContact CD2-CG1 4.09Å; L416-P449 HydrophobicContact CB-CG 4.49Å; L416-P449 HydrophobicContact CD2-CB 4.33Å; L416-P449 HydrophobicContact CD2-CG 4.05Å; L416-P449 HydrophobicContact CG-CB 4.04Å; L416-P449 HydrophobicContact CG-CG 4.05Å; L416-L472 HydrophobicContact CD1-CD2 3.99Å; L416-L472 HydrophobicContact CD2-CD2 3.95Å; L416-L472 HydrophobicContact CG-CD2 4.12Å
417	H	95.4	Very high	92.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.5	-44.2	169.9	-74.7	90.3	0	0	0	110.9	D413 T414 C420 K421 P441 K447	D413-H417 HydrophobicContact CB-CB 3.75Å; D413-H417 IonicContact OD1-CD2 3.71Å; D413-H417 IonicContact OD1-CG 3.69Å; T414-H417 PolarHBondContact N-ND1 2.85Å; T414-H417 WeakPolarHBondContact O-CA 3.42Å; T414-H417 WeakPolarHBondContact O-CB 3.38Å; T414-H417 PolarHBondContact O-N 3.04Å; T414-H417 PolarHBondContact OG1-N 2.77Å; T414-H417 PolarHBondContact OG1-ND1 2.94Å; H417-C420 PolarHBondContact O-N 2.66Å; H417-K421 WeakPolarHBondContact O-CB 3.35Å; H417-K421 PolarHBondContact O-N 2.68Å; H417-P441 PolarHBondContact CE1-O 2.99Å; H417-K447 PolarHBondContact NE2-O 2.97Å
418	F	94.6	Very high	92.7	Very high	6 Å²	6	26.3 Å²	26.3	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-57.8	-50.2	176.5	-91.5	-109.8	0	0	0	111.4	Y352 H356 A359 K360 D408 D413 T414 P415 L416 C420 K421 F422	Y352-F418 HydrophobicContact CD1-CZ 4.21Å; Y352-F418 AromaticContact CE1-CE1 3.93Å; Y352-F418 HydrophobicContact CE1-CE1 3.93Å; Y352-F418 HydrophobicContact CE1-CE2 4.28Å; Y352-F418 AromaticContact CE1-CZ 3.4Å; Y352-F418 HydrophobicContact CE1-CZ 3.4Å; Y352-F418 HydrophobicContact CE2-CE1 4.34Å; Y352-F418 AromaticContact CZ-CE1 3.78Å; Y352-F418 AromaticContact CZ-CZ 3.62Å; H356-F418 AromaticContact CD2-CD2 3.74Å; H356-F418 AromaticContact CD2-CE2 3.67Å; A359-F418 HydrophobicContact CB-CB 3.92Å; K360-F418 HydrophobicContact CB-CD1 4.35Å; D408-F418 HydrophobicContact CB-CE2 3.97Å; D408-F418 HydrophobicContact CB-CZ 4.36Å; D413-F418 HydrophobicContact CB-CD2 3.73Å; D413-F418 HydrophobicContact CB-CE2 3.56Å; T414-F418 PolarHBondContact O-N 2.73Å; P415-F418 WeakPolarHBondContact O-CB 3.35Å; P415-F418 PolarHBondContact O-N 3.47Å; L416-F418 VanDerWaalsContact C-N 3.31Å; L416-F418 PolarHBondContact O-N 2.85Å; F418-C420 PolarHBondContact O-N 3.11Å; F418-K421 PolarHBondContact O-N 3.18Å; F418-F422 HydrophobicContact CD1-CD2 4.18Å; F418-F422 AromaticContact CD1-CE2 3.69Å; F418-F422 HydrophobicContact CD1-CE2 3.69Å; F418-F422 HydrophobicContact CE1-CE2 4.06Å; F418-F422 HydrophobicContact CG-CE2 4.49Å; F418-F422 VanDerWaalsContact O-CD2 3.3Å; F418-F422 WeakPolarHBondContact O-CD2 3.36Å; F418-F422 PolarHBondContact O-N 2.86Å
419	A	95.2	Very high	92.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.9	-48.7	-178.9	0	0	0	0	0	111.8	A359 P415 L416 K421 G423 S424 V427 V428 L431	A359-A419 HydrophobicContact CB-CB 3.98Å; P415-A419 PolarHBondContact O-N 3.35Å; L416-A419 PolarHBondContact O-N 3.43Å; A419-K421 PolarHBondContact O-N 3.05Å; A419-G423 PolarHBondContact O-N 2.98Å; A419-G423 VanDerWaalsContact O-N 3.11Å; A419-S424 WeakPolarHBondContact O-CB 3.37Å; A419-S424 PolarHBondContact O-N 3.35Å; A419-V427 HydrophobicContact CB-CB 4.27Å; A419-V427 HydrophobicContact CB-CG1 3.99Å; A419-V428 HydrophobicContact CB-CG2 3.55Å; A419-L431 HydrophobicContact CB-CD1 4.08Å
420	C	95.1	Very high	92.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.6	-44	175.6	-66	0	0	0	0	112.5	L416 H417 F418 F422 G423 P449 V452 I453 C454 I468	L416-C420 PolarHBondContact O-N 2.78Å; L416-C420 PolarHBondContact O-SG 3.41Å; L416-C420 VanDerWaalsContact O-SG 3.41Å; H417-C420 PolarHBondContact O-N 2.66Å; F418-C420 PolarHBondContact O-N 3.11Å; C420-F422 PolarHBondContact O-N 2.93Å; C420-G423 PolarHBondContact O-N 3.22Å; C420-P449 HydrophobicContact CB-CB 4.41Å; C420-P449 WeakPolarHBondContact CB-O 3.23Å; C420-V452 HydrophobicContact CB-CG2 4.17Å; C420-I453 HydrophobicContact CB-CG1 4.14Å; C420-I453 WeakPolarHBondContact O-CA 3.12Å; C420-C454 PolarHBondContact O-N 3.34Å; C420-I468 HydrophobicContact CB-CG2 4.39Å
421	K	93.8	Very high	93	Very high	7 Å²	7	15.3 Å²	15.3	3%	0.03	8%	0.076	C	C	.	.	H	α-helix	trans	-65	-36.4	-175.7	-171	174.1	-141	151	0	113.5	D413 H417 F418 A419 V452 E455 R456 S457	D413-K421 IonicContact OD1-NZ 2.76Å; D413-K421 PolarHBondContact OD1-NZ 2.93Å; D413-K421 IonicContact OD2-NZ 3.66Å; D413-K421 PolarHBondContact OD2-NZ 3.13Å; H417-K421 WeakPolarHBondContact O-CB 3.35Å; H417-K421 PolarHBondContact O-N 2.68Å; F418-K421 PolarHBondContact O-N 3.18Å; A419-K421 PolarHBondContact O-N 3.05Å; K421-V452 WeakPolarHBondContact CA-O 3.49Å; K421-V452 HydrophobicContact CB-CB 4.3Å; K421-V452 HydrophobicContact CB-CG2 4.12Å; K421-V452 HydrophobicContact CG-CB 4.47Å; K421-E455 WeakPolarHBondContact CE-OE2 3.4Å; K421-E455 HydrophobicContact CG-CB 4.34Å; K421-E455 IonicContact NZ-OE2 2.64Å; K421-E455 PolarHBondContact O-N 3.25Å; K421-R456 HydrophobicContact CG-CB 4.27Å; K421-R456 HydrophobicContact CG-CG 4.06Å; K421-R456 CarbonylContact O-C 3.58Å; K421-R456 WeakPolarHBondContact O-CA 3.5Å; K421-R456 PolarHBondContact O-N 3.46Å; K421-S457 PolarHBondContact O-N 3.36Å
422	F	93	Very high	93.3	Very high	50 Å²	50	15 Å²	15	22%	0.219	7%	0.073	C	C	.	.	H	α-helix	trans	-89.1	-8.2	175.4	-71.1	-71	0	0	0	113.9	K360 F418 C420 R456 S457	K360-F422 HydrophobicContact CB-CD2 4.16Å; K360-F422 HydrophobicContact CB-CE2 4.19Å; K360-F422 HydrophobicContact CD-CE2 4.37Å; K360-F422 HydrophobicContact CD-CZ 4.33Å; K360-F422 HydrophobicContact CG-CD2 4.14Å; K360-F422 HydrophobicContact CG-CE1 4.43Å; K360-F422 HydrophobicContact CG-CE2 3.91Å; K360-F422 HydrophobicContact CG-CZ 4.06Å; F418-F422 HydrophobicContact CD1-CD2 4.18Å; F418-F422 AromaticContact CD1-CE2 3.69Å; F418-F422 HydrophobicContact CD1-CE2 3.69Å; F418-F422 HydrophobicContact CE1-CE2 4.06Å; F418-F422 HydrophobicContact CG-CE2 4.49Å; F418-F422 VanDerWaalsContact O-CD2 3.3Å; F418-F422 WeakPolarHBondContact O-CD2 3.36Å; F418-F422 PolarHBondContact O-N 2.86Å; C420-F422 PolarHBondContact O-N 2.93Å; F422-R456 HydrophobicContact CD1-CB 4.03Å; F422-R456 HydrophobicContact CE1-CB 3.93Å; F422-S457 VanDerWaalsContact O-CA 3.27Å; F422-S457 WeakPolarHBondContact O-CA 3.29Å; F422-S457 WeakPolarHBondContact O-CB 3.21Å
423	G	92.4	Very high	93.1	Very high	12 Å²	12	9.6 Å²	9.6	12%	0.124	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	22.4	179.2	0	0	0	0	0	113.9	A419 C420 A425	A419-G423 PolarHBondContact O-N 2.98Å; A419-G423 VanDerWaalsContact O-N 3.11Å; C420-G423 PolarHBondContact O-N 3.22Å; G423-A425 VanDerWaalsContact C-N 3.27Å; G423-A425 PolarHBondContact O-N 3.23Å
424	S	93.1	Very high	92.8	Very high	5 Å²	5	10.2 Å²	10.2	4%	0.035	6%	0.057	C	C	.	.			trans	-79	66.3	-173.1	-54.3	0	0	0	0	111.6	A359 N362 A419 D426 V427 V428	A359-S424 VanDerWaalsContact O-CB 3.29Å; A359-S424 WeakPolarHBondContact O-CB 3.31Å; A359-S424 PolarHBondContact O-OG 3.29Å; N362-S424 WeakPolarHBondContact OD1-CA 3.37Å; N362-S424 VanDerWaalsContact OD1-CB 3.23Å; N362-S424 WeakPolarHBondContact OD1-CB 3.32Å; N362-S424 PolarHBondContact OD1-O 3.02Å; A419-S424 WeakPolarHBondContact O-CB 3.37Å; A419-S424 PolarHBondContact O-N 3.35Å; S424-D426 PolarHBondContact O-N 3.46Å; S424-V427 PolarHBondContact O-N 3.36Å; S424-V428 WeakPolarHBondContact O-CG2 3.45Å; S424-V428 PolarHBondContact O-N 2.88Å
425	A	92.3	Very high	92.3	Very high	5 Å²	5	14 Å²	14	4%	0.041	7%	0.074	C	C	.	.	H	α-helix	trans	-57.1	-34.4	-169	0	0	0	0	0	114.1	G423 V428 N429 L464 I468 Y471	G423-A425 VanDerWaalsContact C-N 3.27Å; G423-A425 PolarHBondContact O-N 3.23Å; A425-V428 PolarHBondContact O-N 3.13Å; A425-N429 PolarHBondContact O-N 3.47Å; A425-L464 HydrophobicContact CB-CD1 3.74Å; A425-I468 HydrophobicContact CB-CD1 4.17Å; A425-I468 HydrophobicContact CB-CG1 3.72Å; A425-Y471 HydrophobicContact CB-CE2 4.4Å; A425-Y471 WeakPolarHBondContact O-CE2 3.16Å
426	D	92.1	Very high	91.9	Very high	59 Å²	59	16.5 Å²	16.5	32%	0.316	9%	0.087	S	C	.	.	H	α-helix	trans	-71.8	-36.4	179.9	-47.4	-64.1	0	0	0	111.2	N362 A364 S424 N429 V430 R467	N362-D426 PolarHBondContact ND2-OD2 2.83Å; A364-D426 HydrophobicContact CB-CB 3.7Å; S424-D426 PolarHBondContact O-N 3.46Å; D426-N429 PolarHBondContact O-N 2.93Å; D426-V430 WeakPolarHBondContact O-CG2 3.49Å; D426-V430 PolarHBondContact O-N 2.92Å; D426-R467 IonicContact OD1-NH2 3.63Å
427	V	93.8	Very high	91.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-70.4	-38.5	171.1	179.4	0	0	0	0	111.4	A359 N362 A364 C367 A419 S424 N429 V430 L431	A359-V427 HydrophobicContact CB-CG1 3.96Å; N362-V427 PolarHBondContact OD1-N 2.96Å; A364-V427 HydrophobicContact CB-CG2 4.12Å; C367-V427 VanDerWaalsContact SG-CG1 3.59Å; A419-V427 HydrophobicContact CB-CB 4.27Å; A419-V427 HydrophobicContact CB-CG1 3.99Å; S424-V427 PolarHBondContact O-N 3.36Å; V427-N429 VanDerWaalsContact C-N 3.31Å; V427-N429 PolarHBondContact O-N 2.86Å; V427-V430 PolarHBondContact O-N 3.28Å; V427-L431 HydrophobicContact CG1-CD1 3.78Å; V427-L431 HydrophobicContact CG1-CG 3.98Å; V427-L431 WeakPolarHBondContact O-CB 3.46Å; V427-L431 VanDerWaalsContact O-CG 3.32Å; V427-L431 WeakPolarHBondContact O-CG 3.4Å; V427-L431 PolarHBondContact O-N 2.85Å
428	V	93.5	Very high	91.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.8	-46.9	173.4	178.3	0	0	0	0	109.9	L416 A419 S424 A425 V430 L431 S432 I468 L472	L416-V428 HydrophobicContact CD1-CG1 4.22Å; A419-V428 HydrophobicContact CB-CG2 3.55Å; S424-V428 WeakPolarHBondContact O-CG2 3.45Å; S424-V428 PolarHBondContact O-N 2.88Å; A425-V428 PolarHBondContact O-N 3.13Å; V428-V430 PolarHBondContact O-N 3.28Å; V428-L431 PolarHBondContact O-N 3.27Å; V428-S432 PolarHBondContact O-N 3.22Å; V428-S432 PolarHBondContact O-OG 3.07Å; V428-S432 VanDerWaalsContact O-OG 3.05Å; V428-I468 HydrophobicContact CG1-CG2 4.3Å; V428-I468 HydrophobicContact CG2-CG2 4.17Å; V428-L472 HydrophobicContact CG1-CD2 4.33Å; V428-L472 HydrophobicContact CG1-CG 4.41Å
429	N	91.1	Very high	91.1	Very high	9 Å²	9	21.6 Å²	21.6	5%	0.048	12%	0.116	C	C	.	.	H	α-helix	trans	-57.6	-44	178.5	-173.4	41.2	0	0	0	112.8	A425 D426 V427 S433 Y471 H475	A425-N429 PolarHBondContact O-N 3.47Å; D426-N429 PolarHBondContact O-N 2.93Å; V427-N429 VanDerWaalsContact C-N 3.31Å; V427-N429 PolarHBondContact O-N 2.86Å; N429-S433 WeakPolarHBondContact O-CB 3.29Å; N429-S433 PolarHBondContact O-N 3.34Å; N429-S433 PolarHBondContact O-OG 3.31Å; N429-Y471 HydrophobicContact CB-CD1 4.23Å; N429-Y471 HydrophobicContact CB-CD2 3.87Å; N429-Y471 HydrophobicContact CB-CE1 4.13Å; N429-Y471 HydrophobicContact CB-CE2 3.76Å; N429-Y471 HydrophobicContact CB-CG 4.12Å; N429-Y471 WeakPolarHBondContact OD1-CD1 3.28Å; N429-Y471 WeakPolarHBondContact OD1-CE1 3.44Å; N429-H475 PolarHBondContact O-NE2 3.02Å; N429-H475 PolarHBondContact OD1-NE2 3.45Å
430	V	91.2	Very high	90.8	Very high	11 Å²	11	27.2 Å²	27.2	7%	0.067	15%	0.146	C	C	.	.	H	α-helix	trans	-64.4	-51.5	175.6	172.2	0	0	0	0	110.9	A364 C367 R368 L371 D426 V427 V428 S432 S433	A364-V430 HydrophobicContact CB-CG2 4.24Å; C367-V430 HydrophobicContact CB-CG1 3.92Å; R368-V430 HydrophobicContact CG-CB 4.46Å; R368-V430 HydrophobicContact CG-CG1 3.79Å; R368-V430 HydrophobicContact CG-CG2 3.73Å; R368-V430 VanDerWaalsContact CZ-CG2 3.47Å; L371-V430 HydrophobicContact CD1-CG1 4.4Å; D426-V430 WeakPolarHBondContact O-CG2 3.49Å; D426-V430 PolarHBondContact O-N 2.92Å; V427-V430 PolarHBondContact O-N 3.28Å; V428-V430 PolarHBondContact O-N 3.28Å; V430-S432 PolarHBondContact O-N 3.17Å; V430-S433 PolarHBondContact O-N 3.18Å
431	L	91.5	Very high	90.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-44.1	-177.5	-69.3	176.7	0	0	0	112.1	M355 L404 P415 L416 A419 V427 V428 S433 H434 I437	M355-L431 HydrophobicContact CE-CD2 3.81Å; L404-L431 HydrophobicContact CD2-CD2 3.58Å; P415-L431 HydrophobicContact CB-CD1 4.3Å; L416-L431 HydrophobicContact CB-CD1 4.42Å; L416-L431 HydrophobicContact CD1-CB 4.1Å; L416-L431 HydrophobicContact CD1-CD1 4.29Å; A419-L431 HydrophobicContact CB-CD1 4.08Å; V427-L431 HydrophobicContact CG1-CD1 3.78Å; V427-L431 HydrophobicContact CG1-CG 3.98Å; V427-L431 WeakPolarHBondContact O-CB 3.46Å; V427-L431 VanDerWaalsContact O-CG 3.32Å; V427-L431 WeakPolarHBondContact O-CG 3.4Å; V427-L431 PolarHBondContact O-N 2.85Å; V428-L431 PolarHBondContact O-N 3.27Å; L431-S433 VanDerWaalsContact C-N 3.31Å; L431-S433 PolarHBondContact O-N 3.4Å; L431-H434 PolarHBondContact O-N 2.93Å; L431-I437 HydrophobicContact CB-CD1 4.48Å; L431-I437 VanDerWaalsContact O-CB 3.31Å; L431-I437 WeakPolarHBondContact O-CB 3.36Å; L431-I437 WeakPolarHBondContact O-CG1 3.37Å; L431-I437 VanDerWaalsContact O-CG2 3.27Å; L431-I437 WeakPolarHBondContact O-CG2 3.5Å
432	S	90.4	Very high	90.6	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-81.2	-6	-177	70	0	0	0	0	114.9	V428 V430 K439 Y471 H475	V428-S432 PolarHBondContact O-N 3.22Å; V428-S432 PolarHBondContact O-OG 3.07Å; V428-S432 VanDerWaalsContact O-OG 3.05Å; V430-S432 PolarHBondContact O-N 3.17Å; S432-K439 WeakPolarHBondContact O-CE 3.3Å; S432-K439 PolarHBondContact O-NZ 3.09Å; S432-Y471 VanDerWaalsContact CB-O 3.29Å; S432-Y471 WeakPolarHBondContact CB-O 3.39Å; S432-Y471 PolarHBondContact OG-O 3.48Å; S432-H475 PolarHBondContact OG-CE1 3.49Å
433	S	86.9	Confident	90.6	Very high	21 Å²	21	33.6 Å²	33.6	15%	0.147	17%	0.172	C	C	.	.	H	α-helix	trans	-76.4	-28.5	167.8	-63.3	0	0	0	0	113.3	N429 V430 L431 H475	N429-S433 WeakPolarHBondContact O-CB 3.29Å; N429-S433 PolarHBondContact O-N 3.34Å; N429-S433 PolarHBondContact O-OG 3.31Å; V430-S433 PolarHBondContact O-N 3.18Å; L431-S433 VanDerWaalsContact C-N 3.31Å; L431-S433 PolarHBondContact O-N 3.4Å; S433-H475 PolarHBondContact OG-CD2 2.9Å; S433-H475 PolarHBondContact OG-NE2 3.27Å
434	H	87.9	Confident	90.7	Very high	20 Å²	20	39.8 Å²	39.8	9%	0.093	20%	0.196	C	C	.	.	S	Bend	trans	-87	128.9	-169.9	176.6	-80.9	0	0	0	112.8	L371 E375 V400 L404 L431 L436 I437	L371-H434 HydrophobicContact CD1-CB 4.42Å; E375-H434 IonicContact OE1-CD2 2.71Å; E375-H434 PolarHBondContact OE1-CD2 3.11Å; E375-H434 VanDerWaalsContact OE1-CD2 3.32Å; E375-H434 IonicContact OE1-NE2 3.77Å; E375-H434 PolarHBondContact OE1-NE2 2.71Å; V400-H434 VanDerWaalsContact CG1-CE1 3.5Å; V400-H434 WeakPolarHBondContact CG1-CE1 3.33Å; L404-H434 WeakPolarHBondContact CD1-CE1 3.46Å; L404-H434 WeakPolarHBondContact CD1-ND1 3.42Å; L431-H434 PolarHBondContact O-N 2.93Å; H434-L436 VanDerWaalsContact C-N 3.31Å; H434-L436 PolarHBondContact ND1-N 3.15Å; H434-L436 PolarHBondContact O-N 3.38Å; H434-L436 VanDerWaalsContact O-N 3.08Å; H434-I437 WeakPolarHBondContact O-CB 3.29Å; H434-I437 WeakPolarHBondContact O-CG2 3.35Å; H434-I437 PolarHBondContact O-N 2.79Å
435	H	84.3	Confident	90.6	Very high	88 Å²	88	46.9 Å²	46.9	41%	0.407	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.3	-165.1	65.1	-179.5	0	0	0	117.4	P497	H435-P497 HydrophobicContact CB-CB 4.09Å
436	L	87.6	Confident	90.6	Very high	53 Å²	53	51.6 Å²	51.6	28%	0.277	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-3.6	174.9	-55.4	-178.6	0	0	0	113.6	R397 V400 D401 L404 N405 H434 V438	R397-L436 HydrophobicContact CB-CD1 4.23Å; R397-L436 WeakPolarHBondContact O-CD1 3.49Å; V400-L436 HydrophobicContact CB-CD1 4.42Å; V400-L436 HydrophobicContact CG1-CD1 4.22Å; D401-L436 HydrophobicContact CB-CD1 4.36Å; L404-L436 HydrophobicContact CD1-CB 4.29Å; N405-L436 PolarHBondContact ND2-O 3.18Å; H434-L436 VanDerWaalsContact C-N 3.31Å; H434-L436 PolarHBondContact ND1-N 3.15Å; H434-L436 PolarHBondContact O-N 3.38Å; H434-L436 VanDerWaalsContact O-N 3.08Å; L436-V438 PolarHBondContact O-N 2.93Å
437	I	90.6	Very high	90.7	Very high	13 Å²	13	52 Å²	52	7%	0.067	25%	0.246	C	C	.	.			trans	-70.5	125.5	-175.6	-167.9	64.9	0	0	0	111.7	L404 L416 L431 H434 K439	L404-I437 HydrophobicContact CB-CD1 3.99Å; L404-I437 HydrophobicContact CD2-CD1 4.22Å; L416-I437 HydrophobicContact CB-CD1 4.34Å; L416-I437 HydrophobicContact CD2-CG1 4.09Å; L431-I437 HydrophobicContact CB-CD1 4.48Å; L431-I437 VanDerWaalsContact O-CB 3.31Å; L431-I437 WeakPolarHBondContact O-CB 3.36Å; L431-I437 WeakPolarHBondContact O-CG1 3.37Å; L431-I437 VanDerWaalsContact O-CG2 3.27Å; L431-I437 WeakPolarHBondContact O-CG2 3.5Å; H434-I437 WeakPolarHBondContact O-CB 3.29Å; H434-I437 WeakPolarHBondContact O-CG2 3.35Å; H434-I437 PolarHBondContact O-N 2.79Å; I437-K439 HydrophobicContact CG2-CD 4.26Å; I437-K439 HydrophobicContact CG2-CG 3.85Å; I437-K439 PolarHBondContact O-N 3.04Å
438	V	89.8	Confident	90.7	Very high	73 Å²	73	53 Å²	53	44%	0.442	25%	0.253	S	S	.	.			trans	-77.7	114.8	167.7	-174.3	0	0	0	0	107.6	N405 L436 P441	N405-V438 PolarHBondContact OD1-N 2.97Å; L436-V438 PolarHBondContact O-N 2.93Å; V438-P441 HydrophobicContact CG1-CB 4.08Å; V438-P441 HydrophobicContact CG1-CG 4.35Å; V438-P441 WeakPolarHBondContact O-CD 3.37Å
439	K	87.4	Confident	90.7	Very high	26 Å²	26	53 Å²	53	11%	0.113	25%	0.253	C	S	.	.	S	Bend	trans	-83.1	-28.6	-175.4	-59.3	-178.7	-167.4	-176.5	0	113.3	S432 I437 P441 D498	S432-K439 WeakPolarHBondContact O-CE 3.3Å; S432-K439 PolarHBondContact O-NZ 3.09Å; I437-K439 HydrophobicContact CG2-CD 4.26Å; I437-K439 HydrophobicContact CG2-CG 3.85Å; I437-K439 PolarHBondContact O-N 3.04Å; K439-P441 WeakPolarHBondContact O-CD 3.31Å; K439-D498 WeakPolarHBondContact CE-OD1 3.17Å; K439-D498 IonicContact NZ-OD1 2.68Å; K439-D498 PolarHBondContact NZ-OD1 3.38Å; K439-D498 IonicContact NZ-OD2 3.93Å; K439-D498 PolarHBondContact NZ-OD2 3.42Å
440	N	89.4	Confident	90.8	Very high	119 Å²	119	56.1 Å²	56.1	64%	0.636	27%	0.267	S	S	*	.	S	Bend	trans	-116.7	42.4	180	-61	-43.2	0	0	0	115.5
441	P	91.3	Very high	90.9	Very high	24 Å²	24	60.3 Å²	60.3	16%	0.156	29%	0.289	C	S	.	.			trans	-68.5	158.1	173.1	30.8	-30.1	0	0	0	109.5	T414 H417 V438 K439 T448 P449	T414-P441 HydrophobicContact CG2-CB 4.25Å; T414-P441 HydrophobicContact CG2-CG 4.16Å; H417-P441 PolarHBondContact CE1-O 2.99Å; V438-P441 HydrophobicContact CG1-CB 4.08Å; V438-P441 HydrophobicContact CG1-CG 4.35Å; V438-P441 WeakPolarHBondContact O-CD 3.37Å; K439-P441 WeakPolarHBondContact O-CD 3.31Å; P441-T448 WeakPolarHBondContact O-CA 3.36Å; P441-P449 HydrophobicContact CG-CG 4.07Å; P441-P449 WeakPolarHBondContact O-CD 3.29Å
442	R	93.6	Very high	91	Very high	157 Å²	157	60.3 Å²	60.3	59%	0.592	29%	0.289	S	S	*	.			trans	-115.2	133.8	175.9	-61	-164.7	-177.5	-168.7	-8.8	111.6	D446 K447 T448	R442-D446 WeakPolarHBondContact CD-OD1 3.19Å; R442-D446 IonicContact CZ-OD1 2.6Å; R442-D446 IonicContact CZ-OD2 2.62Å; R442-D446 IonicContact NE-OD1 3.31Å; R442-D446 IonicContact NH1-OD1 2.74Å; R442-D446 PolarHBondContact NH1-OD1 3.3Å; R442-D446 IonicContact NH1-OD2 3.05Å; R442-D446 PolarHBondContact NH1-OD2 3.09Å; R442-K447 WeakPolarHBondContact CA-O 3.33Å; R442-T448 HydrophobicContact CG-CG2 4.4Å
443	N	93.4	Very high	91.2	Very high	9 Å²	9	61 Å²	61	5%	0.048	29%	0.292	C	S	.	.			trans	-83.2	-177.2	175.3	75.3	12.1	0	0	0	112.1	Y412 D413 Y445 D446 K447	Y412-N443 WeakPolarHBondContact O-CA 3.24Å; Y412-N443 WeakPolarHBondContact O-CB 3.34Å; D413-N443 PolarHBondContact OD1-ND2 2.82Å; N443-Y445 PolarHBondContact O-N 2.75Å; N443-Y445 WeakPolarHBondContact OD1-CA 3.09Å; N443-Y445 WeakPolarHBondContact OD1-CB 3.39Å; N443-Y445 PolarHBondContact OD1-N 2.85Å; N443-D446 PolarHBondContact O-N 2.8Å; N443-K447 PolarHBondContact N-O 2.82Å; N443-K447 PolarHBondContact OD1-N 3.09Å
444	K	93.1	Very high	91.4	Very high	142 Å²	142	60.1 Å²	60.1	62%	0.617	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-14.8	-179.3	-174.7	176.8	173.7	-175.7	0	114.5	G411 Y412	G411-K444 WeakPolarHBondContact O-CB 3.48Å; G411-K444 PolarHBondContact O-N 3.31Å; Y412-K444 HydrophobicContact CD2-CB 4.37Å
445	Y	91.9	Very high	91.5	Very high	155 Å²	155	62.6 Å²	62.6	61%	0.608	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	12.7	179.3	-54.6	-84	0	0	0	112.6	N443 K447	N443-Y445 PolarHBondContact O-N 2.75Å; N443-Y445 WeakPolarHBondContact OD1-CA 3.09Å; N443-Y445 WeakPolarHBondContact OD1-CB 3.39Å; N443-Y445 PolarHBondContact OD1-N 2.85Å; Y445-K447 PolarHBondContact O-N 2.85Å; Y445-K447 VanDerWaalsContact O-N 3.12Å
446	D	91.8	Very high	91.7	Very high	103 Å²	103	65.5 Å²	65.5	55%	0.551	31%	0.305	S	S	*	.	S	Bend	trans	60.2	11.8	-174.6	-154.4	44.8	0	0	0	114.6	R442 N443	R442-D446 WeakPolarHBondContact CD-OD1 3.19Å; R442-D446 IonicContact CZ-OD1 2.6Å; R442-D446 IonicContact CZ-OD2 2.62Å; R442-D446 IonicContact NE-OD1 3.31Å; R442-D446 IonicContact NH1-OD1 2.74Å; R442-D446 PolarHBondContact NH1-OD1 3.3Å; R442-D446 IonicContact NH1-OD2 3.05Å; R442-D446 PolarHBondContact NH1-OD2 3.09Å; N443-D446 PolarHBondContact O-N 2.8Å
447	K	93.7	Very high	91.7	Very high	67 Å²	67	63.5 Å²	63.5	29%	0.291	30%	0.296	S	S	.	.			trans	-80.5	147.4	174.8	-66.3	-166.9	179.8	-162.9	0	111.1	H417 R442 N443 Y445 D451 V452 E455	H417-K447 PolarHBondContact NE2-O 2.97Å; R442-K447 WeakPolarHBondContact CA-O 3.33Å; N443-K447 PolarHBondContact N-O 2.82Å; N443-K447 PolarHBondContact OD1-N 3.09Å; Y445-K447 PolarHBondContact O-N 2.85Å; Y445-K447 VanDerWaalsContact O-N 3.12Å; K447-D451 HydrophobicContact CB-CB 3.95Å; K447-D451 HydrophobicContact CD-CB 4.3Å; K447-D451 HydrophobicContact CG-CB 4.18Å; K447-V452 HydrophobicContact CB-CG1 4.06Å; K447-V452 HydrophobicContact CD-CG1 3.58Å; K447-E455 IonicContact NZ-OE1 3.35Å; K447-E455 PolarHBondContact NZ-OE1 2.82Å
448	T	94.7	Very high	91.3	Very high	23 Å²	23	73.2 Å²	73.2	14%	0.141	34%	0.337	C	S	.	.			trans	-92.7	173.1	168.3	69.5	0	0	0	0	112	P441 R442 E450 D451	P441-T448 WeakPolarHBondContact O-CA 3.36Å; R442-T448 HydrophobicContact CG-CG2 4.4Å; T448-E450 PolarHBondContact O-N 3.33Å; T448-E450 PolarHBondContact OG1-N 2.94Å; T448-D451 WeakPolarHBondContact CB-OD2 3.03Å; T448-D451 PolarHBondContact N-OD2 3.17Å; T448-D451 PolarHBondContact O-N 2.8Å; T448-D451 PolarHBondContact OG1-N 3.11Å; T448-D451 PolarHBondContact OG1-OD2 2.89Å
449	P	93.9	Very high	90.8	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.9	168.4	-27.3	36.8	0	0	0	114.3	L416 C420 P441 V452 I453 L472	L416-P449 HydrophobicContact CB-CG 4.49Å; L416-P449 HydrophobicContact CD2-CB 4.33Å; L416-P449 HydrophobicContact CD2-CG 4.05Å; L416-P449 HydrophobicContact CG-CB 4.04Å; L416-P449 HydrophobicContact CG-CG 4.05Å; C420-P449 HydrophobicContact CB-CB 4.41Å; C420-P449 WeakPolarHBondContact CB-O 3.23Å; P441-P449 HydrophobicContact CG-CG 4.07Å; P441-P449 WeakPolarHBondContact O-CD 3.29Å; P449-V452 WeakPolarHBondContact O-CG2 3.44Å; P449-I453 WeakPolarHBondContact O-CG1 3.42Å; P449-L472 HydrophobicContact CB-CD1 4.42Å; P449-L472 HydrophobicContact CB-CD2 4.16Å
450	E	93.6	Very high	90.8	Very high	74 Å²	74	78.5 Å²	78.5	35%	0.346	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-36.5	176.9	-165.8	176.9	164.7	0	0	111.9	T448 V452 I453 R469 L472	T448-E450 PolarHBondContact O-N 3.33Å; T448-E450 PolarHBondContact OG1-N 2.94Å; E450-V452 PolarHBondContact O-N 3.3Å; E450-I453 HydrophobicContact CB-CD1 4.45Å; E450-I453 HydrophobicContact CG-CD1 3.87Å; E450-I453 WeakPolarHBondContact O-CD1 3.28Å; E450-I453 VanDerWaalsContact O-CG1 3.3Å; E450-I453 WeakPolarHBondContact O-CG1 3.44Å; E450-I453 PolarHBondContact O-N 2.83Å; E450-R469 VanDerWaalsContact OE1-CD 3.28Å; E450-R469 WeakPolarHBondContact OE1-CD 3.5Å; E450-R469 WeakPolarHBondContact OE1-CG 3.29Å; E450-R469 IonicContact OE1-CZ 2.68Å; E450-R469 IonicContact OE1-NE 2.71Å; E450-R469 PolarHBondContact OE1-NE 3.22Å; E450-R469 IonicContact OE1-NH2 3.78Å; E450-L472 HydrophobicContact CB-CD1 3.98Å; E450-L472 HydrophobicContact CG-CD1 4.36Å
451	D	92.9	Very high	90.8	Very high	99 Å²	99	74.6 Å²	74.6	53%	0.529	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-17.4	179.8	-60.6	-63.9	0	0	0	114	K447 T448	K447-D451 HydrophobicContact CB-CB 3.95Å; K447-D451 HydrophobicContact CD-CB 4.3Å; K447-D451 HydrophobicContact CG-CB 4.18Å; T448-D451 WeakPolarHBondContact CB-OD2 3.03Å; T448-D451 PolarHBondContact N-OD2 3.17Å; T448-D451 PolarHBondContact O-N 2.8Å; T448-D451 PolarHBondContact OG1-N 3.11Å; T448-D451 PolarHBondContact OG1-OD2 2.89Å
452	V	93.6	Very high	90.8	Very high	1 Å²	1	78.3 Å²	78.3	1%	0.006	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	0.3	-178.5	-61	0	0	0	0	114	C420 K421 K447 P449 E450 C454 E455	C420-V452 HydrophobicContact CB-CG2 4.17Å; K421-V452 WeakPolarHBondContact CA-O 3.49Å; K421-V452 HydrophobicContact CB-CB 4.3Å; K421-V452 HydrophobicContact CB-CG2 4.12Å; K421-V452 HydrophobicContact CG-CB 4.47Å; K447-V452 HydrophobicContact CB-CG1 4.06Å; K447-V452 HydrophobicContact CD-CG1 3.58Å; P449-V452 WeakPolarHBondContact O-CG2 3.44Å; E450-V452 PolarHBondContact O-N 3.3Å; V452-C454 PolarHBondContact O-N 3.33Å; V452-C454 VanDerWaalsContact O-N 3.12Å; V452-E455 VanDerWaalsContact O-CB 3.29Å; V452-E455 WeakPolarHBondContact O-CB 3.32Å; V452-E455 PolarHBondContact O-N 3.32Å
453	I	93.9	Very high	90.6	Very high	14 Å²	14	78.1 Å²	78.1	7%	0.072	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	120.4	-174.2	-61.6	169.8	0	0	0	111.4	C420 P449 E450 E455 K465 I468 R469 L472	C420-I453 HydrophobicContact CB-CG1 4.14Å; C420-I453 WeakPolarHBondContact O-CA 3.12Å; P449-I453 WeakPolarHBondContact O-CG1 3.42Å; E450-I453 HydrophobicContact CB-CD1 4.45Å; E450-I453 HydrophobicContact CG-CD1 3.87Å; E450-I453 WeakPolarHBondContact O-CD1 3.28Å; E450-I453 VanDerWaalsContact O-CG1 3.3Å; E450-I453 WeakPolarHBondContact O-CG1 3.44Å; E450-I453 PolarHBondContact O-N 2.83Å; I453-E455 PolarHBondContact O-N 3.5Å; I453-K465 HydrophobicContact CG2-CB 4.07Å; I453-K465 HydrophobicContact CG2-CG 4Å; I453-I468 HydrophobicContact CB-CG2 4.46Å; I453-I468 HydrophobicContact CD1-CB 4.45Å; I453-I468 HydrophobicContact CD1-CG2 3.81Å; I453-I468 HydrophobicContact CG1-CG2 3.74Å; I453-I468 HydrophobicContact CG2-CB 4.03Å; I453-I468 HydrophobicContact CG2-CD1 4.07Å; I453-I468 HydrophobicContact CG2-CG2 3.87Å; I453-R469 HydrophobicContact CD1-CB 4.17Å; I453-L472 HydrophobicContact CD1-CD1 4Å; I453-L472 HydrophobicContact CG1-CD1 4.41Å
454	C	91.7	Very high	90.4	Very high	2 Å²	2	79.4 Å²	79.4	1%	0.014	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	29.4	178.6	-67.5	0	0	0	0	114.2	C420 V452 S457 K460 K465	C420-C454 PolarHBondContact O-N 3.34Å; V452-C454 PolarHBondContact O-N 3.33Å; V452-C454 VanDerWaalsContact O-N 3.12Å; C454-S457 VanDerWaalsContact CA-OG 3.31Å; C454-S457 WeakPolarHBondContact CA-OG 3.29Å; C454-S457 WeakPolarHBondContact CB-OG 3.46Å; C454-S457 PolarHBondContact O-OG 3.04Å; C454-K460 WeakPolarHBondContact O-CE 3.4Å; C454-K460 PolarHBondContact O-NZ 2.82Å; C454-K465 HydrophobicContact CB-CG 4.17Å
455	E	90.5	Very high	90.4	Very high	72 Å²	72	76.1 Å²	76.1	34%	0.336	36%	0.361	S	S	.	.	S	Bend	trans	-62.3	-43.8	172.2	-172.2	-176.6	-107.1	0	0	110.9	K421 K447 V452 I453 K460	K421-E455 WeakPolarHBondContact CE-OE2 3.4Å; K421-E455 HydrophobicContact CG-CB 4.34Å; K421-E455 IonicContact NZ-OE2 2.64Å; K421-E455 PolarHBondContact O-N 3.25Å; K447-E455 IonicContact NZ-OE1 3.35Å; K447-E455 PolarHBondContact NZ-OE1 2.82Å; V452-E455 VanDerWaalsContact O-CB 3.29Å; V452-E455 WeakPolarHBondContact O-CB 3.32Å; V452-E455 PolarHBondContact O-N 3.32Å; I453-E455 PolarHBondContact O-N 3.5Å; E455-K460 PolarHBondContact O-NZ 2.63Å
456	R	88.4	Confident	90.3	Very high	150 Å²	150	72.6 Å²	72.6	57%	0.566	35%	0.35	S	S	*	.	S	Bend	trans	-114.4	5	-177.2	-63.9	-174.2	174.3	179.5	-4	114.6	K421 F422	K421-R456 HydrophobicContact CG-CB 4.27Å; K421-R456 HydrophobicContact CG-CG 4.06Å; K421-R456 CarbonylContact O-C 3.58Å; K421-R456 WeakPolarHBondContact O-CA 3.5Å; K421-R456 PolarHBondContact O-N 3.46Å; F422-R456 HydrophobicContact CD1-CB 4.03Å; F422-R456 HydrophobicContact CE1-CB 3.93Å
457	S	86.8	Confident	90.2	Very high	11 Å²	11	72.5 Å²	72.5	8%	0.077	34%	0.342	C	S	.	.			trans	-66.4	152.2	178	66.3	0	0	0	0	112.6	K421 F422 C454 N459 K460	K421-S457 PolarHBondContact O-N 3.36Å; F422-S457 VanDerWaalsContact O-CA 3.27Å; F422-S457 WeakPolarHBondContact O-CA 3.29Å; F422-S457 WeakPolarHBondContact O-CB 3.21Å; C454-S457 VanDerWaalsContact CA-OG 3.31Å; C454-S457 WeakPolarHBondContact CA-OG 3.29Å; C454-S457 WeakPolarHBondContact CB-OG 3.46Å; C454-S457 PolarHBondContact O-OG 3.04Å; S457-N459 VanDerWaalsContact CB-O 3.27Å; S457-N459 WeakPolarHBondContact CB-O 3.45Å; S457-N459 PolarHBondContact OG-O 3.37Å; S457-K460 WeakPolarHBondContact O-CE 3.47Å; S457-K460 WeakPolarHBondContact OG-CG 3.36Å
458	K	82.7	Confident	90.1	Very high	216 Å²	216	69.3 Å²	69.3	94%	0.939	33%	0.328	S	S	*	.	S	Bend	trans	-73.8	-41.1	170.9	-64.5	173.4	-176.7	168.5	0	111.4
459	N	79.7	Confident	89.9	Confident	97 Å²	97	71.5 Å²	71.5	52%	0.519	33%	0.334	S	S	.	.			trans	-96.6	128.9	173.9	-176.3	-6.7	0	0	0	109.8	S457 S461 L464	S457-N459 VanDerWaalsContact CB-O 3.27Å; S457-N459 WeakPolarHBondContact CB-O 3.45Å; S457-N459 PolarHBondContact OG-O 3.37Å; N459-S461 WeakPolarHBondContact OD1-CB 3.5Å; N459-S461 PolarHBondContact OD1-N 3.36Å; N459-L464 HydrophobicContact CB-CD2 4.21Å
460	K	85.9	Confident	89.7	Confident	114 Å²	114	74.5 Å²	74.5	50%	0.496	35%	0.348	S	S	.	.			trans	-120.4	23.2	-179.4	-63.8	-170.9	176.4	-162.1	0	113.3	C454 E455 S457	C454-K460 WeakPolarHBondContact O-CE 3.4Å; C454-K460 PolarHBondContact O-NZ 2.82Å; E455-K460 PolarHBondContact O-NZ 2.63Å; S457-K460 WeakPolarHBondContact O-CE 3.47Å; S457-K460 WeakPolarHBondContact OG-CG 3.36Å
461	S	90.6	Very high	89.5	Confident	36 Å²	36	72.8 Å²	72.8	25%	0.252	34%	0.338	S	S	.	.			trans	-49.1	141.3	173.9	177.3	0	0	0	0	111.6	N459 E463 L464 K465	N459-S461 WeakPolarHBondContact OD1-CB 3.5Å; N459-S461 PolarHBondContact OD1-N 3.36Å; S461-E463 VanDerWaalsContact C-N 3.3Å; S461-E463 PolarHBondContact OG-N 3.23Å; S461-E463 PolarHBondContact OG-OE2 3.37Å; S461-L464 PolarHBondContact O-N 2.95Å; S461-K465 PolarHBondContact O-N 3.33Å
462	V	90.3	Very high	89.3	Confident	102 Å²	102	68.7 Å²	68.7	62%	0.618	32%	0.317	S	S	*	.	H	α-helix	trans	-62.2	-41	175.7	-179.3	0	0	0	0	110.3	L464 K465 E466	V462-L464 VanDerWaalsContact C-N 3.3Å; V462-L464 PolarHBondContact O-N 2.83Å; V462-K465 WeakPolarHBondContact O-CA 3.3Å; V462-K465 WeakPolarHBondContact O-CB 3.33Å; V462-K465 PolarHBondContact O-N 3.49Å; V462-E466 HydrophobicContact CG1-CG 4.32Å; V462-E466 PolarHBondContact O-N 3.38Å
463	E	89.4	Confident	88.8	Confident	154 Å²	154	73.9 Å²	73.9	72%	0.72	34%	0.339	S	S	*	.	H	α-helix	trans	-59.2	-41.7	179.6	-58.5	153.3	153.8	0	0	111.6	S461 K465 E466 R467	S461-E463 VanDerWaalsContact C-N 3.3Å; S461-E463 PolarHBondContact OG-N 3.23Å; S461-E463 PolarHBondContact OG-OE2 3.37Å; E463-K465 VanDerWaalsContact C-N 3.33Å; E463-K465 PolarHBondContact O-N 3.17Å; E463-E466 PolarHBondContact O-N 2.92Å; E463-R467 VanDerWaalsContact O-CB 3.31Å; E463-R467 WeakPolarHBondContact O-CB 3.47Å; E463-R467 PolarHBondContact O-N 3.09Å
464	L	90.1	Very high	88.2	Confident	35 Å²	35	73.3 Å²	73.3	18%	0.183	34%	0.337	C	S	.	.	H	α-helix	trans	-64.4	-38.4	176.1	-178.3	62.6	0	0	0	111.4	A425 N459 S461 V462 I468	A425-L464 HydrophobicContact CB-CD1 3.74Å; N459-L464 HydrophobicContact CB-CD2 4.21Å; S461-L464 PolarHBondContact O-N 2.95Å; V462-L464 VanDerWaalsContact C-N 3.3Å; V462-L464 PolarHBondContact O-N 2.83Å; L464-I468 HydrophobicContact CD1-CD1 4.18Å; L464-I468 HydrophobicContact CG-CD1 4.13Å; L464-I468 WeakPolarHBondContact O-CB 3.11Å; L464-I468 VanDerWaalsContact O-CG1 3.28Å; L464-I468 WeakPolarHBondContact O-CG1 3.48Å; L464-I468 PolarHBondContact O-N 2.9Å
465	K	91.6	Very high	87.8	Confident	74 Å²	74	73.4 Å²	73.4	32%	0.322	34%	0.337	S	S	.	.	H	α-helix	trans	-67.4	-44.5	175.9	-63.2	-167.9	-179.4	-167.2	0	112	I453 C454 S461 V462 E463 I468 R469	I453-K465 HydrophobicContact CG2-CB 4.07Å; I453-K465 HydrophobicContact CG2-CG 4Å; C454-K465 HydrophobicContact CB-CG 4.17Å; S461-K465 PolarHBondContact O-N 3.33Å; V462-K465 WeakPolarHBondContact O-CA 3.3Å; V462-K465 WeakPolarHBondContact O-CB 3.33Å; V462-K465 PolarHBondContact O-N 3.49Å; E463-K465 VanDerWaalsContact C-N 3.33Å; E463-K465 PolarHBondContact O-N 3.17Å; K465-I468 PolarHBondContact O-N 3.45Å; K465-R469 WeakPolarHBondContact O-CB 3.35Å; K465-R469 PolarHBondContact O-N 3.42Å
466	E	90.5	Very high	87.5	Confident	80 Å²	80	72.4 Å²	72.4	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-64.8	-42.7	177.1	-62.3	-45.9	134.3	0	0	111.4	V462 E463 I468 R469 E470	V462-E466 HydrophobicContact CG1-CG 4.32Å; V462-E466 PolarHBondContact O-N 3.38Å; E463-E466 PolarHBondContact O-N 2.92Å; E466-I468 PolarHBondContact O-N 3.05Å; E466-R469 CarbonylContact O-C 3.55Å; E466-R469 PolarHBondContact O-N 3.17Å; E466-R469 IonicContact OE1-CZ 3.96Å; E466-R469 IonicContact OE1-NH1 2.99Å; E466-R469 PolarHBondContact OE1-NH1 3.11Å; E466-R469 IonicContact OE2-CZ 2.68Å; E466-R469 IonicContact OE2-NH1 2.91Å; E466-R469 PolarHBondContact OE2-NH1 2.82Å; E466-E470 WeakPolarHBondContact O-CG 3.5Å; E466-E470 PolarHBondContact O-N 3.1Å
467	R	89.4	Confident	87.5	Confident	101 Å²	101	65.4 Å²	65.4	38%	0.381	30%	0.304	S	S	.	.	H	α-helix	trans	-59.5	-43.2	175.6	-176.5	171.4	173.2	-172	-9.8	112.3	D426 E463 E470 Y471	D426-R467 IonicContact OD1-NH2 3.63Å; E463-R467 VanDerWaalsContact O-CB 3.31Å; E463-R467 WeakPolarHBondContact O-CB 3.47Å; E463-R467 PolarHBondContact O-N 3.09Å; R467-E470 PolarHBondContact O-N 3.3Å; R467-Y471 HydrophobicContact CG-CD2 4.36Å; R467-Y471 HydrophobicContact CG-CE2 3.68Å; R467-Y471 PolarHBondContact NE-OH 3.03Å; R467-Y471 PolarHBondContact NH2-OH 2.85Å; R467-Y471 VanDerWaalsContact NH2-OH 3.15Å; R467-Y471 WeakPolarHBondContact O-CD2 3.31Å; R467-Y471 PolarHBondContact O-N 2.9Å; R467-Y471 VanDerWaalsContact O-N 3.14Å
468	I	91.6	Very high	87.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-43.4	174.5	-70.4	168.2	0	0	0	111.2	C420 A425 V428 I453 L464 K465 E466 E470 Y471 L472	C420-I468 HydrophobicContact CB-CG2 4.39Å; A425-I468 HydrophobicContact CB-CD1 4.17Å; A425-I468 HydrophobicContact CB-CG1 3.72Å; V428-I468 HydrophobicContact CG1-CG2 4.3Å; V428-I468 HydrophobicContact CG2-CG2 4.17Å; I453-I468 HydrophobicContact CB-CG2 4.46Å; I453-I468 HydrophobicContact CD1-CB 4.45Å; I453-I468 HydrophobicContact CD1-CG2 3.81Å; I453-I468 HydrophobicContact CG1-CG2 3.74Å; I453-I468 HydrophobicContact CG2-CB 4.03Å; I453-I468 HydrophobicContact CG2-CD1 4.07Å; I453-I468 HydrophobicContact CG2-CG2 3.87Å; L464-I468 HydrophobicContact CD1-CD1 4.18Å; L464-I468 HydrophobicContact CG-CD1 4.13Å; L464-I468 WeakPolarHBondContact O-CB 3.11Å; L464-I468 VanDerWaalsContact O-CG1 3.28Å; L464-I468 WeakPolarHBondContact O-CG1 3.48Å; L464-I468 PolarHBondContact O-N 2.9Å; K465-I468 PolarHBondContact O-N 3.45Å; E466-I468 PolarHBondContact O-N 3.05Å; I468-E470 VanDerWaalsContact C-N 3.3Å; I468-E470 PolarHBondContact O-N 2.87Å; I468-Y471 PolarHBondContact O-N 3.29Å; I468-L472 HydrophobicContact CG2-CD1 4.43Å; I468-L472 WeakPolarHBondContact O-CG 3.02Å; I468-L472 PolarHBondContact O-N 2.88Å; I468-L472 VanDerWaalsContact O-N 3.08Å
469	R	91.1	Very high	87.9	Confident	69 Å²	69	54.9 Å²	54.9	26%	0.26	26%	0.258	S	S	.	.	H	α-helix	trans	-62.1	-36	175.4	179.5	-176.2	-70.9	125.9	3.2	112.3	E450 I453 K465 E466 L472 K473	E450-R469 VanDerWaalsContact OE1-CD 3.28Å; E450-R469 WeakPolarHBondContact OE1-CD 3.5Å; E450-R469 WeakPolarHBondContact OE1-CG 3.29Å; E450-R469 IonicContact OE1-CZ 2.68Å; E450-R469 IonicContact OE1-NE 2.71Å; E450-R469 PolarHBondContact OE1-NE 3.22Å; E450-R469 IonicContact OE1-NH2 3.78Å; I453-R469 HydrophobicContact CD1-CB 4.17Å; K465-R469 WeakPolarHBondContact O-CB 3.35Å; K465-R469 PolarHBondContact O-N 3.42Å; E466-R469 CarbonylContact O-C 3.55Å; E466-R469 PolarHBondContact O-N 3.17Å; E466-R469 IonicContact OE1-CZ 3.96Å; E466-R469 IonicContact OE1-NH1 2.99Å; E466-R469 PolarHBondContact OE1-NH1 3.11Å; E466-R469 IonicContact OE2-CZ 2.68Å; E466-R469 IonicContact OE2-NH1 2.91Å; E466-R469 PolarHBondContact OE2-NH1 2.82Å; R469-L472 PolarHBondContact O-N 3.03Å; R469-K473 WeakPolarHBondContact O-CG 3.5Å; R469-K473 PolarHBondContact O-N 3.4Å
470	E	88.7	Confident	88.2	Confident	64 Å²	64	50.3 Å²	50.3	30%	0.299	23%	0.233	S	C	.	.	H	α-helix	trans	-64.9	-44	174.6	-75.8	-170.5	178.5	0	0	112	E466 R467 I468 L472 K473 K531	E466-E470 WeakPolarHBondContact O-CG 3.5Å; E466-E470 PolarHBondContact O-N 3.1Å; R467-E470 PolarHBondContact O-N 3.3Å; I468-E470 VanDerWaalsContact C-N 3.3Å; I468-E470 PolarHBondContact O-N 2.87Å; E470-L472 VanDerWaalsContact C-N 3.29Å; E470-L472 PolarHBondContact O-N 3.06Å; E470-K473 PolarHBondContact O-N 3.19Å; E470-K473 VanDerWaalsContact O-N 3.16Å; E470-K531 WeakPolarHBondContact OE1-CE 3.28Å; E470-K531 IonicContact OE1-NZ 3.56Å; E470-K531 PolarHBondContact OE1-NZ 2.94Å; E470-K531 IonicContact OE2-NZ 3.93Å; E470-K531 PolarHBondContact OE2-NZ 3.27Å
471	Y	89.4	Confident	88.2	Confident	37 Å²	37	46.6 Å²	46.6	15%	0.145	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-30.4	175.5	-63.5	-37.8	0	0	0	113.3	A425 N429 S432 R467 I468 K473 G474	A425-Y471 HydrophobicContact CB-CE2 4.4Å; A425-Y471 WeakPolarHBondContact O-CE2 3.16Å; N429-Y471 HydrophobicContact CB-CD1 4.23Å; N429-Y471 HydrophobicContact CB-CD2 3.87Å; N429-Y471 HydrophobicContact CB-CE1 4.13Å; N429-Y471 HydrophobicContact CB-CE2 3.76Å; N429-Y471 HydrophobicContact CB-CG 4.12Å; N429-Y471 WeakPolarHBondContact OD1-CD1 3.28Å; N429-Y471 WeakPolarHBondContact OD1-CE1 3.44Å; S432-Y471 VanDerWaalsContact CB-O 3.29Å; S432-Y471 WeakPolarHBondContact CB-O 3.39Å; S432-Y471 PolarHBondContact OG-O 3.48Å; R467-Y471 HydrophobicContact CG-CD2 4.36Å; R467-Y471 HydrophobicContact CG-CE2 3.68Å; R467-Y471 PolarHBondContact NE-OH 3.03Å; R467-Y471 PolarHBondContact NH2-OH 2.85Å; R467-Y471 VanDerWaalsContact NH2-OH 3.15Å; R467-Y471 WeakPolarHBondContact O-CD2 3.31Å; R467-Y471 PolarHBondContact O-N 2.9Å; R467-Y471 VanDerWaalsContact O-N 3.14Å; I468-Y471 PolarHBondContact O-N 3.29Å; Y471-K473 VanDerWaalsContact C-N 3.32Å; Y471-G474 PolarHBondContact O-N 2.9Å
472	L	88.6	Confident	87.8	Confident	14 Å²	14	46.1 Å²	46.1	7%	0.073	21%	0.211	C	C	.	.	H	α-helix	trans	-71.1	-23.2	174.8	-71.8	173.6	0	0	0	113.6	L416 V428 P449 E450 I453 I468 R469 E470 G474	L416-L472 HydrophobicContact CD1-CD2 3.99Å; L416-L472 HydrophobicContact CD2-CD2 3.95Å; L416-L472 HydrophobicContact CG-CD2 4.12Å; V428-L472 HydrophobicContact CG1-CD2 4.33Å; V428-L472 HydrophobicContact CG1-CG 4.41Å; P449-L472 HydrophobicContact CB-CD1 4.42Å; P449-L472 HydrophobicContact CB-CD2 4.16Å; E450-L472 HydrophobicContact CB-CD1 3.98Å; E450-L472 HydrophobicContact CG-CD1 4.36Å; I453-L472 HydrophobicContact CD1-CD1 4Å; I453-L472 HydrophobicContact CG1-CD1 4.41Å; I468-L472 HydrophobicContact CG2-CD1 4.43Å; I468-L472 WeakPolarHBondContact O-CG 3.02Å; I468-L472 PolarHBondContact O-N 2.88Å; I468-L472 VanDerWaalsContact O-N 3.08Å; R469-L472 PolarHBondContact O-N 3.03Å; E470-L472 VanDerWaalsContact C-N 3.29Å; E470-L472 PolarHBondContact O-N 3.06Å; L472-G474 PolarHBondContact O-N 3.28Å
473	K	84.3	Confident	87.3	Confident	109 Å²	109	41.4 Å²	41.4	47%	0.474	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-1.1	177.5	-70.4	166.8	-179.1	170.6	0	113.9	R469 E470 Y471 P529	R469-K473 WeakPolarHBondContact O-CG 3.5Å; R469-K473 PolarHBondContact O-N 3.4Å; E470-K473 PolarHBondContact O-N 3.19Å; E470-K473 VanDerWaalsContact O-N 3.16Å; Y471-K473 VanDerWaalsContact C-N 3.32Å; K473-P529 HydrophobicContact CB-CG 4.44Å; K473-P529 WeakPolarHBondContact O-CD 3.43Å
474	G	80.1	Confident	86.2	Confident	2 Å²	2	41.4 Å²	41.4	2%	0.021	18%	0.183	C	C	.	.			trans	88.2	161.5	175.9	0	0	0	0	0	114.1	Y471 L472	Y471-G474 PolarHBondContact O-N 2.9Å; L472-G474 PolarHBondContact O-N 3.28Å
475	H	83.3	Confident	85	Confident	5 Å²	5	44.4 Å²	44.4	2%	0.023	20%	0.199	C	C	.	.			trans	-107.1	101.3	-164.3	-73.4	40.3	0	0	0	110.5	N429 S432 S433 Y477 S496 P497 P526	N429-H475 PolarHBondContact O-NE2 3.02Å; N429-H475 PolarHBondContact OD1-NE2 3.45Å; S432-H475 PolarHBondContact OG-CE1 3.49Å; S433-H475 PolarHBondContact OG-CD2 2.9Å; S433-H475 PolarHBondContact OG-NE2 3.27Å; H475-Y477 HydrophobicContact CB-CE2 4.16Å; H475-Y477 WeakPolarHBondContact O-CE2 3.45Å; H475-S496 WeakPolarHBondContact O-CB 3.24Å; H475-P497 WeakPolarHBondContact O-CD 3.17Å; H475-P526 HydrophobicContact CB-CB 3.89Å; H475-P526 VanDerWaalsContact CD2-CB 3.42Å; H475-P526 WeakPolarHBondContact CD2-CB 3.08Å
476	Y	85.1	Confident	83.6	Confident	50 Å²	50	47.3 Å²	47.3	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	144.6	-178.8	-69.8	-99.7	0	0	0	111.5	L494 W495 L527 P529	Y476-L494 HydrophobicContact CD1-CB 4.06Å; Y476-L494 HydrophobicContact CD1-CD2 4.16Å; Y476-L494 HydrophobicContact CD1-CG 4.32Å; Y476-W495 CarbonylContact C-O 3.08Å; Y476-W495 VanDerWaalsContact CA-O 3.28Å; Y476-W495 WeakPolarHBondContact CA-O 3.21Å; Y476-L527 WeakPolarHBondContact CA-O 3.41Å; Y476-L527 WeakPolarHBondContact CB-O 3.27Å; Y476-L527 PolarHBondContact N-O 3.34Å; Y476-L527 PolarHBondContact O-N 2.74Å; Y476-P529 HydrophobicContact CD2-CB 3.66Å; Y476-P529 HydrophobicContact CD2-CG 3.95Å; Y476-P529 HydrophobicContact CE1-CB 4.45Å; Y476-P529 HydrophobicContact CE2-CB 3.59Å; Y476-P529 HydrophobicContact CE2-CG 3.68Å; Y476-P529 HydrophobicContact CG-CB 4.15Å
477	Y	87.3	Confident	82.5	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.9	-177.9	-58.7	-100.9	0	0	0	109.1	H475 P479 W495 P497 F523 A524 P526 L732	H475-Y477 HydrophobicContact CB-CE2 4.16Å; H475-Y477 WeakPolarHBondContact O-CE2 3.45Å; Y477-P479 WeakPolarHBondContact O-CD 3.22Å; Y477-W495 AromaticContact CD2-CE3 3.58Å; Y477-W495 HydrophobicContact CD2-CE3 3.58Å; Y477-W495 AromaticContact CD2-CZ3 3.73Å; Y477-W495 HydrophobicContact CD2-CZ3 3.73Å; Y477-W495 HydrophobicContact CE2-CE3 4.27Å; Y477-W495 AromaticContact CE2-CZ3 3.94Å; Y477-W495 HydrophobicContact CE2-CZ3 3.94Å; Y477-W495 HydrophobicContact CG-CE3 4.12Å; Y477-W495 HydrophobicContact CG-CZ3 4.43Å; Y477-W495 PolarHBondContact N-O 3.32Å; Y477-W495 PolarHBondContact O-N 3.05Å; Y477-P497 HydrophobicContact CE2-CG 4.43Å; Y477-F523 AromaticContact CD1-CD2 3.87Å; Y477-F523 HydrophobicContact CD1-CD2 3.87Å; Y477-F523 HydrophobicContact CD1-CE2 4.06Å; Y477-F523 HydrophobicContact CE1-CE2 4.3Å; Y477-A524 CarbonylContact C-O 3.52Å; Y477-A524 WeakPolarHBondContact CA-O 3.27Å; Y477-P526 HydrophobicContact CE1-CB 4.13Å; Y477-P526 HydrophobicContact CE2-CB 4.39Å; Y477-L732 HydrophobicContact CE1-CD1 3.78Å; Y477-L732 HydrophobicContact CE2-CD2 4.37Å
478	V	88.7	Confident	81.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	96.2	178.7	-173	0	0	0	0	108.5	I491 L494 F523 A524 A532 F535 R536 W539	V478-I491 HydrophobicContact CG1-CG2 3.88Å; V478-L494 HydrophobicContact CG2-CD1 4.28Å; V478-F523 WeakPolarHBondContact O-CA 3.23Å; V478-A524 PolarHBondContact N-O 2.71Å; V478-A524 PolarHBondContact O-N 3.14Å; V478-A524 VanDerWaalsContact O-N 3.11Å; V478-A532 HydrophobicContact CG2-CB 3.89Å; V478-A532 WeakPolarHBondContact CG2-O 3.39Å; V478-F535 HydrophobicContact CB-CD1 4.14Å; V478-F535 HydrophobicContact CG1-CD1 4.25Å; V478-F535 HydrophobicContact CG2-CD1 4.18Å; V478-R536 HydrophobicContact CG1-CB 3.95Å; V478-R536 HydrophobicContact CG1-CG 4.25Å; V478-R536 HydrophobicContact CG2-CB 4.44Å; V478-W539 HydrophobicContact CG1-CE3 3.96Å; V478-W539 HydrophobicContact CG1-CZ3 3.96Å
479	P	89.5	Confident	81	Confident	6 Å²	6	45.5 Å²	45.5	4%	0.039	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	148.1	-176.5	31.1	-34	0	0	0	112.9	Y477 L481 G492 E493 L520	Y477-P479 WeakPolarHBondContact O-CD 3.22Å; P479-L481 HydrophobicContact CB-CD2 4.33Å; P479-G492 PolarHBondContact O-N 2.64Å; P479-E493 VanDerWaalsContact CD-O 3.28Å; P479-E493 WeakPolarHBondContact CD-O 3.44Å; P479-L520 HydrophobicContact CB-CD1 3.45Å; P479-L520 VanDerWaalsContact CB-CD1 3.45Å
480	L	87.4	Confident	80.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	120	163.6	-173	70.3	0	0	0	109.1	P489 I491 R521 A522 W539 F562 E563	L480-P489 HydrophobicContact CD1-CB 4.04Å; L480-P489 HydrophobicContact CG-CB 4.28Å; L480-I491 HydrophobicContact CD1-CG1 3.72Å; L480-R521 PolarHBondContact O-N 2.81Å; L480-A522 HydrophobicContact CB-CB 4.2Å; L480-A522 HydrophobicContact CD2-CB 4.47Å; L480-A522 PolarHBondContact N-O 2.65Å; L480-W539 HydrophobicContact CB-CH2 3.7Å; L480-W539 HydrophobicContact CB-CZ2 4.1Å; L480-W539 HydrophobicContact CD1-CH2 4.26Å; L480-W539 HydrophobicContact CD1-CZ2 3.95Å; L480-W539 HydrophobicContact CD2-CZ2 4.19Å; L480-W539 HydrophobicContact CG-CH2 4.4Å; L480-W539 HydrophobicContact CG-CZ2 4.31Å; L480-F562 HydrophobicContact CD1-CB 4.34Å; L480-F562 HydrophobicContact CD2-CB 4.11Å; L480-E563 HydrophobicContact CD2-CG 3.7Å
481	L	85.6	Confident	80.4	Confident	37 Å²	37	43 Å²	43	19%	0.194	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139.2	-179.1	-56.8	179.5	0	0	0	110	P479 P489 V490 L518 T519 L520	P479-L481 HydrophobicContact CB-CD2 4.33Å; L481-P489 CarbonylContact O-C 3.55Å; L481-P489 VanDerWaalsContact O-CA 3.31Å; L481-P489 WeakPolarHBondContact O-CA 3.43Å; L481-P489 WeakPolarHBondContact O-CB 3.41Å; L481-V490 PolarHBondContact N-O 2.96Å; L481-V490 PolarHBondContact O-N 3.44Å; L481-L518 HydrophobicContact CB-CB 4.22Å; L481-L518 HydrophobicContact CB-CD1 4.43Å; L481-L518 HydrophobicContact CD1-CB 4.45Å; L481-L518 HydrophobicContact CD1-CD1 4.09Å; L481-T519 CarbonylContact C-O 3.57Å; L481-T519 WeakPolarHBondContact CA-O 3.37Å; L481-L520 HydrophobicContact CD2-CB 4.41Å; L481-L520 HydrophobicContact CD2-CD1 4.01Å
482	R	82.7	Confident	79.9	Confident	26 Å²	26	41.6 Å²	41.6	10%	0.098	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.9	174.5	-179.7	177.2	-86.8	139.7	-8.7	110.4	P489 T519 R521 P558 E559 E563	R482-P489 HydrophobicContact CB-CB 4.18Å; R482-T519 PolarHBondContact N-O 3.06Å; R482-T519 PolarHBondContact O-N 3.43Å; R482-T519 PolarHBondContact O-OG1 3.35Å; R482-R521 HydrophobicContact CB-CG 3.7Å; R482-P558 PolarHBondContact NH2-O 3.47Å; R482-E559 PolarHBondContact NH1-O 2.94Å; R482-E559 PolarHBondContact NH2-O 2.99Å; R482-E563 IonicContact CZ-OE1 2.69Å; R482-E563 IonicContact NH1-OE1 3.44Å; R482-E563 PolarHBondContact NH1-OE1 2.86Å; R482-E563 IonicContact NH1-OE2 3.17Å; R482-E563 IonicContact NH2-OE1 2.69Å; R482-E563 IonicContact NH2-OE2 3.76Å
483	A	78.8	Confident	79.7	Confident	3 Å²	3	47.6 Å²	47.6	3%	0.025	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	149.7	171.8	0	0	0	0	0	112	D485 S487 P516 V517 L518	A483-D485 WeakPolarHBondContact CB-OD1 3.48Å; A483-D485 PolarHBondContact O-N 2.81Å; A483-S487 WeakPolarHBondContact CB-OG 3.32Å; A483-P516 HydrophobicContact CB-CB 3.8Å; A483-P516 HydrophobicContact CB-CG 3.7Å; A483-V517 WeakPolarHBondContact CA-O 3.31Å; A483-L518 HydrophobicContact CB-CD2 4.08Å
484	E	67.5	Low	79.7	Confident	154 Å²	154	43.8 Å²	43.8	72%	0.72	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-15.5	177.1	-58.4	-170.2	152.2	0	0	114.1	T486 T519	E484-T486 VanDerWaalsContact C-N 3.3Å; E484-T486 PolarHBondContact O-N 2.82Å; E484-T519 HydrophobicContact CG-CG2 4.13Å
485	D	64.1	Low	79.8	Confident	97 Å²	97	45.2 Å²	45.2	52%	0.519	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	8.2	-173	71.3	-9.4	0	0	0	114.8	A483 S487	A483-D485 WeakPolarHBondContact CB-OD1 3.48Å; A483-D485 PolarHBondContact O-N 2.81Å; D485-S487 VanDerWaalsContact OD1-CB 3.28Å; D485-S487 WeakPolarHBondContact OD1-CB 3.42Å; D485-S487 PolarHBondContact OD1-N 3.44Å
486	T	60.9	Low	79.6	Confident	135 Å²	135	45 Å²	45	83%	0.828	24%	0.244	S	C	*	.			trans	74	17.7	-174	-16.7	0	0	0	0	114.9	E484	E484-T486 VanDerWaalsContact C-N 3.3Å; E484-T486 PolarHBondContact O-N 2.82Å
487	S	68.2	Low	78.7	Confident	43 Å²	43	43.4 Å²	43.4	30%	0.301	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-61.1	161.3	173.4	87.5	0	0	0	0	113.1	A483 D485	A483-S487 WeakPolarHBondContact CB-OG 3.32Å; D485-S487 VanDerWaalsContact OD1-CB 3.28Å; D485-S487 WeakPolarHBondContact OD1-CB 3.42Å; D485-S487 PolarHBondContact OD1-N 3.44Å
488	S	69.6	Low	77.6	Confident	88 Å²	88	45.7 Å²	45.7	62%	0.615	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-58.3	132.1	169.2	54.8	0	0	0	0	110.6
489	P	81.1	Confident	76.1	Confident	12 Å²	12	49.3 Å²	49.3	8%	0.078	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-68.9	146	-179.2	30.5	-36.7	0	0	0	111.6	L480 L481 R482 F562	L480-P489 HydrophobicContact CD1-CB 4.04Å; L480-P489 HydrophobicContact CG-CB 4.28Å; L481-P489 CarbonylContact O-C 3.55Å; L481-P489 VanDerWaalsContact O-CA 3.31Å; L481-P489 WeakPolarHBondContact O-CA 3.43Å; L481-P489 WeakPolarHBondContact O-CB 3.41Å; R482-P489 HydrophobicContact CB-CB 4.18Å; P489-F562 HydrophobicContact CG-CB 3.76Å; P489-F562 HydrophobicContact CG-CD1 3.89Å; P489-F562 HydrophobicContact CG-CD2 3.62Å; P489-F562 HydrophobicContact CG-CE1 4.35Å; P489-F562 HydrophobicContact CG-CE2 4.13Å; P489-F562 HydrophobicContact CG-CG 3.48Å; P489-F562 VanDerWaalsContact CG-CG 3.48Å; P489-F562 HydrophobicContact CG-CZ 4.46Å
490	V	82.8	Confident	74.2	Confident	71 Å²	71	52.6 Å²	52.6	43%	0.43	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.7	-175.3	-179.7	0	0	0	0	109	L481 G492	L481-V490 PolarHBondContact N-O 2.96Å; L481-V490 PolarHBondContact O-N 3.44Å; V490-G492 PolarHBondContact O-N 2.93Å
491	I	84.2	Confident	72	Confident	9 Å²	9	56.7 Å²	56.7	5%	0.046	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	119.9	166.7	-60.6	156.6	0	0	0	106.8	V478 L480 R536 W539 K540	V478-I491 HydrophobicContact CG1-CG2 3.88Å; L480-I491 HydrophobicContact CD1-CG1 3.72Å; I491-R536 HydrophobicContact CG2-CG 4.27Å; I491-W539 HydrophobicContact CB-CE3 4.45Å; I491-W539 HydrophobicContact CD1-CB 4Å; I491-W539 HydrophobicContact CD1-CD2 3.49Å; I491-W539 VanDerWaalsContact CD1-CD2 3.49Å; I491-W539 HydrophobicContact CD1-CE3 4.06Å; I491-W539 HydrophobicContact CD1-CG 3.42Å; I491-W539 VanDerWaalsContact CD1-CG 3.42Å; I491-W539 HydrophobicContact CG1-CD2 3.73Å; I491-W539 HydrophobicContact CG1-CE3 3.91Å; I491-W539 HydrophobicContact CG1-CG 4.22Å; I491-W539 HydrophobicContact CG1-CH2 4.49Å; I491-W539 HydrophobicContact CG1-CZ2 4.29Å; I491-W539 HydrophobicContact CG1-CZ3 4.3Å; I491-W539 HydrophobicContact CG2-CD2 4.28Å; I491-W539 HydrophobicContact CG2-CE3 3.68Å; I491-W539 HydrophobicContact CG2-CZ3 4.07Å; I491-K540 HydrophobicContact CB-CD 4.49Å; I491-K540 HydrophobicContact CB-CG 3.99Å; I491-K540 HydrophobicContact CD1-CG 3.79Å; I491-K540 HydrophobicContact CG2-CG 4.15Å; I491-K540 WeakPolarHBondContact O-CE 3.5Å; I491-K540 PolarHBondContact O-NZ 3.38Å
492	G	79.1	Confident	69.6	Low	8 Å²	8	63 Å²	63	8%	0.082	35%	0.351	C	S	.	.			trans	-72.6	-149.4	-169.2	0	0	0	0	0	114.6	P479 V490 R536 K540	P479-G492 PolarHBondContact O-N 2.64Å; V490-G492 PolarHBondContact O-N 2.93Å; G492-R536 VanDerWaalsContact O-CZ 3.3Å; G492-R536 PolarHBondContact O-NE 3.33Å; G492-R536 PolarHBondContact O-NH2 2.92Å; G492-K540 PolarHBondContact O-NZ 3.2Å
493	E	83.3	Confident	67.4	Low	140 Å²	140	63.6 Å²	63.6	65%	0.654	36%	0.362	S	S	*	.			trans	-105.8	168.6	175	-52.9	-122.6	100.1	0	0	109.9	P479 W495 R536	P479-E493 VanDerWaalsContact CD-O 3.28Å; P479-E493 WeakPolarHBondContact CD-O 3.44Å; E493-W495 PolarHBondContact O-N 3.14Å; E493-W495 VanDerWaalsContact O-N 3.13Å; E493-R536 IonicContact OE1-CZ 3.79Å; E493-R536 IonicContact OE1-NH2 3.98Å; E493-R536 PolarHBondContact OE1-NH2 3.46Å
494	L	84.8	Confident	65.3	Low	29 Å²	29	67.2 Å²	67.2	15%	0.152	39%	0.387	C	S	.	.			trans	-70.4	106.9	178.6	-103.1	65.3	0	0	0	109.7	Y476 V478 Q499 A532 E533 R536	Y476-L494 HydrophobicContact CD1-CB 4.06Å; Y476-L494 HydrophobicContact CD1-CD2 4.16Å; Y476-L494 HydrophobicContact CD1-CG 4.32Å; V478-L494 HydrophobicContact CG2-CD1 4.28Å; L494-Q499 PolarHBondContact O-NE2 2.9Å; L494-A532 HydrophobicContact CD1-CB 4.34Å; L494-A532 HydrophobicContact CD2-CB 3.84Å; L494-A532 HydrophobicContact CG-CB 3.89Å; L494-E533 HydrophobicContact CD2-CB 4.08Å; L494-R536 HydrophobicContact CD1-CB 4.14Å; L494-R536 VanDerWaalsContact CD1-CD 3.44Å; L494-R536 HydrophobicContact CD1-CG 4.44Å
495	W	81.8	Confident	63.9	Low	32 Å²	32	66.5 Å²	66.5	12%	0.121	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-91.8	142.8	177	-174.9	88.7	0	0	0	110.5	Y476 Y477 E493 P497 L732 E735 F736	Y476-W495 CarbonylContact C-O 3.08Å; Y476-W495 VanDerWaalsContact CA-O 3.28Å; Y476-W495 WeakPolarHBondContact CA-O 3.21Å; Y477-W495 AromaticContact CD2-CE3 3.58Å; Y477-W495 HydrophobicContact CD2-CE3 3.58Å; Y477-W495 AromaticContact CD2-CZ3 3.73Å; Y477-W495 HydrophobicContact CD2-CZ3 3.73Å; Y477-W495 HydrophobicContact CE2-CE3 4.27Å; Y477-W495 AromaticContact CE2-CZ3 3.94Å; Y477-W495 HydrophobicContact CE2-CZ3 3.94Å; Y477-W495 HydrophobicContact CG-CE3 4.12Å; Y477-W495 HydrophobicContact CG-CZ3 4.43Å; Y477-W495 PolarHBondContact N-O 3.32Å; Y477-W495 PolarHBondContact O-N 3.05Å; E493-W495 PolarHBondContact O-N 3.14Å; E493-W495 VanDerWaalsContact O-N 3.13Å; W495-P497 HydrophobicContact CH2-CB 4.25Å; W495-P497 HydrophobicContact CH2-CG 3.75Å; W495-P497 HydrophobicContact CZ3-CG 3.72Å; W495-L732 HydrophobicContact CH2-CD2 3.78Å; W495-L732 HydrophobicContact CZ3-CD2 3.62Å; W495-E735 HydrophobicContact CH2-CB 4.44Å; W495-E735 HydrophobicContact CZ2-CB 4.11Å; W495-F736 HydrophobicContact CB-CE1 4.43Å; W495-F736 HydrophobicContact CB-CZ 4.27Å; W495-F736 HydrophobicContact CD2-CE1 4.14Å; W495-F736 HydrophobicContact CD2-CE2 4.38Å; W495-F736 AromaticContact CD2-CZ 3.74Å; W495-F736 HydrophobicContact CD2-CZ 3.74Å; W495-F736 HydrophobicContact CE3-CE2 4.3Å; W495-F736 AromaticContact CE3-CZ 3.97Å; W495-F736 HydrophobicContact CE3-CZ 3.97Å; W495-F736 AromaticContact CG-CE1 3.95Å; W495-F736 HydrophobicContact CG-CE1 3.95Å; W495-F736 AromaticContact CG-CZ 3.88Å; W495-F736 HydrophobicContact CG-CZ 3.88Å
496	S	78.9	Confident	62.5	Low	0 Å²	0	67.8 Å²	67.8	0%	0	40%	0.395	C	S	.	.			trans	-144.6	143.1	170.2	159.1	0	0	0	0	108.8	H475 D498 Q499	H475-S496 WeakPolarHBondContact O-CB 3.24Å; S496-D498 PolarHBondContact O-N 3.38Å; S496-D498 VanDerWaalsContact O-N 3.1Å; S496-D498 PolarHBondContact OG-N 2.89Å; S496-D498 VanDerWaalsContact OG-N 3.17Å; S496-D498 PolarHBondContact OG-OD2 3.43Å; S496-Q499 PolarHBondContact O-N 3.06Å; S496-Q499 VanDerWaalsContact O-N 3.11Å
497	P	67.6	Low	61.3	Low	17 Å²	17	66.2 Å²	66.2	11%	0.11	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-55	-25.9	174.2	-23.1	32.4	0	0	0	114	H435 H475 Y477 W495 Q499 T500	H435-P497 HydrophobicContact CB-CB 4.09Å; H475-P497 WeakPolarHBondContact O-CD 3.17Å; Y477-P497 HydrophobicContact CE2-CG 4.43Å; W495-P497 HydrophobicContact CH2-CB 4.25Å; W495-P497 HydrophobicContact CH2-CG 3.75Å; W495-P497 HydrophobicContact CZ3-CG 3.72Å; P497-Q499 VanDerWaalsContact C-N 3.34Å; P497-T500 PolarHBondContact O-OG1 2.92Å
498	D	62.8	Low	59.7	Low	53 Å²	53	72.4 Å²	72.4	28%	0.283	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-71.7	-26.8	-178.6	-51	-38.5	0	0	0	112.6	K439 S496 T500	K439-D498 WeakPolarHBondContact CE-OD1 3.17Å; K439-D498 IonicContact NZ-OD1 2.68Å; K439-D498 PolarHBondContact NZ-OD1 3.38Å; K439-D498 IonicContact NZ-OD2 3.93Å; K439-D498 PolarHBondContact NZ-OD2 3.42Å; S496-D498 PolarHBondContact O-N 3.38Å; S496-D498 VanDerWaalsContact O-N 3.1Å; S496-D498 PolarHBondContact OG-N 2.89Å; S496-D498 VanDerWaalsContact OG-N 3.17Å; S496-D498 PolarHBondContact OG-OD2 3.43Å; D498-T500 VanDerWaalsContact C-N 3.3Å; D498-T500 PolarHBondContact O-N 3.05Å
499	Q	57.8	Low	58	Low	75 Å²	75	76.7 Å²	76.7	35%	0.35	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-76	-13.7	-168.6	-74.5	-175	78.1	0	0	114.2	L494 S496 P497 A501 E502 A503	L494-Q499 PolarHBondContact O-NE2 2.9Å; S496-Q499 PolarHBondContact O-N 3.06Å; S496-Q499 VanDerWaalsContact O-N 3.11Å; P497-Q499 VanDerWaalsContact C-N 3.34Å; Q499-A501 PolarHBondContact O-N 3.35Å; Q499-E502 PolarHBondContact O-N 3.44Å; Q499-A503 HydrophobicContact CB-CB 4.42Å; Q499-A503 WeakPolarHBondContact O-CB 3.49Å; Q499-A503 PolarHBondContact O-N 2.95Å
500	T	48.8	Very low	56	Low	76 Å²	76	79.8 Å²	79.8	47%	0.466	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-61.2	-20.6	-171.7	-46.2	0	0	0	0	113.6	P497 D498	P497-T500 PolarHBondContact O-OG1 2.92Å; D498-T500 VanDerWaalsContact C-N 3.3Å; D498-T500 PolarHBondContact O-N 3.05Å
501	A	40.8	Very low	54	Low	85 Å²	85	79 Å²	79	70%	0.702	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-80.3	-33.4	174.6	0	0	0	0	0	114.1	Q499	Q499-A501 PolarHBondContact O-N 3.35Å
502	E	35.5	Very low	52.3	Low	169 Å²	169	81.3 Å²	81.3	79%	0.79	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	-23.8	-167.4	-61.6	-170.5	156.3	0	0	113.9	Q499 S504	Q499-E502 PolarHBondContact O-N 3.44Å; E502-S504 PolarHBondContact O-N 3.26Å; E502-S504 VanDerWaalsContact O-N 3.1Å
503	A	37.6	Very low	51.2	Low	40 Å²	40	87.6 Å²	87.6	33%	0.331	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-67.5	-11.6	-175.9	0	0	0	0	0	115	Q499 H505 V506	Q499-A503 HydrophobicContact CB-CB 4.42Å; Q499-A503 WeakPolarHBondContact O-CB 3.49Å; Q499-A503 PolarHBondContact O-N 2.95Å; A503-H505 PolarHBondContact O-N 3.14Å; A503-V506 PolarHBondContact O-N 3.16Å
504	S	35.1	Very low	49.8	Very low	79 Å²	79	91.7 Å²	91.7	55%	0.552	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-60.3	-3	-178	60.7	0	0	0	0	115.7	E502	E502-S504 PolarHBondContact O-N 3.26Å; E502-S504 VanDerWaalsContact O-N 3.1Å
505	H	37.5	Very low	48.6	Very low	139 Å²	139	95.2 Å²	95.2	64%	0.644	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-114.2	-10.4	179.8	-89	-110.9	0	0	0	115.8	A503 R508	A503-H505 PolarHBondContact O-N 3.14Å; H505-R508 PolarHBondContact CE1-NH2 2.94Å; H505-R508 PolarHBondContact NE2-NH2 3.12Å
506	V	34.8	Very low	47.6	Very low	124 Å²	124	96.5 Å²	96.5	75%	0.752	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-43.8	-172.3	-176	0	0	0	0	113.1	A503 R508	A503-V506 PolarHBondContact O-N 3.16Å; V506-R508 PolarHBondContact O-N 3.38Å
507	S	35.6	Very low	47.2	Very low	102 Å²	102	100.9 Å²	100.9	71%	0.713	58%	0.58	S	S	*	*			trans	-86.3	30.8	-179.1	56.4	0	0	0	0	114.1	H509	S507-H509 PolarHBondContact O-N 2.97Å
508	R	34.3	Very low	47.8	Very low	173 Å²	173	103.2 Å²	103.2	65%	0.653	59%	0.592	S	S	*	*			trans	-76.3	38.7	-179.4	-153	-178	-65.9	-175.4	-0	113.9	H505 V506	H505-R508 PolarHBondContact CE1-NH2 2.94Å; H505-R508 PolarHBondContact NE2-NH2 3.12Å; V506-R508 PolarHBondContact O-N 3.38Å
509	H	34.4	Very low	48.7	Very low	177 Å²	177	102.2 Å²	102.2	82%	0.819	59%	0.587	S	S	*	*			trans	-90.9	94.4	158.8	-74.3	67.2	0	0	0	106.7	S507 G511	S507-H509 PolarHBondContact O-N 2.97Å; H509-G511 PolarHBondContact O-N 2.7Å; H509-G511 VanDerWaalsContact O-N 3.15Å
510	G	38.1	Very low	50	Low	77 Å²	77	99.7 Å²	99.7	79%	0.794	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-60.4	118.2	174.7	0	0	0	0	0	109.4	S512	G510-S512 PolarHBondContact O-N 2.81Å
511	G	41.1	Very low	51.8	Low	56 Å²	56	98.5 Å²	98.5	58%	0.577	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-56.1	136.2	178.3	0	0	0	0	0	110.7	H509 D515	H509-G511 PolarHBondContact O-N 2.7Å; H509-G511 VanDerWaalsContact O-N 3.15Å; G511-D515 WeakPolarHBondContact CA-OD2 3.45Å
512	S	48.1	Very low	54.1	Low	57 Å²	57	94.4 Å²	94.4	40%	0.399	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-59.3	144.9	168.4	-178	0	0	0	0	108.9	G510 R514 D515	G510-S512 PolarHBondContact O-N 2.81Å; S512-R514 PolarHBondContact O-N 2.66Å; S512-D515 WeakPolarHBondContact CB-OD2 3.36Å; S512-D515 PolarHBondContact N-OD2 2.87Å; S512-D515 PolarHBondContact O-N 2.95Å
513	P	56.8	Low	56.8	Low	139 Å²	139	86.5 Å²	86.5	90%	0.903	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	18.8	168.7	-23.7	35.2	0	0	0	115.2
514	R	53.4	Low	59.3	Low	226 Å²	226	84.6 Å²	84.6	85%	0.853	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-6.7	174.6	-64.6	-174.5	173.4	-165.5	-2.5	112.9	S512	S512-R514 PolarHBondContact O-N 2.66Å
515	D	59.2	Low	61.7	Low	103 Å²	103	80.8 Å²	80.8	55%	0.551	45%	0.45	S	S	*	.	S	Bend	trans	-74.8	128.5	175	-61.7	-21.5	0	0	0	107.5	G511 S512	G511-D515 WeakPolarHBondContact CA-OD2 3.45Å; S512-D515 WeakPolarHBondContact CB-OD2 3.36Å; S512-D515 PolarHBondContact N-OD2 2.87Å; S512-D515 PolarHBondContact O-N 2.95Å
516	P	61.4	Low	64.1	Low	59 Å²	59	75.3 Å²	75.3	38%	0.383	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-75.1	145.6	-168.6	30.5	-36.2	0	0	0	111.8	A483 L518	A483-P516 HydrophobicContact CB-CB 3.8Å; A483-P516 HydrophobicContact CB-CG 3.7Å; P516-L518 PolarHBondContact O-N 3.43Å
517	V	70.6	Confident	66.5	Low	93 Å²	93	70 Å²	70	56%	0.564	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-61.7	122.8	178.4	-178.5	0	0	0	0	109.8	A483	A483-V517 WeakPolarHBondContact CA-O 3.31Å
518	L	79.3	Confident	68.9	Low	66 Å²	66	65.7 Å²	65.7	35%	0.346	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	105	-177.5	-72.2	-177.2	0	0	0	110.9	L481 A483 P516	L481-L518 HydrophobicContact CB-CB 4.22Å; L481-L518 HydrophobicContact CB-CD1 4.43Å; L481-L518 HydrophobicContact CD1-CB 4.45Å; L481-L518 HydrophobicContact CD1-CD1 4.09Å; A483-L518 HydrophobicContact CB-CD2 4.08Å; P516-L518 PolarHBondContact O-N 3.43Å
519	T	81.6	Confident	71.4	Confident	31 Å²	31	59.4 Å²	59.4	19%	0.19	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	138	175.8	65.5	0	0	0	0	111.4	L481 R482 E484 R521	L481-T519 CarbonylContact C-O 3.57Å; L481-T519 WeakPolarHBondContact CA-O 3.37Å; R482-T519 PolarHBondContact N-O 3.06Å; R482-T519 PolarHBondContact O-N 3.43Å; R482-T519 PolarHBondContact O-OG1 3.35Å; E484-T519 HydrophobicContact CG-CG2 4.13Å; T519-R521 PolarHBondContact OG1-NE 2.88Å; T519-R521 VanDerWaalsContact OG1-NE 3.13Å
520	L	86.4	Confident	73.8	Confident	23 Å²	23	54 Å²	54	12%	0.12	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	127.5	170.9	-177.5	66.9	0	0	0	109.4	P479 L481 A522 F523 F587 F736	P479-L520 HydrophobicContact CB-CD1 3.45Å; P479-L520 VanDerWaalsContact CB-CD1 3.45Å; L481-L520 HydrophobicContact CD2-CB 4.41Å; L481-L520 HydrophobicContact CD2-CD1 4.01Å; L520-A522 WeakPolarHBondContact CD1-O 3.45Å; L520-F523 HydrophobicContact CD2-CD1 4.24Å; L520-F587 HydrophobicContact CB-CZ 4.07Å; L520-F587 HydrophobicContact CD2-CE1 3.98Å; L520-F587 HydrophobicContact CD2-CZ 3.79Å; L520-F587 HydrophobicContact CG-CE1 3.85Å; L520-F587 HydrophobicContact CG-CZ 3.78Å; L520-F587 WeakPolarHBondContact O-CZ 2.99Å; L520-F736 HydrophobicContact CD2-CB 4.37Å; L520-F736 HydrophobicContact CD2-CD1 4.47Å; L520-F736 HydrophobicContact CD2-CD2 3.62Å; L520-F736 HydrophobicContact CD2-CE2 3.98Å; L520-F736 HydrophobicContact CD2-CG 3.91Å
521	R	87.1	Confident	76.3	Confident	50 Å²	50	53.2 Å²	53.2	19%	0.189	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-27.5	-179.1	-66.5	-53.4	-168.3	130.6	-14	114.5	L480 R482 T519 Y580 E582	L480-R521 PolarHBondContact O-N 2.81Å; R482-R521 HydrophobicContact CB-CG 3.7Å; T519-R521 PolarHBondContact OG1-NE 2.88Å; T519-R521 VanDerWaalsContact OG1-NE 3.13Å; R521-Y580 WeakPolarHBondContact O-CB 3.44Å; R521-Y580 PolarHBondContact O-N 3.42Å; R521-E582 IonicContact CZ-OE1 3.71Å; R521-E582 IonicContact NH1-OE1 3.37Å; R521-E582 PolarHBondContact NH1-OE1 3.5Å; R521-E582 IonicContact NH2-OE1 3.35Å; R521-E582 PolarHBondContact NH2-OE1 3.18Å
522	A	88.9	Confident	78.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	166.1	172	0	0	0	0	0	110.5	L480 L520 W577 V578 E579	L480-A522 HydrophobicContact CB-CB 4.2Å; L480-A522 HydrophobicContact CD2-CB 4.47Å; L480-A522 PolarHBondContact N-O 2.65Å; L520-A522 WeakPolarHBondContact CD1-O 3.45Å; A522-W577 HydrophobicContact CB-CH2 3.62Å; A522-W577 HydrophobicContact CB-CZ2 3.48Å; A522-W577 VanDerWaalsContact CB-CZ2 3.48Å; A522-V578 CarbonylContact C-O 3.59Å; A522-V578 VanDerWaalsContact CA-O 3.25Å; A522-V578 WeakPolarHBondContact CA-O 3.21Å; A522-V578 WeakPolarHBondContact CB-O 3.28Å; A522-E579 HydrophobicContact CB-CB 3.75Å
523	F	90.5	Very high	80.4	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.009	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.2	166.4	60.6	-94.8	0	0	0	111.6	Y477 V478 L520 V578 F587 V729 L732	Y477-F523 AromaticContact CD1-CD2 3.87Å; Y477-F523 HydrophobicContact CD1-CD2 3.87Å; Y477-F523 HydrophobicContact CD1-CE2 4.06Å; Y477-F523 HydrophobicContact CE1-CE2 4.3Å; V478-F523 WeakPolarHBondContact O-CA 3.23Å; L520-F523 HydrophobicContact CD2-CD1 4.24Å; F523-V578 HydrophobicContact CD1-CB 4.43Å; F523-V578 HydrophobicContact CD2-CB 4.33Å; F523-V578 HydrophobicContact CD2-CG2 4.2Å; F523-V578 HydrophobicContact CE1-CB 3.95Å; F523-V578 HydrophobicContact CE1-CG1 4.39Å; F523-V578 HydrophobicContact CE1-CG2 4.38Å; F523-V578 HydrophobicContact CE2-CB 3.85Å; F523-V578 HydrophobicContact CE2-CG2 3.46Å; F523-V578 VanDerWaalsContact CE2-CG2 3.46Å; F523-V578 HydrophobicContact CZ-CB 3.65Å; F523-V578 HydrophobicContact CZ-CG1 4.19Å; F523-V578 HydrophobicContact CZ-CG2 3.57Å; F523-V578 PolarHBondContact N-O 3.05Å; F523-V578 PolarHBondContact O-N 2.91Å; F523-F587 HydrophobicContact CD1-CD1 4.33Å; F523-F587 HydrophobicContact CE1-CD1 4.09Å; F523-F587 HydrophobicContact CE1-CG 4.48Å; F523-V729 HydrophobicContact CE1-CG1 3.89Å; F523-V729 HydrophobicContact CZ-CG1 3.76Å; F523-V729 HydrophobicContact CZ-CG2 4.43Å; F523-L732 HydrophobicContact CE2-CD1 4.49Å; F523-L732 HydrophobicContact CZ-CD1 4.31Å
524	A	90.2	Very high	82	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.2	163.4	0	0	0	0	0	109.2	Y477 V478 L527 F535 P576 W577	Y477-A524 CarbonylContact C-O 3.52Å; Y477-A524 WeakPolarHBondContact CA-O 3.27Å; V478-A524 PolarHBondContact N-O 2.71Å; V478-A524 PolarHBondContact O-N 3.14Å; V478-A524 VanDerWaalsContact O-N 3.11Å; A524-L527 HydrophobicContact CB-CD1 4.5Å; A524-F535 HydrophobicContact CB-CD1 3.86Å; A524-F535 HydrophobicContact CB-CE1 3.33Å; A524-F535 HydrophobicContact CB-CZ 3.74Å; A524-P576 WeakPolarHBondContact CA-O 3.37Å; A524-W577 HydrophobicContact CB-CE3 3.99Å; A524-W577 HydrophobicContact CB-CZ3 4.25Å
525	G	86.4	Confident	83.7	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.7	161.1	-179	0	0	0	0	0	114.1	P576	G525-P576 PolarHBondContact N-O 3.46Å
526	P	87.1	Confident	85.2	Confident	23 Å²	23	35.3 Å²	35.3	15%	0.149	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-79.2	140.7	8.7	30.7	-34.2	0	0	0	113.2	H475 Y477 L726	H475-P526 HydrophobicContact CB-CB 3.89Å; H475-P526 VanDerWaalsContact CD2-CB 3.42Å; H475-P526 WeakPolarHBondContact CD2-CB 3.08Å; Y477-P526 HydrophobicContact CE1-CB 4.13Å; Y477-P526 HydrophobicContact CE2-CB 4.39Å; P526-L726 HydrophobicContact CG-CD2 4.37Å
527	L	86.3	Confident	86.5	Confident	12 Å²	12	37.4 Å²	37.4	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	152.1	175.3	-69.8	171.9	0	0	0	109.7	Y476 A524 K531 A532 F535 Y575	Y476-L527 WeakPolarHBondContact CA-O 3.41Å; Y476-L527 WeakPolarHBondContact CB-O 3.27Å; Y476-L527 PolarHBondContact N-O 3.34Å; Y476-L527 PolarHBondContact O-N 2.74Å; A524-L527 HydrophobicContact CB-CD1 4.5Å; L527-K531 HydrophobicContact CB-CB 4.22Å; L527-K531 HydrophobicContact CD2-CB 4.27Å; L527-A532 HydrophobicContact CB-CB 4.01Å; L527-F535 HydrophobicContact CD1-CB 4.4Å; L527-Y575 HydrophobicContact CD1-CD2 3.63Å; L527-Y575 HydrophobicContact CD1-CE2 4.09Å; L527-Y575 HydrophobicContact CD1-CG 4.24Å; L527-Y575 HydrophobicContact CD2-CD1 3.78Å; L527-Y575 HydrophobicContact CD2-CD2 3.64Å; L527-Y575 HydrophobicContact CD2-CE1 4.2Å; L527-Y575 HydrophobicContact CD2-CE2 4.04Å; L527-Y575 HydrophobicContact CD2-CG 3.51Å; L527-Y575 HydrophobicContact CG-CD2 4.3Å; L527-Y575 HydrophobicContact CG-CG 4.5Å
528	S	85.3	Confident	87.3	Confident	13 Å²	13	34.6 Å²	34.6	9%	0.091	18%	0.182	C	C	.	.			trans	-67.6	151.9	168	64.4	0	0	0	0	109.9	A530 K531 A532	S528-A530 VanDerWaalsContact C-N 3.28Å; S528-A530 PolarHBondContact O-N 3.39Å; S528-A530 VanDerWaalsContact O-N 3.12Å; S528-K531 PolarHBondContact O-N 3.48Å; S528-A532 PolarHBondContact O-N 3.34Å
529	P	86.3	Confident	87.8	Confident	40 Å²	40	31.5 Å²	31.5	26%	0.26	17%	0.165	S	C	.	.	H	α-helix	trans	-55.9	-38.9	-168.1	12.6	-25.7	0	0	0	113.9	K473 Y476 A532 E533	K473-P529 HydrophobicContact CB-CG 4.44Å; K473-P529 WeakPolarHBondContact O-CD 3.43Å; Y476-P529 HydrophobicContact CD2-CB 3.66Å; Y476-P529 HydrophobicContact CD2-CG 3.95Å; Y476-P529 HydrophobicContact CE1-CB 4.45Å; Y476-P529 HydrophobicContact CE2-CB 3.59Å; Y476-P529 HydrophobicContact CE2-CG 3.68Å; Y476-P529 HydrophobicContact CG-CB 4.15Å; P529-A532 PolarHBondContact O-N 2.82Å; P529-E533 VanDerWaalsContact O-CB 3.3Å; P529-E533 WeakPolarHBondContact O-CB 3.31Å; P529-E533 PolarHBondContact O-N 3.39Å
530	A	86.4	Confident	87.9	Confident	64 Å²	64	33.9 Å²	33.9	53%	0.529	17%	0.173	S	C	.	.	H	α-helix	trans	-64.1	-43.9	175.5	0	0	0	0	0	112.9	S528 E533 D534	S528-A530 VanDerWaalsContact C-N 3.28Å; S528-A530 PolarHBondContact O-N 3.39Å; S528-A530 VanDerWaalsContact O-N 3.12Å; A530-E533 PolarHBondContact O-N 3.48Å; A530-D534 WeakPolarHBondContact O-CB 3.46Å; A530-D534 PolarHBondContact O-N 3.18Å
531	K	89.1	Confident	87.7	Confident	60 Å²	60	37.8 Å²	37.8	26%	0.261	20%	0.198	S	C	.	.	H	α-helix	trans	-65.1	-40.5	177.1	-69.7	-176.7	179.2	176.5	0	111.5	E470 L527 S528 F535 Y575	E470-K531 WeakPolarHBondContact OE1-CE 3.28Å; E470-K531 IonicContact OE1-NZ 3.56Å; E470-K531 PolarHBondContact OE1-NZ 2.94Å; E470-K531 IonicContact OE2-NZ 3.93Å; E470-K531 PolarHBondContact OE2-NZ 3.27Å; L527-K531 HydrophobicContact CB-CB 4.22Å; L527-K531 HydrophobicContact CD2-CB 4.27Å; S528-K531 PolarHBondContact O-N 3.48Å; K531-F535 WeakPolarHBondContact O-CB 3.37Å; K531-F535 PolarHBondContact O-N 3.19Å; K531-Y575 HydrophobicContact CB-CE2 4.27Å; K531-Y575 HydrophobicContact CD-CE1 4.14Å
532	A	88.3	Confident	87.4	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-43.7	175.5	0	0	0	0	0	112.2	V478 L494 L527 S528 P529 R536	V478-A532 HydrophobicContact CG2-CB 3.89Å; V478-A532 WeakPolarHBondContact CG2-O 3.39Å; L494-A532 HydrophobicContact CD1-CB 4.34Å; L494-A532 HydrophobicContact CD2-CB 3.84Å; L494-A532 HydrophobicContact CG-CB 3.89Å; L527-A532 HydrophobicContact CB-CB 4.01Å; S528-A532 PolarHBondContact O-N 3.34Å; P529-A532 PolarHBondContact O-N 2.82Å; A532-R536 VanDerWaalsContact O-CB 3.29Å; A532-R536 WeakPolarHBondContact O-CB 3.31Å; A532-R536 PolarHBondContact O-N 3.21Å
533	E	88.4	Confident	86.9	Confident	76 Å²	76	39.7 Å²	39.7	36%	0.355	22%	0.217	S	C	.	.	H	α-helix	trans	-63.2	-46	178	-173	83.7	-103.1	0	0	111.2	L494 P529 A530 R536 K537	L494-E533 HydrophobicContact CD2-CB 4.08Å; P529-E533 VanDerWaalsContact O-CB 3.3Å; P529-E533 WeakPolarHBondContact O-CB 3.31Å; P529-E533 PolarHBondContact O-N 3.39Å; A530-E533 PolarHBondContact O-N 3.48Å; E533-R536 PolarHBondContact O-N 3.02Å; E533-K537 WeakPolarHBondContact O-CG 3.03Å; E533-K537 PolarHBondContact O-N 3.18Å
534	D	89.1	Confident	85.9	Confident	88 Å²	88	51 Å²	51	47%	0.471	26%	0.26	S	S	.	.	H	α-helix	trans	-72.7	-35.2	-180	-70	-21.9	0	0	0	112.7	A530 K537 L538	A530-D534 WeakPolarHBondContact O-CB 3.46Å; A530-D534 PolarHBondContact O-N 3.18Å; D534-K537 PolarHBondContact O-N 3.37Å; D534-K537 WeakPolarHBondContact OD1-CD 3.38Å; D534-K537 IonicContact OD1-NZ 2.68Å; D534-K537 PolarHBondContact OD1-NZ 3.46Å; D534-L538 WeakPolarHBondContact O-CB 3.47Å; D534-L538 PolarHBondContact O-N 2.8Å
535	F	90.6	Very high	85.1	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.009	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-46	168.5	-175.3	-98.7	0	0	0	111.5	V478 A524 L527 K531 K537 L538 W539 L569 A570 L573 Y575 W577	V478-F535 HydrophobicContact CB-CD1 4.14Å; V478-F535 HydrophobicContact CG1-CD1 4.25Å; V478-F535 HydrophobicContact CG2-CD1 4.18Å; A524-F535 HydrophobicContact CB-CD1 3.86Å; A524-F535 HydrophobicContact CB-CE1 3.33Å; A524-F535 HydrophobicContact CB-CZ 3.74Å; L527-F535 HydrophobicContact CD1-CB 4.4Å; K531-F535 WeakPolarHBondContact O-CB 3.37Å; K531-F535 PolarHBondContact O-N 3.19Å; F535-K537 PolarHBondContact O-N 3.04Å; F535-L538 PolarHBondContact O-N 3.37Å; F535-W539 HydrophobicContact CD1-CE3 4.15Å; F535-W539 HydrophobicContact CE1-CD2 4.14Å; F535-W539 AromaticContact CE1-CE3 3.5Å; F535-W539 HydrophobicContact CE1-CE3 3.5Å; F535-W539 VanDerWaalsContact CE1-CE3 3.5Å; F535-W539 AromaticContact CE1-CZ3 3.88Å; F535-W539 HydrophobicContact CE1-CZ3 3.88Å; F535-W539 HydrophobicContact CZ-CE3 4.34Å; F535-W539 WeakPolarHBondContact O-CB 3.42Å; F535-W539 PolarHBondContact O-N 2.9Å; F535-L569 HydrophobicContact CE2-CB 3.92Å; F535-L569 HydrophobicContact CZ-CB 4.46Å; F535-A570 HydrophobicContact CE2-CB 4.18Å; F535-A570 HydrophobicContact CZ-CB 4.26Å; F535-L573 HydrophobicContact CD2-CD1 3.93Å; F535-Y575 HydrophobicContact CB-CD2 4.36Å; F535-Y575 HydrophobicContact CB-CE2 4.16Å; F535-Y575 AromaticContact CD2-CD2 3.74Å; F535-Y575 HydrophobicContact CD2-CD2 3.74Å; F535-Y575 HydrophobicContact CD2-CE2 4.14Å; F535-Y575 HydrophobicContact CE2-CD2 4.41Å; F535-Y575 HydrophobicContact CG-CD2 4.27Å; F535-W577 HydrophobicContact CZ-CZ3 4.43Å
536	R	89.5	Confident	84.4	Confident	40 Å²	40	63.9 Å²	63.9	15%	0.151	32%	0.319	C	S	.	.	H	α-helix	trans	-61	-42.2	176.7	-178.9	179.8	-176.8	-120.8	13.1	112	V478 I491 G492 E493 L494 A532 E533 K540	V478-R536 HydrophobicContact CG1-CB 3.95Å; V478-R536 HydrophobicContact CG1-CG 4.25Å; V478-R536 HydrophobicContact CG2-CB 4.44Å; I491-R536 HydrophobicContact CG2-CG 4.27Å; G492-R536 VanDerWaalsContact O-CZ 3.3Å; G492-R536 PolarHBondContact O-NE 3.33Å; G492-R536 PolarHBondContact O-NH2 2.92Å; E493-R536 IonicContact OE1-CZ 3.79Å; E493-R536 IonicContact OE1-NH2 3.98Å; E493-R536 PolarHBondContact OE1-NH2 3.46Å; L494-R536 HydrophobicContact CD1-CB 4.14Å; L494-R536 VanDerWaalsContact CD1-CD 3.44Å; L494-R536 HydrophobicContact CD1-CG 4.44Å; A532-R536 VanDerWaalsContact O-CB 3.29Å; A532-R536 WeakPolarHBondContact O-CB 3.31Å; A532-R536 PolarHBondContact O-N 3.21Å; E533-R536 PolarHBondContact O-N 3.02Å; R536-K540 HydrophobicContact CG-CD 4.25Å; R536-K540 WeakPolarHBondContact O-CB 3.3Å; R536-K540 WeakPolarHBondContact O-CG 3.38Å; R536-K540 PolarHBondContact O-N 2.68Å
537	K	88.8	Confident	83.8	Confident	103 Å²	103	63.4 Å²	63.4	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-60.6	-47.7	173.5	-70.2	166.8	-163.3	146.6	0	111.3	E533 D534 F535 T541	E533-K537 WeakPolarHBondContact O-CG 3.03Å; E533-K537 PolarHBondContact O-N 3.18Å; D534-K537 PolarHBondContact O-N 3.37Å; D534-K537 WeakPolarHBondContact OD1-CD 3.38Å; D534-K537 IonicContact OD1-NZ 2.68Å; D534-K537 PolarHBondContact OD1-NZ 3.46Å; F535-K537 PolarHBondContact O-N 3.04Å; K537-T541 CarbonylContact O-C 3.5Å; K537-T541 WeakPolarHBondContact O-CA 3.41Å; K537-T541 PolarHBondContact O-N 2.89Å; K537-T541 PolarHBondContact O-OG1 3.15Å
538	L	88.4	Confident	83.2	Confident	34 Å²	34	65.5 Å²	65.5	18%	0.178	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-41.6	-179.2	-177.5	60	0	0	0	112.3	D534 F535 P542 P543 L569 L573	D534-L538 WeakPolarHBondContact O-CB 3.47Å; D534-L538 PolarHBondContact O-N 2.8Å; F535-L538 PolarHBondContact O-N 3.37Å; L538-P542 HydrophobicContact CD1-CB 4.49Å; L538-P542 VanDerWaalsContact O-CA 3.32Å; L538-P542 WeakPolarHBondContact O-CA 3.4Å; L538-P542 WeakPolarHBondContact O-CB 3.41Å; L538-P542 WeakPolarHBondContact O-CD 3.49Å; L538-P543 HydrophobicContact CD1-CG 4.24Å; L538-L569 HydrophobicContact CD1-CD2 4.5Å; L538-L569 HydrophobicContact CD2-CD2 3.88Å; L538-L569 HydrophobicContact CG-CD1 4.21Å; L538-L569 HydrophobicContact CG-CD2 3.96Å; L538-L573 HydrophobicContact CD2-CD1 3.82Å
539	W	88.1	Confident	82.7	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-75.6	-36.1	-178.4	-170.3	22	0	0	0	113.1	V478 L480 I491 F535 K554 F562 L569 W577	V478-W539 HydrophobicContact CG1-CE3 3.96Å; V478-W539 HydrophobicContact CG1-CZ3 3.96Å; L480-W539 HydrophobicContact CB-CH2 3.7Å; L480-W539 HydrophobicContact CB-CZ2 4.1Å; L480-W539 HydrophobicContact CD1-CH2 4.26Å; L480-W539 HydrophobicContact CD1-CZ2 3.95Å; L480-W539 HydrophobicContact CD2-CZ2 4.19Å; L480-W539 HydrophobicContact CG-CH2 4.4Å; L480-W539 HydrophobicContact CG-CZ2 4.31Å; I491-W539 HydrophobicContact CB-CE3 4.45Å; I491-W539 HydrophobicContact CD1-CB 4Å; I491-W539 HydrophobicContact CD1-CD2 3.49Å; I491-W539 VanDerWaalsContact CD1-CD2 3.49Å; I491-W539 HydrophobicContact CD1-CE3 4.06Å; I491-W539 HydrophobicContact CD1-CG 3.42Å; I491-W539 VanDerWaalsContact CD1-CG 3.42Å; I491-W539 HydrophobicContact CG1-CD2 3.73Å; I491-W539 HydrophobicContact CG1-CE3 3.91Å; I491-W539 HydrophobicContact CG1-CG 4.22Å; I491-W539 HydrophobicContact CG1-CH2 4.49Å; I491-W539 HydrophobicContact CG1-CZ2 4.29Å; I491-W539 HydrophobicContact CG1-CZ3 4.3Å; I491-W539 HydrophobicContact CG2-CD2 4.28Å; I491-W539 HydrophobicContact CG2-CE3 3.68Å; I491-W539 HydrophobicContact CG2-CZ3 4.07Å; F535-W539 HydrophobicContact CD1-CE3 4.15Å; F535-W539 HydrophobicContact CE1-CD2 4.14Å; F535-W539 AromaticContact CE1-CE3 3.5Å; F535-W539 HydrophobicContact CE1-CE3 3.5Å; F535-W539 VanDerWaalsContact CE1-CE3 3.5Å; F535-W539 AromaticContact CE1-CZ3 3.88Å; F535-W539 HydrophobicContact CE1-CZ3 3.88Å; F535-W539 HydrophobicContact CZ-CE3 4.34Å; F535-W539 WeakPolarHBondContact O-CB 3.42Å; F535-W539 PolarHBondContact O-N 2.9Å; W539-K554 PolarHBondContact O-NZ 3.39Å; W539-F562 PolarHBondContact NE1-O 2.96Å; W539-F562 VanDerWaalsContact NE1-O 3.14Å; W539-L569 HydrophobicContact CB-CD1 4.14Å; W539-L569 HydrophobicContact CG-CD1 4.42Å; W539-W577 AromaticContact CH2-CH2 3.48Å; W539-W577 HydrophobicContact CH2-CH2 3.48Å; W539-W577 VanDerWaalsContact CH2-CH2 3.48Å; W539-W577 AromaticContact CH2-CZ3 3.58Å; W539-W577 HydrophobicContact CH2-CZ3 3.58Å; W539-W577 AromaticContact CZ2-CH2 3.54Å; W539-W577 HydrophobicContact CZ2-CH2 3.54Å; W539-W577 AromaticContact CZ2-CZ3 3.95Å; W539-W577 HydrophobicContact CZ2-CZ3 3.95Å; W539-W577 HydrophobicContact CZ3-CH2 4.47Å; W539-W577 HydrophobicContact CZ3-CZ3 4.15Å
540	K	85.1	Confident	82.2	Confident	81 Å²	81	68.6 Å²	68.6	35%	0.352	35%	0.349	S	S	.	.	H	α-helix	trans	-72.6	-49.7	172.4	-74.3	-171.8	175.3	-169.2	0	112	I491 G492 R536	I491-K540 HydrophobicContact CB-CD 4.49Å; I491-K540 HydrophobicContact CB-CG 3.99Å; I491-K540 HydrophobicContact CD1-CG 3.79Å; I491-K540 HydrophobicContact CG2-CG 4.15Å; I491-K540 WeakPolarHBondContact O-CE 3.5Å; I491-K540 PolarHBondContact O-NZ 3.38Å; G492-K540 PolarHBondContact O-NZ 3.2Å; R536-K540 HydrophobicContact CG-CD 4.25Å; R536-K540 WeakPolarHBondContact O-CB 3.3Å; R536-K540 WeakPolarHBondContact O-CG 3.38Å; R536-K540 PolarHBondContact O-N 2.68Å
541	T	82.2	Confident	81.6	Confident	105 Å²	105	69.8 Å²	69.8	64%	0.644	34%	0.343	S	S	*	.	S	Bend	trans	-136.8	78.3	-169.3	44.8	0	0	0	0	110.8	K537	K537-T541 CarbonylContact O-C 3.5Å; K537-T541 WeakPolarHBondContact O-CA 3.41Å; K537-T541 PolarHBondContact O-N 2.89Å; K537-T541 PolarHBondContact O-OG1 3.15Å
542	P	79.8	Confident	81	Confident	14 Å²	14	72.7 Å²	72.7	9%	0.091	36%	0.358	C	S	.	.			trans	-66.4	149.3	-178.7	25.2	-34.1	0	0	0	112.7	L538 A547 L550	L538-P542 HydrophobicContact CD1-CB 4.49Å; L538-P542 VanDerWaalsContact O-CA 3.32Å; L538-P542 WeakPolarHBondContact O-CA 3.4Å; L538-P542 WeakPolarHBondContact O-CB 3.41Å; L538-P542 WeakPolarHBondContact O-CD 3.49Å; P542-A547 HydrophobicContact CG-CB 4.08Å; P542-L550 HydrophobicContact CB-CD1 3.67Å; P542-L550 HydrophobicContact CG-CB 4.37Å; P542-L550 HydrophobicContact CG-CD1 4.09Å
543	P	78.3	Confident	80.5	Confident	76 Å²	76	73.1 Å²	73.1	49%	0.494	36%	0.36	S	S	.	.			trans	-53.1	145.1	171.4	-27.3	35.1	0	0	0	112.5	L538 E545 K546 A547	L538-P543 HydrophobicContact CD1-CG 4.24Å; P543-E545 PolarHBondContact O-N 2.79Å; P543-K546 PolarHBondContact O-N 2.88Å; P543-A547 WeakPolarHBondContact O-CB 3.43Å; P543-A547 PolarHBondContact O-N 3.03Å
544	R	71.3	Confident	80.1	Confident	241 Å²	241	70.7 Å²	70.7	91%	0.909	35%	0.348	S	S	*	.	H	α-helix	trans	-51.3	-34.2	-170.1	-68.3	-175.9	177.2	-174.5	-0.1	114.4
545	E	72.3	Confident	79.3	Confident	190 Å²	190	74.5 Å²	74.5	89%	0.888	36%	0.361	S	S	*	.	H	α-helix	trans	-63.5	-43.7	178.9	-64	169.8	-167.8	0	0	112.8	P543	P543-E545 PolarHBondContact O-N 2.79Å
546	K	71.4	Confident	78.5	Confident	80 Å²	80	76.8 Å²	76.8	35%	0.348	38%	0.377	S	S	.	.	H	α-helix	trans	-88.5	-23.3	176.8	-69.2	-176	173.6	179.6	0	113	P543 G548 F549 L550 E572	P543-K546 PolarHBondContact O-N 2.88Å; K546-G548 PolarHBondContact O-N 3.17Å; K546-F549 PolarHBondContact O-N 3.29Å; K546-F549 VanDerWaalsContact O-N 3.14Å; K546-L550 HydrophobicContact CB-CD1 3.95Å; K546-L550 HydrophobicContact CB-CG 4.46Å; K546-L550 WeakPolarHBondContact O-CG 3.18Å; K546-L550 PolarHBondContact O-N 3.49Å; K546-E572 IonicContact NZ-OE1 2.79Å; K546-E572 PolarHBondContact NZ-OE1 3.28Å; K546-E572 IonicContact NZ-OE2 2.74Å; K546-E572 PolarHBondContact NZ-OE2 3.17Å
547	A	74	Confident	77.8	Confident	13 Å²	13	75.2 Å²	75.2	11%	0.107	37%	0.372	C	S	.	.	H	α-helix	trans	-54.9	-37	-176.9	0	0	0	0	0	113	P542 P543 F549 H551	P542-A547 HydrophobicContact CG-CB 4.08Å; P543-A547 WeakPolarHBondContact O-CB 3.43Å; P543-A547 PolarHBondContact O-N 3.03Å; A547-F549 PolarHBondContact O-N 3.19Å; A547-H551 WeakPolarHBondContact O-CB 3.43Å; A547-H551 PolarHBondContact O-CD2 3.45Å; A547-H551 VanDerWaalsContact O-CG 3.27Å; A547-H551 PolarHBondContact O-N 3.45Å
548	G	74.3	Confident	76.9	Confident	55 Å²	55	75.1 Å²	75.1	57%	0.567	38%	0.382	S	S	*	.	H	α-helix	trans	-58.2	-48.5	177	0	0	0	0	0	113.3	K546 H552	K546-G548 PolarHBondContact O-N 3.17Å; G548-H552 PolarHBondContact O-N 2.97Å; G548-H552 VanDerWaalsContact O-N 3.16Å
549	F	75.1	Confident	76.1	Confident	110 Å²	110	77.5 Å²	77.5	48%	0.482	39%	0.392	S	S	.	.	H	α-helix	trans	-69.5	-49.3	177.9	178.5	-96.9	0	0	0	111.6	K546 A547 H551 H552 V553	K546-F549 PolarHBondContact O-N 3.29Å; K546-F549 VanDerWaalsContact O-N 3.14Å; A547-F549 PolarHBondContact O-N 3.19Å; F549-H551 VanDerWaalsContact C-N 3.3Å; F549-H551 PolarHBondContact O-N 3.21Å; F549-H552 WeakPolarHBondContact O-CA 3.42Å; F549-H552 VanDerWaalsContact O-CB 3.27Å; F549-H552 WeakPolarHBondContact O-CB 3.5Å; F549-H552 PolarHBondContact O-N 3.47Å; F549-V553 HydrophobicContact CD1-CG2 4.23Å; F549-V553 HydrophobicContact CE1-CG2 3.8Å; F549-V553 HydrophobicContact CE2-CG2 4.38Å; F549-V553 HydrophobicContact CZ-CG2 3.88Å; F549-V553 PolarHBondContact O-N 2.93Å
550	L	75.7	Confident	75.9	Confident	8 Å²	8	78.7 Å²	78.7	4%	0.042	40%	0.396	C	S	.	.	H	α-helix	trans	-68.6	-28	-176.5	-58.2	173.9	0	0	0	112.8	P542 K546 K554 V565 L569	P542-L550 HydrophobicContact CB-CD1 3.67Å; P542-L550 HydrophobicContact CG-CB 4.37Å; P542-L550 HydrophobicContact CG-CD1 4.09Å; K546-L550 HydrophobicContact CB-CD1 3.95Å; K546-L550 HydrophobicContact CB-CG 4.46Å; K546-L550 WeakPolarHBondContact O-CG 3.18Å; K546-L550 PolarHBondContact O-N 3.49Å; L550-K554 WeakPolarHBondContact O-CB 3.49Å; L550-K554 WeakPolarHBondContact O-CG 3.28Å; L550-K554 PolarHBondContact O-N 2.74Å; L550-K554 VanDerWaalsContact O-N 3.16Å; L550-V565 HydrophobicContact CB-CG1 4.31Å; L550-V565 HydrophobicContact CB-CG2 4.27Å; L550-V565 HydrophobicContact CD2-CB 4.46Å; L550-V565 HydrophobicContact CD2-CG1 3.96Å; L550-V565 HydrophobicContact CD2-CG2 3.92Å; L550-L569 HydrophobicContact CD1-CD1 4.46Å; L550-L569 HydrophobicContact CD1-CD2 4.09Å
551	H	74.3	Confident	75.7	Confident	89 Å²	89	74.8 Å²	74.8	41%	0.412	38%	0.38	S	S	.	.	H	α-helix	trans	-78.7	-17.8	168.2	-70.3	-53.7	0	0	0	113.6	A547 F549 K555	A547-H551 WeakPolarHBondContact O-CB 3.43Å; A547-H551 PolarHBondContact O-CD2 3.45Å; A547-H551 VanDerWaalsContact O-CG 3.27Å; A547-H551 PolarHBondContact O-N 3.45Å; F549-H551 VanDerWaalsContact C-N 3.3Å; F549-H551 PolarHBondContact O-N 3.21Å; H551-K555 WeakPolarHBondContact O-CB 3.42Å; H551-K555 VanDerWaalsContact O-CD 3.23Å; H551-K555 WeakPolarHBondContact O-CD 3.43Å; H551-K555 WeakPolarHBondContact O-CG 3.27Å
552	H	75.5	Confident	75.7	Confident	122 Å²	122	72 Å²	72	57%	0.565	36%	0.359	S	S	*	.	H	α-helix	trans	-73.9	-50.9	168	-178.2	-96.2	0	0	0	110.1	G548 F549 K554 K555 S556	G548-H552 PolarHBondContact O-N 2.97Å; G548-H552 VanDerWaalsContact O-N 3.16Å; F549-H552 WeakPolarHBondContact O-CA 3.42Å; F549-H552 VanDerWaalsContact O-CB 3.27Å; F549-H552 WeakPolarHBondContact O-CB 3.5Å; F549-H552 PolarHBondContact O-N 3.47Å; H552-K554 PolarHBondContact O-N 2.97Å; H552-K555 CarbonylContact O-C 3.58Å; H552-K555 WeakPolarHBondContact O-CA 3.31Å; H552-K555 WeakPolarHBondContact O-CB 3.12Å; H552-K555 PolarHBondContact O-N 3Å; H552-S556 PolarHBondContact O-N 3.1Å; H552-S556 PolarHBondContact O-OG 3.03Å
553	V	78.6	Confident	76.2	Confident	9 Å²	9	71.4 Å²	71.4	6%	0.055	36%	0.355	C	S	.	.	H	α-helix	trans	-57.9	-44.6	178.5	-179.1	0	0	0	0	111.9	F549 K555 S556 R564 V565	F549-V553 HydrophobicContact CD1-CG2 4.23Å; F549-V553 HydrophobicContact CE1-CG2 3.8Å; F549-V553 HydrophobicContact CE2-CG2 4.38Å; F549-V553 HydrophobicContact CZ-CG2 3.88Å; F549-V553 PolarHBondContact O-N 2.93Å; V553-K555 PolarHBondContact O-N 3.05Å; V553-K555 VanDerWaalsContact O-N 3.11Å; V553-S556 WeakPolarHBondContact CA-OG 3.43Å; V553-S556 PolarHBondContact O-N 2.96Å; V553-S556 PolarHBondContact O-OG 3.18Å; V553-S556 VanDerWaalsContact O-OG 3.11Å; V553-R564 HydrophobicContact CG1-CB 4.13Å; V553-R564 HydrophobicContact CG1-CG 4.21Å; V553-V565 HydrophobicContact CB-CG2 3.71Å; V553-V565 HydrophobicContact CG1-CG2 3.7Å
554	K	79.3	Confident	76.6	Confident	24 Å²	24	69.8 Å²	69.8	10%	0.104	34%	0.339	C	S	.	.	H	α-helix	trans	-64.9	-8.2	173.6	-75.6	173.3	176	175.5	0	115.1	W539 L550 H552 F562 V565	W539-K554 PolarHBondContact O-NZ 3.39Å; L550-K554 WeakPolarHBondContact O-CB 3.49Å; L550-K554 WeakPolarHBondContact O-CG 3.28Å; L550-K554 PolarHBondContact O-N 2.74Å; L550-K554 VanDerWaalsContact O-N 3.16Å; H552-K554 PolarHBondContact O-N 2.97Å; K554-F562 HydrophobicContact CB-CD2 4.32Å; K554-F562 HydrophobicContact CB-CE2 4.05Å; K554-F562 HydrophobicContact CD-CD1 4.22Å; K554-F562 HydrophobicContact CD-CD2 4.43Å; K554-F562 HydrophobicContact CD-CE1 4.02Å; K554-F562 HydrophobicContact CD-CE2 4.23Å; K554-F562 HydrophobicContact CD-CG 4.43Å; K554-F562 HydrophobicContact CD-CZ 4.02Å; K554-F562 HydrophobicContact CG-CD1 4.48Å; K554-F562 HydrophobicContact CG-CD2 3.94Å; K554-F562 HydrophobicContact CG-CE2 4Å; K554-F562 HydrophobicContact CG-CG 4.19Å; K554-F562 HydrophobicContact CG-CZ 4.31Å; K554-V565 HydrophobicContact CG-CB 4.45Å; K554-V565 HydrophobicContact CG-CG2 4.04Å
555	K	73.6	Confident	77.3	Confident	168 Å²	168	58.4 Å²	58.4	73%	0.73	30%	0.296	S	S	*	.	H	α-helix	trans	-111.9	-31.2	177.9	-74.8	176.2	-172.7	175.9	0	113.5	H551 H552 V553 D557	H551-K555 WeakPolarHBondContact O-CB 3.42Å; H551-K555 VanDerWaalsContact O-CD 3.23Å; H551-K555 WeakPolarHBondContact O-CD 3.43Å; H551-K555 WeakPolarHBondContact O-CG 3.27Å; H552-K555 CarbonylContact O-C 3.58Å; H552-K555 WeakPolarHBondContact O-CA 3.31Å; H552-K555 WeakPolarHBondContact O-CB 3.12Å; H552-K555 PolarHBondContact O-N 3Å; V553-K555 PolarHBondContact O-N 3.05Å; V553-K555 VanDerWaalsContact O-N 3.11Å; K555-D557 PolarHBondContact O-N 3.38Å
556	S	72.8	Confident	78.1	Confident	51 Å²	51	49.3 Å²	49.3	36%	0.357	25%	0.253	S	S	.	.	H	α-helix	trans	-68.9	-20.6	177.2	52.9	0	0	0	0	112.8	H552 V553	H552-S556 PolarHBondContact O-N 3.1Å; H552-S556 PolarHBondContact O-OG 3.03Å; V553-S556 WeakPolarHBondContact CA-OG 3.43Å; V553-S556 PolarHBondContact O-N 2.96Å; V553-S556 PolarHBondContact O-OG 3.18Å; V553-S556 VanDerWaalsContact O-OG 3.11Å
557	D	75.1	Confident	78.9	Confident	6 Å²	6	46 Å²	46	3%	0.032	24%	0.239	C	C	.	.			trans	-143.5	104.5	179.6	173.4	17	0	0	0	111.2	K555 E559 R560 G561 R564 K834	K555-D557 PolarHBondContact O-N 3.38Å; D557-E559 VanDerWaalsContact C-N 3.32Å; D557-E559 PolarHBondContact OD1-N 3.46Å; D557-R560 VanDerWaalsContact CG-N 3.33Å; D557-R560 PolarHBondContact OD1-N 3.23Å; D557-R560 VanDerWaalsContact OD2-CA 3.23Å; D557-R560 WeakPolarHBondContact OD2-CA 3.49Å; D557-R560 WeakPolarHBondContact OD2-CB 3.3Å; D557-R560 PolarHBondContact OD2-N 3.33Å; D557-G561 WeakPolarHBondContact O-CA 3.35Å; D557-G561 PolarHBondContact O-N 3.03Å; D557-G561 PolarHBondContact OD2-N 3.47Å; D557-G561 VanDerWaalsContact OD2-N 3.11Å; D557-R564 IonicContact OD2-CZ 3.68Å; D557-R564 IonicContact OD2-NE 2.8Å; D557-R564 IonicContact OD2-NH2 3.17Å; D557-R564 PolarHBondContact OD2-NH2 3Å; D557-K834 IonicContact OD1-NZ 2.79Å; D557-K834 PolarHBondContact OD1-NZ 3.36Å
558	P	69.8	Low	79.5	Confident	101 Å²	101	48.3 Å²	48.3	66%	0.656	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-16.9	179.2	30.3	-34.3	0	0	0	113.8	R482	R482-P558 PolarHBondContact NH2-O 3.47Å
559	E	72.6	Confident	80.2	Confident	84 Å²	84	45.9 Å²	45.9	39%	0.393	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-38.3	-174.1	-61.8	170.2	172.3	0	0	112.3	R482 D557 K834 S876	R482-E559 PolarHBondContact NH1-O 2.94Å; R482-E559 PolarHBondContact NH2-O 2.99Å; D557-E559 VanDerWaalsContact C-N 3.32Å; D557-E559 PolarHBondContact OD1-N 3.46Å; E559-K834 WeakPolarHBondContact OE2-CD 3.17Å; E559-K834 IonicContact OE2-NZ 2.82Å; E559-K834 PolarHBondContact OE2-NZ 3.08Å; E559-S876 PolarHBondContact OE1-OG 3.1Å; E559-S876 PolarHBondContact OE2-OG 3.22Å
560	R	81.9	Confident	80.9	Confident	25 Å²	25	40.6 Å²	40.6	9%	0.094	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.3	5.1	178.9	-67.8	-71.4	-173.9	155.2	-3.6	114.8	D557 F562 E563 R564 Y580 D838	D557-R560 VanDerWaalsContact CG-N 3.33Å; D557-R560 PolarHBondContact OD1-N 3.23Å; D557-R560 VanDerWaalsContact OD2-CA 3.23Å; D557-R560 WeakPolarHBondContact OD2-CA 3.49Å; D557-R560 WeakPolarHBondContact OD2-CB 3.3Å; D557-R560 PolarHBondContact OD2-N 3.33Å; R560-F562 VanDerWaalsContact C-N 3.31Å; R560-F562 PolarHBondContact O-N 3.32Å; R560-E563 VanDerWaalsContact CA-OE2 3.32Å; R560-E563 WeakPolarHBondContact CA-OE2 3.41Å; R560-E563 WeakPolarHBondContact O-CB 3.32Å; R560-E563 PolarHBondContact O-N 3.27Å; R560-R564 WeakPolarHBondContact O-CB 3.45Å; R560-R564 PolarHBondContact O-N 2.83Å; R560-Y580 VanDerWaalsContact CZ-O 3.27Å; R560-Y580 PolarHBondContact NH1-O 3.08Å; R560-Y580 PolarHBondContact NH2-O 3.17Å; R560-D838 HydrophobicContact CG-CB 4.46Å
561	G	82.1	Confident	81.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-70.2	-17.5	-175.8	0	0	0	0	0	115.9	D557 V565	D557-G561 WeakPolarHBondContact O-CA 3.35Å; D557-G561 PolarHBondContact O-N 3.03Å; D557-G561 PolarHBondContact OD2-N 3.47Å; D557-G561 VanDerWaalsContact OD2-N 3.11Å; G561-V565 PolarHBondContact O-N 2.8Å
562	F	82.8	Confident	82.1	Confident	47 Å²	47	44.9 Å²	44.9	21%	0.206	22%	0.218	C	C	.	.	H	α-helix	trans	-85.6	-38.8	173.8	-85.5	-108.7	0	0	0	111.8	L480 P489 W539 K554 R560 G566	L480-F562 HydrophobicContact CD1-CB 4.34Å; L480-F562 HydrophobicContact CD2-CB 4.11Å; P489-F562 HydrophobicContact CG-CB 3.76Å; P489-F562 HydrophobicContact CG-CD1 3.89Å; P489-F562 HydrophobicContact CG-CD2 3.62Å; P489-F562 HydrophobicContact CG-CE1 4.35Å; P489-F562 HydrophobicContact CG-CE2 4.13Å; P489-F562 HydrophobicContact CG-CG 3.48Å; P489-F562 VanDerWaalsContact CG-CG 3.48Å; P489-F562 HydrophobicContact CG-CZ 4.46Å; W539-F562 PolarHBondContact NE1-O 2.96Å; W539-F562 VanDerWaalsContact NE1-O 3.14Å; K554-F562 HydrophobicContact CB-CD2 4.32Å; K554-F562 HydrophobicContact CB-CE2 4.05Å; K554-F562 HydrophobicContact CD-CD1 4.22Å; K554-F562 HydrophobicContact CD-CD2 4.43Å; K554-F562 HydrophobicContact CD-CE1 4.02Å; K554-F562 HydrophobicContact CD-CE2 4.23Å; K554-F562 HydrophobicContact CD-CG 4.43Å; K554-F562 HydrophobicContact CD-CZ 4.02Å; K554-F562 HydrophobicContact CG-CD1 4.48Å; K554-F562 HydrophobicContact CG-CD2 3.94Å; K554-F562 HydrophobicContact CG-CE2 4Å; K554-F562 HydrophobicContact CG-CG 4.19Å; K554-F562 HydrophobicContact CG-CZ 4.31Å; R560-F562 VanDerWaalsContact C-N 3.31Å; R560-F562 PolarHBondContact O-N 3.32Å; F562-G566 PolarHBondContact O-N 2.94Å
563	E	89.4	Confident	82.7	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-59.4	-50.8	170.3	-64.3	78.6	171	0	0	109.9	L480 R482 R560 V565 G566 R567 W577	L480-E563 HydrophobicContact CD2-CG 3.7Å; R482-E563 IonicContact CZ-OE1 2.69Å; R482-E563 IonicContact NH1-OE1 3.44Å; R482-E563 PolarHBondContact NH1-OE1 2.86Å; R482-E563 IonicContact NH1-OE2 3.17Å; R482-E563 IonicContact NH2-OE1 2.69Å; R482-E563 IonicContact NH2-OE2 3.76Å; R560-E563 VanDerWaalsContact CA-OE2 3.32Å; R560-E563 WeakPolarHBondContact CA-OE2 3.41Å; R560-E563 WeakPolarHBondContact O-CB 3.32Å; R560-E563 PolarHBondContact O-N 3.27Å; E563-V565 PolarHBondContact O-N 3.37Å; E563-G566 WeakPolarHBondContact O-CA 3.48Å; E563-G566 PolarHBondContact O-N 3.3Å; E563-R567 WeakPolarHBondContact O-CB 3.26Å; E563-R567 PolarHBondContact O-N 2.71Å; E563-W577 VanDerWaalsContact O-CZ2 3.3Å; E563-W577 WeakPolarHBondContact O-CZ2 3.38Å
564	R	86.5	Confident	83.1	Confident	42 Å²	42	45 Å²	45	16%	0.158	24%	0.238	C	C	.	.	H	α-helix	trans	-56.4	-48.2	177.9	-158.2	-177.7	-48.4	-139.7	-4.4	112.3	V553 D557 R560 G566 R567 E568 D838 A841	V553-R564 HydrophobicContact CG1-CB 4.13Å; V553-R564 HydrophobicContact CG1-CG 4.21Å; D557-R564 IonicContact OD2-CZ 3.68Å; D557-R564 IonicContact OD2-NE 2.8Å; D557-R564 IonicContact OD2-NH2 3.17Å; D557-R564 PolarHBondContact OD2-NH2 3Å; R560-R564 WeakPolarHBondContact O-CB 3.45Å; R560-R564 PolarHBondContact O-N 2.83Å; R564-G566 VanDerWaalsContact C-N 3.35Å; R564-G566 PolarHBondContact O-N 3.09Å; R564-R567 PolarHBondContact O-N 3.26Å; R564-E568 WeakPolarHBondContact O-CB 3.46Å; R564-E568 VanDerWaalsContact O-CG 3.27Å; R564-E568 WeakPolarHBondContact O-CG 3.36Å; R564-E568 PolarHBondContact O-N 2.65Å; R564-D838 IonicContact CZ-OD1 3.82Å; R564-D838 IonicContact NH2-OD1 3.85Å; R564-D838 PolarHBondContact NH2-OD1 2.92Å; R564-A841 VanDerWaalsContact NH1-CB 3.32Å
565	V	85.9	Confident	83.6	Confident	1 Å²	1	46 Å²	46	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-64.9	-35.9	174.2	163.1	0	0	0	0	112.6	L550 V553 K554 G561 E563 L569	L550-V565 HydrophobicContact CB-CG1 4.31Å; L550-V565 HydrophobicContact CB-CG2 4.27Å; L550-V565 HydrophobicContact CD2-CB 4.46Å; L550-V565 HydrophobicContact CD2-CG1 3.96Å; L550-V565 HydrophobicContact CD2-CG2 3.92Å; V553-V565 HydrophobicContact CB-CG2 3.71Å; V553-V565 HydrophobicContact CG1-CG2 3.7Å; K554-V565 HydrophobicContact CG-CB 4.45Å; K554-V565 HydrophobicContact CG-CG2 4.04Å; G561-V565 PolarHBondContact O-N 2.8Å; E563-V565 PolarHBondContact O-N 3.37Å; V565-L569 HydrophobicContact CG1-CD1 3.82Å; V565-L569 HydrophobicContact CG1-CG 4.35Å; V565-L569 WeakPolarHBondContact O-CB 3.29Å; V565-L569 WeakPolarHBondContact O-CG 3.49Å; V565-L569 PolarHBondContact O-N 2.73Å
566	G	88.3	Confident	84.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.6	-45.3	175.3	0	0	0	0	0	111.8	F562 E563 R564 L569 A570	F562-G566 PolarHBondContact O-N 2.94Å; E563-G566 WeakPolarHBondContact O-CA 3.48Å; E563-G566 PolarHBondContact O-N 3.3Å; R564-G566 VanDerWaalsContact C-N 3.35Å; R564-G566 PolarHBondContact O-N 3.09Å; G566-L569 PolarHBondContact O-N 2.89Å; G566-A570 VanDerWaalsContact O-CB 3.29Å; G566-A570 WeakPolarHBondContact O-CB 3.47Å; G566-A570 PolarHBondContact O-N 3.17Å
567	R	89.6	Confident	85.1	Confident	11 Å²	11	38 Å²	38	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-50.2	175.8	-169.1	167.7	65.2	-126.8	7.5	112.5	E563 R564 L569 A570 H571 W577 E579 A841	E563-R567 WeakPolarHBondContact O-CB 3.26Å; E563-R567 PolarHBondContact O-N 2.71Å; R564-R567 PolarHBondContact O-N 3.26Å; R567-L569 PolarHBondContact O-N 3.44Å; R567-A570 PolarHBondContact O-N 2.78Å; R567-H571 WeakPolarHBondContact CG-NE2 3.36Å; R567-H571 PolarHBondContact O-CD2 3.5Å; R567-H571 PolarHBondContact O-N 3.43Å; R567-W577 HydrophobicContact CB-CD2 4.25Å; R567-W577 HydrophobicContact CB-CG 4.29Å; R567-W577 HydrophobicContact CB-CZ2 4.31Å; R567-W577 HydrophobicContact CG-CG 4.27Å; R567-E579 IonicContact CZ-OE1 3.18Å; R567-E579 IonicContact CZ-OE2 2.64Å; R567-E579 IonicContact NE-OE1 3.6Å; R567-E579 IonicContact NH1-OE1 3.73Å; R567-E579 PolarHBondContact NH1-OE1 3.41Å; R567-E579 IonicContact NH1-OE2 2.82Å; R567-E579 PolarHBondContact NH1-OE2 3.12Å; R567-A841 VanDerWaalsContact NH2-C 3.25Å; R567-A841 PolarHBondContact NH2-O 2.68Å
568	E	86.4	Confident	85.9	Confident	61 Å²	61	38 Å²	38	29%	0.285	21%	0.205	S	C	.	.	H	α-helix	trans	-53.6	-49.2	174.3	-75.4	164.8	-159.4	0	0	112	R564 E572	R564-E568 WeakPolarHBondContact O-CB 3.46Å; R564-E568 VanDerWaalsContact O-CG 3.27Å; R564-E568 WeakPolarHBondContact O-CG 3.36Å; R564-E568 PolarHBondContact O-N 2.65Å; E568-E572 WeakPolarHBondContact O-CB 3.5Å; E568-E572 PolarHBondContact O-N 2.83Å
569	L	88.2	Confident	86.9	Confident	3 Å²	3	33.2 Å²	33.2	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-67.7	-34.3	178.7	-70.6	173.2	0	0	0	112.7	F535 L538 W539 L550 V565 G566 R567 L573	F535-L569 HydrophobicContact CE2-CB 3.92Å; F535-L569 HydrophobicContact CZ-CB 4.46Å; L538-L569 HydrophobicContact CD1-CD2 4.5Å; L538-L569 HydrophobicContact CD2-CD2 3.88Å; L538-L569 HydrophobicContact CG-CD1 4.21Å; L538-L569 HydrophobicContact CG-CD2 3.96Å; W539-L569 HydrophobicContact CB-CD1 4.14Å; W539-L569 HydrophobicContact CG-CD1 4.42Å; L550-L569 HydrophobicContact CD1-CD1 4.46Å; L550-L569 HydrophobicContact CD1-CD2 4.09Å; V565-L569 HydrophobicContact CG1-CD1 3.82Å; V565-L569 HydrophobicContact CG1-CG 4.35Å; V565-L569 WeakPolarHBondContact O-CB 3.29Å; V565-L569 WeakPolarHBondContact O-CG 3.49Å; V565-L569 PolarHBondContact O-N 2.73Å; G566-L569 PolarHBondContact O-N 2.89Å; R567-L569 PolarHBondContact O-N 3.44Å; L569-L573 WeakPolarHBondContact O-CB 3.33Å; L569-L573 WeakPolarHBondContact O-CG 3.3Å; L569-L573 PolarHBondContact O-N 3.27Å
570	A	90.3	Very high	87.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-69	-47.2	177.8	0	0	0	0	0	111.1	F535 G566 R567 E572 L573 G574 Y575 W577	F535-A570 HydrophobicContact CE2-CB 4.18Å; F535-A570 HydrophobicContact CZ-CB 4.26Å; G566-A570 VanDerWaalsContact O-CB 3.29Å; G566-A570 WeakPolarHBondContact O-CB 3.47Å; G566-A570 PolarHBondContact O-N 3.17Å; R567-A570 PolarHBondContact O-N 2.78Å; A570-E572 PolarHBondContact O-N 2.96Å; A570-L573 CarbonylContact O-C 3.54Å; A570-L573 PolarHBondContact O-N 3.04Å; A570-G574 PolarHBondContact O-N 3.34Å; A570-Y575 PolarHBondContact O-N 2.94Å; A570-W577 HydrophobicContact CB-CB 3.84Å; A570-W577 HydrophobicContact CB-CD2 4.41Å; A570-W577 HydrophobicContact CB-CE3 4.09Å; A570-W577 HydrophobicContact CB-CG 4.35Å
571	H	88.1	Confident	87.8	Confident	69 Å²	69	31.1 Å²	31.1	32%	0.319	16%	0.163	S	C	.	.	H	α-helix	trans	-64.7	-38.4	175.5	-61.9	-53.3	0	0	0	112.7	R567 L573 G574 D589 S591	R567-H571 WeakPolarHBondContact CG-NE2 3.36Å; R567-H571 PolarHBondContact O-CD2 3.5Å; R567-H571 PolarHBondContact O-N 3.43Å; H571-L573 PolarHBondContact O-N 3.47Å; H571-G574 PolarHBondContact O-N 3.25Å; H571-D589 IonicContact CE1-OD2 2.7Å; H571-D589 PolarHBondContact CE1-OD2 2.63Å; H571-S591 PolarHBondContact CE1-OG 2.86Å
572	E	88.1	Confident	88	Confident	117 Å²	117	36.3 Å²	36.3	55%	0.547	19%	0.187	S	C	.	.	H	α-helix	trans	-61.3	-34.3	175.4	-173.7	179.4	-160.9	0	0	112.3	K546 E568 A570	K546-E572 IonicContact NZ-OE1 2.79Å; K546-E572 PolarHBondContact NZ-OE1 3.28Å; K546-E572 IonicContact NZ-OE2 2.74Å; K546-E572 PolarHBondContact NZ-OE2 3.17Å; E568-E572 WeakPolarHBondContact O-CB 3.5Å; E568-E572 PolarHBondContact O-N 2.83Å; A570-E572 PolarHBondContact O-N 2.96Å
573	L	87.5	Confident	88	Confident	69 Å²	69	35.3 Å²	35.3	36%	0.361	18%	0.182	S	C	.	.	H	α-helix	trans	-92.9	-4	179.8	-66.4	172.4	0	0	0	114	F535 L538 L569 A570 H571 Y575	F535-L573 HydrophobicContact CD2-CD1 3.93Å; L538-L573 HydrophobicContact CD2-CD1 3.82Å; L569-L573 WeakPolarHBondContact O-CB 3.33Å; L569-L573 WeakPolarHBondContact O-CG 3.3Å; L569-L573 PolarHBondContact O-N 3.27Å; A570-L573 CarbonylContact O-C 3.54Å; A570-L573 PolarHBondContact O-N 3.04Å; H571-L573 PolarHBondContact O-N 3.47Å; L573-Y575 VanDerWaalsContact C-N 3.32Å; L573-Y575 HydrophobicContact CB-CD1 3.86Å; L573-Y575 HydrophobicContact CB-CD2 3.92Å; L573-Y575 HydrophobicContact CB-CE1 3.86Å; L573-Y575 HydrophobicContact CB-CE2 3.96Å; L573-Y575 HydrophobicContact CB-CG 3.87Å; L573-Y575 HydrophobicContact CD1-CD2 4.13Å; L573-Y575 HydrophobicContact CD1-CE2 3.79Å; L573-Y575 HydrophobicContact CG-CE2 4.48Å; L573-Y575 WeakPolarHBondContact O-CD1 3.41Å; L573-Y575 VanDerWaalsContact O-CE1 3.28Å; L573-Y575 WeakPolarHBondContact O-CE1 3.48Å
574	G	86.1	Confident	87.8	Confident	66 Å²	66	37 Å²	37	68%	0.68	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.8	31.8	-174.4	0	0	0	0	0	113.5	A570 H571	A570-G574 PolarHBondContact O-N 3.34Å; H571-G574 PolarHBondContact O-N 3.25Å
575	Y	90.1	Very high	87.6	Confident	43 Å²	43	37.3 Å²	37.3	17%	0.169	21%	0.207	C	C	.	.			trans	-97.8	142.4	-176.5	-69	0.2	0	0	0	111.2	L527 K531 F535 A570 L573 W577	L527-Y575 HydrophobicContact CD1-CD2 3.63Å; L527-Y575 HydrophobicContact CD1-CE2 4.09Å; L527-Y575 HydrophobicContact CD1-CG 4.24Å; L527-Y575 HydrophobicContact CD2-CD1 3.78Å; L527-Y575 HydrophobicContact CD2-CD2 3.64Å; L527-Y575 HydrophobicContact CD2-CE1 4.2Å; L527-Y575 HydrophobicContact CD2-CE2 4.04Å; L527-Y575 HydrophobicContact CD2-CG 3.51Å; L527-Y575 HydrophobicContact CG-CD2 4.3Å; L527-Y575 HydrophobicContact CG-CG 4.5Å; K531-Y575 HydrophobicContact CB-CE2 4.27Å; K531-Y575 HydrophobicContact CD-CE1 4.14Å; F535-Y575 HydrophobicContact CB-CD2 4.36Å; F535-Y575 HydrophobicContact CB-CE2 4.16Å; F535-Y575 AromaticContact CD2-CD2 3.74Å; F535-Y575 HydrophobicContact CD2-CD2 3.74Å; F535-Y575 HydrophobicContact CD2-CE2 4.14Å; F535-Y575 HydrophobicContact CE2-CD2 4.41Å; F535-Y575 HydrophobicContact CG-CD2 4.27Å; A570-Y575 PolarHBondContact O-N 2.94Å; L573-Y575 VanDerWaalsContact C-N 3.32Å; L573-Y575 HydrophobicContact CB-CD1 3.86Å; L573-Y575 HydrophobicContact CB-CD2 3.92Å; L573-Y575 HydrophobicContact CB-CE1 3.86Å; L573-Y575 HydrophobicContact CB-CE2 3.96Å; L573-Y575 HydrophobicContact CB-CG 3.87Å; L573-Y575 HydrophobicContact CD1-CD2 4.13Å; L573-Y575 HydrophobicContact CD1-CE2 3.79Å; L573-Y575 HydrophobicContact CG-CE2 4.48Å; L573-Y575 WeakPolarHBondContact O-CD1 3.41Å; L573-Y575 VanDerWaalsContact O-CE1 3.28Å; L573-Y575 WeakPolarHBondContact O-CE1 3.48Å; Y575-W577 PolarHBondContact O-N 3.29Å
576	P	88.3	Confident	87.6	Confident	47 Å²	47	38.4 Å²	38.4	31%	0.305	21%	0.214	S	C	.	.			trans	-63.3	128.9	175.4	-19.6	31.7	0	0	0	111.5	A524 G525 L726	A524-P576 WeakPolarHBondContact CA-O 3.37Å; G525-P576 PolarHBondContact N-O 3.46Å; P576-L726 HydrophobicContact CB-CD1 4.47Å; P576-L726 HydrophobicContact CB-CD2 4.12Å; P576-L726 HydrophobicContact CG-CD2 4.35Å
577	W	90.8	Very high	87.6	Confident	6 Å²	6	39.7 Å²	39.7	2%	0.023	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	146.5	177	-179.7	-106.8	0	0	0	109.5	A522 A524 F535 W539 E563 R567 A570 Y575 E579 D589	A522-W577 HydrophobicContact CB-CH2 3.62Å; A522-W577 HydrophobicContact CB-CZ2 3.48Å; A522-W577 VanDerWaalsContact CB-CZ2 3.48Å; A524-W577 HydrophobicContact CB-CE3 3.99Å; A524-W577 HydrophobicContact CB-CZ3 4.25Å; F535-W577 HydrophobicContact CZ-CZ3 4.43Å; W539-W577 AromaticContact CH2-CH2 3.48Å; W539-W577 HydrophobicContact CH2-CH2 3.48Å; W539-W577 VanDerWaalsContact CH2-CH2 3.48Å; W539-W577 AromaticContact CH2-CZ3 3.58Å; W539-W577 HydrophobicContact CH2-CZ3 3.58Å; W539-W577 AromaticContact CZ2-CH2 3.54Å; W539-W577 HydrophobicContact CZ2-CH2 3.54Å; W539-W577 AromaticContact CZ2-CZ3 3.95Å; W539-W577 HydrophobicContact CZ2-CZ3 3.95Å; W539-W577 HydrophobicContact CZ3-CH2 4.47Å; W539-W577 HydrophobicContact CZ3-CZ3 4.15Å; E563-W577 VanDerWaalsContact O-CZ2 3.3Å; E563-W577 WeakPolarHBondContact O-CZ2 3.38Å; R567-W577 HydrophobicContact CB-CD2 4.25Å; R567-W577 HydrophobicContact CB-CG 4.29Å; R567-W577 HydrophobicContact CB-CZ2 4.31Å; R567-W577 HydrophobicContact CG-CG 4.27Å; A570-W577 HydrophobicContact CB-CB 3.84Å; A570-W577 HydrophobicContact CB-CD2 4.41Å; A570-W577 HydrophobicContact CB-CE3 4.09Å; A570-W577 HydrophobicContact CB-CG 4.35Å; Y575-W577 PolarHBondContact O-N 3.29Å; W577-E579 HydrophobicContact CZ2-CB 4.36Å; W577-E579 PolarHBondContact NE1-OE2 3.36Å; W577-D589 WeakPolarHBondContact O-CB 3.3Å
578	V	90.3	Very high	87.5	Confident	6 Å²	6	39.5 Å²	39.5	4%	0.036	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	134.8	170	-159.7	0	0	0	0	109.5	A522 F523 F587 L726	A522-V578 CarbonylContact C-O 3.59Å; A522-V578 VanDerWaalsContact CA-O 3.25Å; A522-V578 WeakPolarHBondContact CA-O 3.21Å; A522-V578 WeakPolarHBondContact CB-O 3.28Å; F523-V578 HydrophobicContact CD1-CB 4.43Å; F523-V578 HydrophobicContact CD2-CB 4.33Å; F523-V578 HydrophobicContact CD2-CG2 4.2Å; F523-V578 HydrophobicContact CE1-CB 3.95Å; F523-V578 HydrophobicContact CE1-CG1 4.39Å; F523-V578 HydrophobicContact CE1-CG2 4.38Å; F523-V578 HydrophobicContact CE2-CB 3.85Å; F523-V578 HydrophobicContact CE2-CG2 3.46Å; F523-V578 VanDerWaalsContact CE2-CG2 3.46Å; F523-V578 HydrophobicContact CZ-CB 3.65Å; F523-V578 HydrophobicContact CZ-CG1 4.19Å; F523-V578 HydrophobicContact CZ-CG2 3.57Å; F523-V578 PolarHBondContact N-O 3.05Å; F523-V578 PolarHBondContact O-N 2.91Å; V578-F587 VanDerWaalsContact CG1-C 3.49Å; V578-F587 HydrophobicContact CG1-CB 3.72Å; V578-L726 HydrophobicContact CG2-CD1 4.24Å
579	E	90.8	Very high	87.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.1	179.9	70.6	-159.9	175.7	0	0	112.7	A522 R567 W577 W581 F587 V588	A522-E579 HydrophobicContact CB-CB 3.75Å; R567-E579 IonicContact CZ-OE1 3.18Å; R567-E579 IonicContact CZ-OE2 2.64Å; R567-E579 IonicContact NE-OE1 3.6Å; R567-E579 IonicContact NH1-OE1 3.73Å; R567-E579 PolarHBondContact NH1-OE1 3.41Å; R567-E579 IonicContact NH1-OE2 2.82Å; R567-E579 PolarHBondContact NH1-OE2 3.12Å; W577-E579 HydrophobicContact CZ2-CB 4.36Å; W577-E579 PolarHBondContact NE1-OE2 3.36Å; E579-W581 HydrophobicContact CG-CZ2 4.28Å; E579-W581 VanDerWaalsContact CG-NE1 3.3Å; E579-W581 WeakPolarHBondContact OE1-CZ2 3.33Å; E579-W581 PolarHBondContact OE1-NE1 3.44Å; E579-F587 CarbonylContact O-C 3.43Å; E579-F587 WeakPolarHBondContact O-CA 3.41Å; E579-V588 PolarHBondContact O-N 3.11Å; E579-V588 VanDerWaalsContact O-O 3.08Å
580	Y	87.6	Confident	87.6	Confident	64 Å²	64	37.4 Å²	37.4	25%	0.251	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	129.6	-175.2	-171.8	-110.7	0	0	0	112	R521 R560 E582 G585 F587	R521-Y580 WeakPolarHBondContact O-CB 3.44Å; R521-Y580 PolarHBondContact O-N 3.42Å; R560-Y580 VanDerWaalsContact CZ-O 3.27Å; R560-Y580 PolarHBondContact NH1-O 3.08Å; R560-Y580 PolarHBondContact NH2-O 3.17Å; Y580-E582 HydrophobicContact CD1-CG 4.01Å; Y580-E582 HydrophobicContact CE1-CB 4.41Å; Y580-E582 HydrophobicContact CE1-CG 3.67Å; Y580-G585 WeakPolarHBondContact CE2-O 2.97Å; Y580-G585 PolarHBondContact OH-O 3.45Å; Y580-F587 HydrophobicContact CD2-CD1 4.45Å; Y580-F587 AromaticContact CD2-CD2 3.65Å; Y580-F587 HydrophobicContact CD2-CD2 3.65Å; Y580-F587 HydrophobicContact CD2-CE1 4.4Å; Y580-F587 AromaticContact CD2-CE2 3.58Å; Y580-F587 HydrophobicContact CD2-CE2 3.58Å; Y580-F587 HydrophobicContact CD2-CG 4.09Å; Y580-F587 AromaticContact CD2-CZ 3.98Å; Y580-F587 HydrophobicContact CD2-CZ 3.98Å; Y580-F587 HydrophobicContact CE2-CD2 4.36Å; Y580-F587 HydrophobicContact CE2-CE2 4.26Å; Y580-F587 HydrophobicContact CG-CE1 4.47Å; Y580-F587 HydrophobicContact CG-CE2 4.29Å; Y580-F587 HydrophobicContact CG-CZ 4.24Å
581	W	87.4	Confident	87.4	Confident	1 Å²	1	38.7 Å²	38.7	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	103.1	177.3	-70.6	101.5	0	0	0	110.8	E579 F583 L584 G585 C586 V588 L590 L835 D838 V839 A842	E579-W581 HydrophobicContact CG-CZ2 4.28Å; E579-W581 VanDerWaalsContact CG-NE1 3.3Å; E579-W581 WeakPolarHBondContact OE1-CZ2 3.33Å; E579-W581 PolarHBondContact OE1-NE1 3.44Å; W581-F583 HydrophobicContact CB-CD1 4.18Å; W581-F583 HydrophobicContact CB-CE1 3.98Å; W581-F583 HydrophobicContact CD2-CE1 4.06Å; W581-F583 HydrophobicContact CE3-CD1 4.2Å; W581-F583 AromaticContact CE3-CE1 3.64Å; W581-F583 HydrophobicContact CE3-CE1 3.64Å; W581-F583 HydrophobicContact CG-CE1 4.24Å; W581-F583 HydrophobicContact CZ3-CE1 4.43Å; W581-F583 PolarHBondContact O-N 3.22Å; W581-F583 VanDerWaalsContact O-N 3.07Å; W581-L584 HydrophobicContact CB-CB 4.24Å; W581-L584 HydrophobicContact CB-CD1 4.18Å; W581-L584 HydrophobicContact CB-CG 4.27Å; W581-L584 CarbonylContact O-C 3.37Å; W581-L584 PolarHBondContact O-N 2.86Å; W581-G585 PolarHBondContact O-N 2.88Å; W581-C586 PolarHBondContact N-O 3.5Å; W581-V588 PolarHBondContact NE1-O 2.99Å; W581-L590 HydrophobicContact CD2-CD1 3.92Å; W581-L590 VanDerWaalsContact CE2-CD1 3.43Å; W581-L590 HydrophobicContact CG-CD1 4.34Å; W581-L590 HydrophobicContact CH2-CD1 4.21Å; W581-L590 HydrophobicContact CZ2-CD1 3.59Å; W581-L590 HydrophobicContact CZ2-CG 4.27Å; W581-L835 HydrophobicContact CE3-CD1 4.06Å; W581-L835 HydrophobicContact CZ3-CD1 3.88Å; W581-D838 HydrophobicContact CH2-CB 4.49Å; W581-V839 HydrophobicContact CE3-CG2 3.98Å; W581-V839 HydrophobicContact CH2-CG2 3.78Å; W581-V839 HydrophobicContact CZ3-CG2 3.49Å; W581-V839 VanDerWaalsContact CZ3-CG2 3.49Å; W581-A842 HydrophobicContact CH2-CB 4.35Å; W581-A842 HydrophobicContact CZ2-CB 3.87Å
582	E	85.3	Confident	87.4	Confident	108 Å²	108	37.3 Å²	37.3	51%	0.505	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-31	-175.6	-72	171.3	-166.2	0	0	113.8	R521 Y580	R521-E582 IonicContact CZ-OE1 3.71Å; R521-E582 IonicContact NH1-OE1 3.37Å; R521-E582 PolarHBondContact NH1-OE1 3.5Å; R521-E582 IonicContact NH2-OE1 3.35Å; R521-E582 PolarHBondContact NH2-OE1 3.18Å; Y580-E582 HydrophobicContact CD1-CG 4.01Å; Y580-E582 HydrophobicContact CE1-CB 4.41Å; Y580-E582 HydrophobicContact CE1-CG 3.67Å
583	F	83.9	Confident	87.3	Confident	26 Å²	26	34.9 Å²	34.9	11%	0.114	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-21.8	178.4	76.8	-86.1	0	0	0	114.3	W581 L599 Y602 L827 L835 V839	W581-F583 HydrophobicContact CB-CD1 4.18Å; W581-F583 HydrophobicContact CB-CE1 3.98Å; W581-F583 HydrophobicContact CD2-CE1 4.06Å; W581-F583 HydrophobicContact CE3-CD1 4.2Å; W581-F583 AromaticContact CE3-CE1 3.64Å; W581-F583 HydrophobicContact CE3-CE1 3.64Å; W581-F583 HydrophobicContact CG-CE1 4.24Å; W581-F583 HydrophobicContact CZ3-CE1 4.43Å; W581-F583 PolarHBondContact O-N 3.22Å; W581-F583 VanDerWaalsContact O-N 3.07Å; F583-L599 HydrophobicContact CE2-CD1 3.7Å; F583-L599 HydrophobicContact CZ-CD1 3.75Å; F583-Y602 AromaticContact CD2-CD1 3.86Å; F583-Y602 HydrophobicContact CD2-CD1 3.86Å; F583-Y602 HydrophobicContact CD2-CD2 4.07Å; F583-Y602 AromaticContact CD2-CE1 3.66Å; F583-Y602 HydrophobicContact CD2-CE1 3.66Å; F583-Y602 AromaticContact CD2-CE2 3.88Å; F583-Y602 HydrophobicContact CD2-CE2 3.88Å; F583-Y602 HydrophobicContact CD2-CG 4.07Å; F583-Y602 AromaticContact CD2-CZ 3.67Å; F583-Y602 AromaticContact CE2-CD1 3.88Å; F583-Y602 HydrophobicContact CE2-CD1 3.88Å; F583-Y602 HydrophobicContact CE2-CE1 4.08Å; F583-Y602 HydrophobicContact CE2-CG 4.16Å; F583-Y602 VanDerWaalsContact O-CE2 3.29Å; F583-Y602 WeakPolarHBondContact O-CE2 3.42Å; F583-L827 HydrophobicContact CD2-CD2 4.47Å; F583-L827 HydrophobicContact CE2-CD2 3.94Å; F583-L827 HydrophobicContact CZ-CD1 4.29Å; F583-L827 HydrophobicContact CZ-CD2 4.34Å; F583-L835 HydrophobicContact CB-CD2 4.12Å; F583-L835 HydrophobicContact CD1-CD1 3.9Å; F583-L835 HydrophobicContact CD1-CD2 3.71Å; F583-L835 HydrophobicContact CD1-CG 4.24Å; F583-L835 HydrophobicContact CE1-CD1 4.12Å; F583-L835 HydrophobicContact CE1-CD2 4.34Å; F583-L835 HydrophobicContact CE1-CG 4.48Å; F583-L835 HydrophobicContact CG-CD2 4.01Å; F583-V839 HydrophobicContact CE1-CG2 3.72Å; F583-V839 HydrophobicContact CZ-CG2 3.95Å
584	L	83.9	Confident	87.2	Confident	38 Å²	38	36.4 Å²	36.4	20%	0.199	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-14.9	171.6	-61.3	179.3	0	0	0	112.1	W581 C586 V588 L590 R598 Y602	W581-L584 HydrophobicContact CB-CB 4.24Å; W581-L584 HydrophobicContact CB-CD1 4.18Å; W581-L584 HydrophobicContact CB-CG 4.27Å; W581-L584 CarbonylContact O-C 3.37Å; W581-L584 PolarHBondContact O-N 2.86Å; L584-C586 PolarHBondContact O-N 3.17Å; L584-V588 HydrophobicContact CD1-CG1 3.81Å; L584-L590 HydrophobicContact CD1-CD2 3.87Å; L584-R598 HydrophobicContact CD1-CB 4.41Å; L584-Y602 HydrophobicContact CD2-CD2 3.97Å; L584-Y602 HydrophobicContact CD2-CG 3.91Å
585	G	82.8	Confident	87.3	Confident	47 Å²	47	33.2 Å²	33.2	49%	0.485	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	3.5	-175.5	0	0	0	0	0	114.9	Y580 W581	Y580-G585 WeakPolarHBondContact CE2-O 2.97Å; Y580-G585 PolarHBondContact OH-O 3.45Å; W581-G585 PolarHBondContact O-N 2.88Å
586	C	86.2	Confident	87.2	Confident	24 Å²	24	31.4 Å²	31.4	16%	0.162	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	165.7	-171	71.3	0	0	0	0	114	W581 L584	W581-C586 PolarHBondContact N-O 3.5Å; L584-C586 PolarHBondContact O-N 3.17Å
587	F	87.3	Confident	87.2	Confident	28 Å²	28	33.6 Å²	33.6	12%	0.123	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.8	167.7	-75.8	-92.9	0	0	0	109.6	L520 F523 V578 E579 Y580 V729 T733	L520-F587 HydrophobicContact CB-CZ 4.07Å; L520-F587 HydrophobicContact CD2-CE1 3.98Å; L520-F587 HydrophobicContact CD2-CZ 3.79Å; L520-F587 HydrophobicContact CG-CE1 3.85Å; L520-F587 HydrophobicContact CG-CZ 3.78Å; L520-F587 WeakPolarHBondContact O-CZ 2.99Å; F523-F587 HydrophobicContact CD1-CD1 4.33Å; F523-F587 HydrophobicContact CE1-CD1 4.09Å; F523-F587 HydrophobicContact CE1-CG 4.48Å; V578-F587 VanDerWaalsContact CG1-C 3.49Å; V578-F587 HydrophobicContact CG1-CB 3.72Å; E579-F587 CarbonylContact O-C 3.43Å; E579-F587 WeakPolarHBondContact O-CA 3.41Å; Y580-F587 HydrophobicContact CD2-CD1 4.45Å; Y580-F587 AromaticContact CD2-CD2 3.65Å; Y580-F587 HydrophobicContact CD2-CD2 3.65Å; Y580-F587 HydrophobicContact CD2-CE1 4.4Å; Y580-F587 AromaticContact CD2-CE2 3.58Å; Y580-F587 HydrophobicContact CD2-CE2 3.58Å; Y580-F587 HydrophobicContact CD2-CG 4.09Å; Y580-F587 AromaticContact CD2-CZ 3.98Å; Y580-F587 HydrophobicContact CD2-CZ 3.98Å; Y580-F587 HydrophobicContact CE2-CD2 4.36Å; Y580-F587 HydrophobicContact CE2-CE2 4.26Å; Y580-F587 HydrophobicContact CG-CE1 4.47Å; Y580-F587 HydrophobicContact CG-CE2 4.29Å; Y580-F587 HydrophobicContact CG-CZ 4.24Å; F587-V729 HydrophobicContact CB-CG1 3.64Å; F587-V729 HydrophobicContact CG-CG1 4.25Å; F587-T733 HydrophobicContact CD2-CG2 3.48Å; F587-T733 VanDerWaalsContact CD2-CG2 3.48Å; F587-T733 HydrophobicContact CE2-CG2 3.52Å; F587-T733 HydrophobicContact CG-CG2 4.45Å
588	V	87.6	Confident	87	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.036	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	147.4	176.5	66.5	0	0	0	0	111.1	E579 W581 L584 L590	E579-V588 PolarHBondContact O-N 3.11Å; E579-V588 VanDerWaalsContact O-O 3.08Å; W581-V588 PolarHBondContact NE1-O 2.99Å; L584-V588 HydrophobicContact CD1-CG1 3.81Å; V588-L590 HydrophobicContact CG1-CD2 3.82Å
589	D	89.8	Confident	86.9	Confident	20 Å²	20	37.9 Å²	37.9	11%	0.107	19%	0.194	C	C	.	.			trans	-87.9	113.3	164.4	177.2	-1	0	0	0	109.3	H571 W577 S591 S592 G595	H571-D589 IonicContact CE1-OD2 2.7Å; H571-D589 PolarHBondContact CE1-OD2 2.63Å; W577-D589 WeakPolarHBondContact O-CB 3.3Å; D589-S591 PolarHBondContact O-N 3.41Å; D589-S591 WeakPolarHBondContact OD1-CB 3.29Å; D589-S591 PolarHBondContact OD1-N 3.3Å; D589-S591 PolarHBondContact OD1-OG 3.47Å; D589-S591 PolarHBondContact OD2-OG 3.12Å; D589-S591 VanDerWaalsContact OD2-OG 3.11Å; D589-S592 WeakPolarHBondContact O-CB 3.45Å; D589-S592 PolarHBondContact O-N 2.93Å; D589-S592 VanDerWaalsContact O-N 3.16Å; D589-S592 PolarHBondContact O-OG 3.38Å; D589-G595 WeakPolarHBondContact O-CA 3.48Å
590	L	86.6	Confident	86.9	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-18.7	-178.5	-64	-178.6	0	0	0	113.7	W581 L584 V588 S592 V839 A842 L843	W581-L590 HydrophobicContact CD2-CD1 3.92Å; W581-L590 VanDerWaalsContact CE2-CD1 3.43Å; W581-L590 HydrophobicContact CG-CD1 4.34Å; W581-L590 HydrophobicContact CH2-CD1 4.21Å; W581-L590 HydrophobicContact CZ2-CD1 3.59Å; W581-L590 HydrophobicContact CZ2-CG 4.27Å; L584-L590 HydrophobicContact CD1-CD2 3.87Å; V588-L590 HydrophobicContact CG1-CD2 3.82Å; L590-S592 VanDerWaalsContact C-N 3.28Å; L590-V839 HydrophobicContact CD1-CB 4.31Å; L590-V839 HydrophobicContact CD1-CG1 3.81Å; L590-V839 HydrophobicContact CD1-CG2 3.88Å; L590-A842 HydrophobicContact CB-CB 4.17Å; L590-A842 HydrophobicContact CD1-CB 4.36Å; L590-L843 HydrophobicContact CB-CD2 4.19Å; L590-L843 WeakPolarHBondContact O-CD2 3.33Å
591	S	86.8	Confident	87	Confident	27 Å²	27	41.6 Å²	41.6	19%	0.189	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.9	175	75	0	0	0	0	113.3	H571 D589	H571-S591 PolarHBondContact CE1-OG 2.86Å; D589-S591 PolarHBondContact O-N 3.41Å; D589-S591 WeakPolarHBondContact OD1-CB 3.29Å; D589-S591 PolarHBondContact OD1-N 3.3Å; D589-S591 PolarHBondContact OD1-OG 3.47Å; D589-S591 PolarHBondContact OD2-OG 3.12Å; D589-S591 VanDerWaalsContact OD2-OG 3.11Å
592	S	88	Confident	87	Confident	41 Å²	41	44.3 Å²	44.3	29%	0.287	23%	0.225	S	C	.	.	S	Bend	trans	-78.6	157.4	177.1	75.6	0	0	0	0	112.6	D589 L590 E594 G595 L596	D589-S592 WeakPolarHBondContact O-CB 3.45Å; D589-S592 PolarHBondContact O-N 2.93Å; D589-S592 VanDerWaalsContact O-N 3.16Å; D589-S592 PolarHBondContact O-OG 3.38Å; L590-S592 VanDerWaalsContact C-N 3.28Å; S592-E594 PolarHBondContact O-N 2.91Å; S592-G595 WeakPolarHBondContact O-CA 3.43Å; S592-G595 PolarHBondContact O-N 2.7Å; S592-G595 PolarHBondContact OG-N 2.69Å; S592-G595 VanDerWaalsContact OG-N 3.1Å; S592-L596 PolarHBondContact O-N 3.11Å
593	Q	86.8	Confident	87.1	Confident	66 Å²	66	39.4 Å²	39.4	31%	0.308	20%	0.202	S	C	.	.	H	α-helix	trans	-60	-30.3	176.7	-175.1	66.7	-5.8	0	0	112.8	Q597	Q593-Q597 VanDerWaalsContact O-CG 3.29Å; Q593-Q597 WeakPolarHBondContact O-CG 3.41Å; Q593-Q597 PolarHBondContact O-N 3.46Å; Q593-Q597 PolarHBondContact O-NE2 3.31Å
594	E	85.8	Confident	87.2	Confident	100 Å²	100	40.3 Å²	40.3	47%	0.467	21%	0.21	S	C	.	.	H	α-helix	trans	-71.8	-42.6	171.8	-166.9	-170.2	150.7	0	0	111.5	S592 L596 Q597 R598	S592-E594 PolarHBondContact O-N 2.91Å; E594-L596 VanDerWaalsContact C-N 3.34Å; E594-L596 PolarHBondContact O-N 3.03Å; E594-Q597 WeakPolarHBondContact O-CB 3.13Å; E594-Q597 PolarHBondContact O-N 3.28Å; E594-R598 HydrophobicContact CG-CG 4.29Å; E594-R598 WeakPolarHBondContact O-CG 3.32Å; E594-R598 PolarHBondContact O-N 2.84Å; E594-R598 IonicContact OE1-CZ 2.68Å; E594-R598 VanDerWaalsContact OE1-CZ 3.23Å; E594-R598 IonicContact OE1-NE 2.77Å; E594-R598 PolarHBondContact OE1-NE 2.83Å; E594-R598 IonicContact OE1-NH2 3.81Å; E594-R598 PolarHBondContact OE1-NH2 2.9Å
595	G	86.4	Confident	87.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-41	177.5	0	0	0	0	0	113.4	D589 S592 R598 L599	D589-G595 WeakPolarHBondContact O-CA 3.48Å; S592-G595 WeakPolarHBondContact O-CA 3.43Å; S592-G595 PolarHBondContact O-N 2.7Å; S592-G595 PolarHBondContact OG-N 2.69Å; S592-G595 VanDerWaalsContact OG-N 3.1Å; G595-R598 PolarHBondContact O-N 2.88Å; G595-L599 WeakPolarHBondContact O-CB 3.46Å; G595-L599 PolarHBondContact O-N 3.38Å
596	L	88.8	Confident	87.3	Confident	5 Å²	5	44 Å²	44	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-42.7	172.9	-68.1	174.1	0	0	0	112.1	S592 E594 L599 E600 L843 V848 F853 V856	S592-L596 PolarHBondContact O-N 3.11Å; E594-L596 VanDerWaalsContact C-N 3.34Å; E594-L596 PolarHBondContact O-N 3.03Å; L596-L599 PolarHBondContact O-N 2.9Å; L596-E600 WeakPolarHBondContact O-CB 3.48Å; L596-E600 PolarHBondContact O-N 3.5Å; L596-L843 HydrophobicContact CD2-CD2 3.54Å; L596-V848 HydrophobicContact CD2-CG2 3.98Å; L596-F853 HydrophobicContact CB-CD1 4.02Å; L596-F853 HydrophobicContact CB-CD2 3.97Å; L596-F853 HydrophobicContact CB-CE1 3.73Å; L596-F853 HydrophobicContact CB-CE2 3.65Å; L596-F853 HydrophobicContact CB-CG 4.14Å; L596-F853 HydrophobicContact CB-CZ 3.52Å; L596-F853 HydrophobicContact CD1-CD2 3.97Å; L596-F853 HydrophobicContact CD1-CE2 3.64Å; L596-F853 HydrophobicContact CD1-CZ 4.29Å; L596-F853 HydrophobicContact CG-CD2 4.46Å; L596-F853 HydrophobicContact CG-CE2 4.26Å; L596-V856 HydrophobicContact CD2-CG1 4.38Å
597	Q	88.6	Confident	87.1	Confident	93 Å²	93	44.2 Å²	44.2	44%	0.435	21%	0.212	S	C	.	.	H	α-helix	trans	-62.5	-47.4	175	-72.3	170.1	33.6	0	0	111.9	Q593 E594 L599 E600 E601 F853	Q593-Q597 VanDerWaalsContact O-CG 3.29Å; Q593-Q597 WeakPolarHBondContact O-CG 3.41Å; Q593-Q597 PolarHBondContact O-N 3.46Å; Q593-Q597 PolarHBondContact O-NE2 3.31Å; E594-Q597 WeakPolarHBondContact O-CB 3.13Å; E594-Q597 PolarHBondContact O-N 3.28Å; Q597-L599 VanDerWaalsContact C-N 3.27Å; Q597-L599 PolarHBondContact O-N 3.42Å; Q597-E600 PolarHBondContact O-N 3.43Å; Q597-E601 WeakPolarHBondContact O-CG 3.46Å; Q597-E601 PolarHBondContact O-N 2.98Å; Q597-F853 HydrophobicContact CB-CE1 4.39Å; Q597-F853 HydrophobicContact CG-CE1 3.67Å; Q597-F853 HydrophobicContact CG-CZ 4.07Å
598	R	87.3	Confident	86.8	Confident	102 Å²	102	48.1 Å²	48.1	39%	0.385	23%	0.233	S	C	.	.	H	α-helix	trans	-59.1	-38.2	177.8	-61.6	-101.4	-167	165.7	1.8	111.8	L584 E594 G595 Y602	L584-R598 HydrophobicContact CD1-CB 4.41Å; E594-R598 HydrophobicContact CG-CG 4.29Å; E594-R598 WeakPolarHBondContact O-CG 3.32Å; E594-R598 PolarHBondContact O-N 2.84Å; E594-R598 IonicContact OE1-CZ 2.68Å; E594-R598 VanDerWaalsContact OE1-CZ 3.23Å; E594-R598 IonicContact OE1-NE 2.77Å; E594-R598 PolarHBondContact OE1-NE 2.83Å; E594-R598 IonicContact OE1-NH2 3.81Å; E594-R598 PolarHBondContact OE1-NH2 2.9Å; G595-R598 PolarHBondContact O-N 2.88Å; R598-Y602 WeakPolarHBondContact O-CB 3.47Å; R598-Y602 PolarHBondContact O-N 3.16Å
599	L	87.7	Confident	86.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-75.2	-38.2	178.9	-170.8	64.8	0	0	0	112.8	F583 G595 L596 Q597 Y602 L603 L827 V839 L843 V856	F583-L599 HydrophobicContact CE2-CD1 3.7Å; F583-L599 HydrophobicContact CZ-CD1 3.75Å; G595-L599 WeakPolarHBondContact O-CB 3.46Å; G595-L599 PolarHBondContact O-N 3.38Å; L596-L599 PolarHBondContact O-N 2.9Å; Q597-L599 VanDerWaalsContact C-N 3.27Å; Q597-L599 PolarHBondContact O-N 3.42Å; L599-Y602 PolarHBondContact O-N 3.2Å; L599-L603 HydrophobicContact CG-CD1 4.15Å; L599-L603 WeakPolarHBondContact O-CB 3.39Å; L599-L603 WeakPolarHBondContact O-CG 3.36Å; L599-L603 PolarHBondContact O-N 3.06Å; L599-L827 HydrophobicContact CD1-CD2 4Å; L599-V839 HydrophobicContact CD2-CG1 4.05Å; L599-L843 HydrophobicContact CD2-CD1 3.68Å; L599-V856 HydrophobicContact CB-CG2 4.06Å; L599-V856 HydrophobicContact CD2-CG1 3.91Å; L599-V856 HydrophobicContact CD2-CG2 4.04Å; L599-V856 HydrophobicContact CG-CG2 3.97Å
600	E	90.3	Very high	85.3	Confident	24 Å²	24	50.5 Å²	50.5	11%	0.112	25%	0.252	C	S	.	.	H	α-helix	trans	-63.3	-44	172.3	-176.4	68.2	-154.7	0	0	111	L596 Q597 Y602 L603 T604 F853 P854 A855 V856	L596-E600 WeakPolarHBondContact O-CB 3.48Å; L596-E600 PolarHBondContact O-N 3.5Å; Q597-E600 PolarHBondContact O-N 3.43Å; E600-Y602 PolarHBondContact O-N 3.44Å; E600-L603 PolarHBondContact O-N 3.02Å; E600-T604 HydrophobicContact CG-CG2 4.41Å; E600-T604 WeakPolarHBondContact O-CB 3.36Å; E600-T604 VanDerWaalsContact O-CG2 3.29Å; E600-T604 WeakPolarHBondContact O-CG2 3.49Å; E600-T604 PolarHBondContact O-N 2.93Å; E600-T604 PolarHBondContact O-OG1 3.42Å; E600-F853 HydrophobicContact CB-CD1 3.99Å; E600-F853 HydrophobicContact CG-CD1 4.34Å; E600-F853 VanDerWaalsContact OE2-CA 3.32Å; E600-F853 WeakPolarHBondContact OE2-CA 3.41Å; E600-P854 VanDerWaalsContact OE1-CD 3.32Å; E600-P854 WeakPolarHBondContact OE1-CD 3.42Å; E600-P854 WeakPolarHBondContact OE1-CG 3.43Å; E600-A855 VanDerWaalsContact CD-CB 3.5Å; E600-A855 VanDerWaalsContact CD-N 3.28Å; E600-A855 WeakPolarHBondContact OE1-CB 3.46Å; E600-A855 PolarHBondContact OE1-N 3.41Å; E600-A855 WeakPolarHBondContact OE2-CA 3.44Å; E600-A855 WeakPolarHBondContact OE2-CB 3.3Å; E600-A855 PolarHBondContact OE2-N 3.05Å; E600-V856 HydrophobicContact CB-CG2 3.97Å; E600-V856 WeakPolarHBondContact OE2-CG2 3.4Å; E600-V856 PolarHBondContact OE2-N 2.95Å
601	E	89.8	Confident	84.6	Confident	117 Å²	117	55.3 Å²	55.3	55%	0.547	27%	0.273	S	S	.	.	H	α-helix	trans	-60.4	-43.8	173.8	-75	-173.7	175.8	0	0	111.8	Q597 T604 Q605	Q597-E601 WeakPolarHBondContact O-CG 3.46Å; Q597-E601 PolarHBondContact O-N 2.98Å; E601-T604 WeakPolarHBondContact CA-OG1 3.4Å; E601-T604 PolarHBondContact O-OG1 2.86Å; E601-T604 VanDerWaalsContact O-OG1 3.12Å; E601-Q605 WeakPolarHBondContact O-CB 3.24Å; E601-Q605 WeakPolarHBondContact O-CG 3.33Å; E601-Q605 PolarHBondContact O-N 2.94Å; E601-Q605 PolarHBondContact O-NE2 2.74Å
602	Y	87.6	Confident	83.8	Confident	59 Å²	59	56.6 Å²	56.6	23%	0.231	28%	0.284	C	S	.	.	H	α-helix	trans	-62.1	-49.2	176.2	-179.6	-93.7	0	0	0	112.5	F583 L584 R598 L599 E600 Q605 Q606 L827	F583-Y602 AromaticContact CD2-CD1 3.86Å; F583-Y602 HydrophobicContact CD2-CD1 3.86Å; F583-Y602 HydrophobicContact CD2-CD2 4.07Å; F583-Y602 AromaticContact CD2-CE1 3.66Å; F583-Y602 HydrophobicContact CD2-CE1 3.66Å; F583-Y602 AromaticContact CD2-CE2 3.88Å; F583-Y602 HydrophobicContact CD2-CE2 3.88Å; F583-Y602 HydrophobicContact CD2-CG 4.07Å; F583-Y602 AromaticContact CD2-CZ 3.67Å; F583-Y602 AromaticContact CE2-CD1 3.88Å; F583-Y602 HydrophobicContact CE2-CD1 3.88Å; F583-Y602 HydrophobicContact CE2-CE1 4.08Å; F583-Y602 HydrophobicContact CE2-CG 4.16Å; F583-Y602 VanDerWaalsContact O-CE2 3.29Å; F583-Y602 WeakPolarHBondContact O-CE2 3.42Å; L584-Y602 HydrophobicContact CD2-CD2 3.97Å; L584-Y602 HydrophobicContact CD2-CG 3.91Å; R598-Y602 WeakPolarHBondContact O-CB 3.47Å; R598-Y602 PolarHBondContact O-N 3.16Å; L599-Y602 PolarHBondContact O-N 3.2Å; E600-Y602 PolarHBondContact O-N 3.44Å; Y602-Q605 PolarHBondContact O-N 3.4Å; Y602-Q606 WeakPolarHBondContact O-CB 3.43Å; Y602-Q606 PolarHBondContact O-N 2.73Å; Y602-L827 HydrophobicContact CD1-CD2 4.09Å; Y602-L827 HydrophobicContact CE1-CD2 3.95Å; Y602-L827 PolarHBondContact OH-O 2.85Å
603	L	86.2	Confident	82.5	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-66.7	-40.3	-178.6	-72.2	170.2	0	0	0	112.1	L599 E600 Q606 E607 L827 A855 V856 W859	L599-L603 HydrophobicContact CG-CD1 4.15Å; L599-L603 WeakPolarHBondContact O-CB 3.39Å; L599-L603 WeakPolarHBondContact O-CG 3.36Å; L599-L603 PolarHBondContact O-N 3.06Å; E600-L603 PolarHBondContact O-N 3.02Å; L603-Q606 PolarHBondContact O-N 3.25Å; L603-E607 PolarHBondContact O-N 3.41Å; L603-L827 HydrophobicContact CD2-CD2 3.89Å; L603-A855 HydrophobicContact CB-CB 3.84Å; L603-V856 HydrophobicContact CD1-CB 4.45Å; L603-V856 HydrophobicContact CD1-CG2 4.09Å; L603-W859 HydrophobicContact CD1-CB 3.82Å; L603-W859 HydrophobicContact CD1-CG 4.13Å; L603-W859 HydrophobicContact CD2-CB 4.34Å; L603-W859 HydrophobicContact CD2-CG 4.3Å
604	T	87	Confident	81.2	Confident	45 Å²	45	61.5 Å²	61.5	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-67.7	-39	176.5	52.5	0	0	0	0	112.1	E600 E601 E607 I608 A855	E600-T604 HydrophobicContact CG-CG2 4.41Å; E600-T604 WeakPolarHBondContact O-CB 3.36Å; E600-T604 VanDerWaalsContact O-CG2 3.29Å; E600-T604 WeakPolarHBondContact O-CG2 3.49Å; E600-T604 PolarHBondContact O-N 2.93Å; E600-T604 PolarHBondContact O-OG1 3.42Å; E601-T604 WeakPolarHBondContact CA-OG1 3.4Å; E601-T604 PolarHBondContact O-OG1 2.86Å; E601-T604 VanDerWaalsContact O-OG1 3.12Å; T604-E607 PolarHBondContact O-N 3.32Å; T604-I608 WeakPolarHBondContact O-CD1 3.42Å; T604-I608 VanDerWaalsContact O-CG1 3.25Å; T604-I608 WeakPolarHBondContact O-CG1 3.4Å; T604-I608 PolarHBondContact O-N 3.48Å; T604-A855 HydrophobicContact CG2-CB 3.91Å
605	Q	85.4	Confident	80	Confident	128 Å²	128	61.1 Å²	61.1	60%	0.598	30%	0.301	S	S	*	.	H	α-helix	trans	-62.2	-41.6	171	-72.6	171.6	42.9	0	0	111.8	E601 Y602 E607 I608 G609	E601-Q605 WeakPolarHBondContact O-CB 3.24Å; E601-Q605 WeakPolarHBondContact O-CG 3.33Å; E601-Q605 PolarHBondContact O-N 2.94Å; E601-Q605 PolarHBondContact O-NE2 2.74Å; Y602-Q605 PolarHBondContact O-N 3.4Å; Q605-E607 PolarHBondContact O-N 3.09Å; Q605-I608 PolarHBondContact O-N 2.9Å; Q605-G609 PolarHBondContact O-N 3.42Å
606	Q	83.1	Confident	78.8	Confident	33 Å²	33	64.9 Å²	64.9	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-40.7	176.3	-155	-150.8	69.5	0	0	111.8	Y602 L603 K610 F826 L827	Y602-Q606 WeakPolarHBondContact O-CB 3.43Å; Y602-Q606 PolarHBondContact O-N 2.73Å; L603-Q606 PolarHBondContact O-N 3.25Å; Q606-K610 WeakPolarHBondContact O-CG 3.34Å; Q606-K610 PolarHBondContact O-N 3.34Å; Q606-K610 VanDerWaalsContact O-N 3.15Å; Q606-F826 PolarHBondContact NE2-O 3.25Å; Q606-L827 PolarHBondContact NE2-O 3.3Å; Q606-L827 VanDerWaalsContact NE2-O 3.17Å
607	E	81.4	Confident	77.2	Confident	29 Å²	29	66.3 Å²	66.3	14%	0.136	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-45.3	173.1	-83.4	-164.1	-153.4	0	0	113	L603 T604 Q605 K610 K611 L825 R858	L603-E607 PolarHBondContact O-N 3.41Å; T604-E607 PolarHBondContact O-N 3.32Å; Q605-E607 PolarHBondContact O-N 3.09Å; E607-K610 PolarHBondContact O-N 2.8Å; E607-K611 WeakPolarHBondContact O-CD 3.06Å; E607-K611 VanDerWaalsContact O-CG 3.29Å; E607-K611 WeakPolarHBondContact O-CG 3.48Å; E607-K611 PolarHBondContact O-N 3.32Å; E607-K611 IonicContact OE2-NZ 3.42Å; E607-K611 PolarHBondContact OE2-NZ 3.29Å; E607-L825 HydrophobicContact CG-CD1 3.45Å; E607-L825 VanDerWaalsContact CG-CD1 3.45Å; E607-L825 HydrophobicContact CG-CD2 4.17Å; E607-L825 HydrophobicContact CG-CG 4.46Å; E607-L825 VanDerWaalsContact OE1-CD1 3.32Å; E607-L825 WeakPolarHBondContact OE1-CD1 3.47Å; E607-R858 IonicContact OE1-CZ 2.75Å; E607-R858 IonicContact OE1-NE 2.97Å; E607-R858 PolarHBondContact OE1-NE 3.47Å; E607-R858 IonicContact OE1-NH2 3.9Å; E607-R858 PolarHBondContact OE1-NH2 2.92Å; E607-R858 IonicContact OE2-NH2 3.72Å
608	I	82.4	Confident	75.7	Confident	110 Å²	110	67.3 Å²	67.3	56%	0.564	35%	0.345	S	S	*	.	H	α-helix	trans	-65.5	-44.3	-178.7	-68.4	162.1	0	0	0	110.4	T604 Q605 K610 K611 A612	T604-I608 WeakPolarHBondContact O-CD1 3.42Å; T604-I608 VanDerWaalsContact O-CG1 3.25Å; T604-I608 WeakPolarHBondContact O-CG1 3.4Å; T604-I608 PolarHBondContact O-N 3.48Å; Q605-I608 PolarHBondContact O-N 2.9Å; I608-K610 PolarHBondContact O-N 2.93Å; I608-K611 PolarHBondContact O-N 3.26Å; I608-A612 PolarHBondContact O-N 2.62Å
609	G	75	Confident	73.9	Confident	35 Å²	35	69.6 Å²	69.6	36%	0.361	35%	0.354	S	S	.	.	H	α-helix	trans	-59.9	-45.1	176.8	0	0	0	0	0	112.9	Q605 A612 Q613	Q605-G609 PolarHBondContact O-N 3.42Å; G609-A612 PolarHBondContact O-N 3.46Å; G609-Q613 WeakPolarHBondContact O-CG 3.43Å; G609-Q613 PolarHBondContact O-N 3.29Å
610	K	71.1	Confident	72.3	Confident	42 Å²	42	76.5 Å²	76.5	18%	0.183	39%	0.386	C	S	.	.	H	α-helix	trans	-64	-39.1	176.5	-75.2	173.1	173.7	172.2	0	112.6	Q606 E607 I608 Q614 L825 G829	Q606-K610 WeakPolarHBondContact O-CG 3.34Å; Q606-K610 PolarHBondContact O-N 3.34Å; Q606-K610 VanDerWaalsContact O-N 3.15Å; E607-K610 PolarHBondContact O-N 2.8Å; I608-K610 PolarHBondContact O-N 2.93Å; K610-Q614 PolarHBondContact O-N 3Å; K610-Q614 VanDerWaalsContact O-N 3.15Å; K610-L825 HydrophobicContact CD-CD2 3.97Å; K610-G829 PolarHBondContact NZ-O 2.95Å
611	K	70.1	Confident	70.3	Confident	101 Å²	101	79 Å²	79	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-61.3	-49.3	175	-73.2	161.1	-173.3	158	0	111.1	E607 I608 Q613 Q614 E615	E607-K611 WeakPolarHBondContact O-CD 3.06Å; E607-K611 VanDerWaalsContact O-CG 3.29Å; E607-K611 WeakPolarHBondContact O-CG 3.48Å; E607-K611 PolarHBondContact O-N 3.32Å; E607-K611 IonicContact OE2-NZ 3.42Å; E607-K611 PolarHBondContact OE2-NZ 3.29Å; I608-K611 PolarHBondContact O-N 3.26Å; K611-Q613 PolarHBondContact O-N 2.72Å; K611-Q614 PolarHBondContact O-N 3.27Å; K611-E615 PolarHBondContact O-N 3.36Å
612	A	69.9	Low	68.1	Low	53 Å²	53	77.7 Å²	77.7	44%	0.438	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-38	179	0	0	0	0	0	113.6	I608 G609 T616	I608-A612 PolarHBondContact O-N 2.62Å; G609-A612 PolarHBondContact O-N 3.46Å; A612-T616 PolarHBondContact O-N 2.77Å; A612-T616 VanDerWaalsContact O-N 3.16Å; A612-T616 PolarHBondContact O-OG1 3.38Å
613	Q	61.8	Low	66.1	Low	143 Å²	143	80 Å²	80	67%	0.668	44%	0.438	S	S	*	.	H	α-helix	trans	-64.3	-41.2	175.1	-75.5	176.6	-15	0	0	112.1	G609 K611 T616 G617	G609-Q613 WeakPolarHBondContact O-CG 3.43Å; G609-Q613 PolarHBondContact O-N 3.29Å; K611-Q613 PolarHBondContact O-N 2.72Å; Q613-T616 WeakPolarHBondContact O-CB 3.48Å; Q613-T616 PolarHBondContact O-N 2.68Å; Q613-G617 PolarHBondContact O-N 2.92Å
614	Q	59.3	Low	64.2	Low	67 Å²	67	82.4 Å²	82.4	31%	0.313	46%	0.464	S	S	.	.	H	α-helix	trans	-69.3	-43.3	176.9	-178.8	165.2	6.7	0	0	112.7	K610 K611 T616 G617 E618	K610-Q614 PolarHBondContact O-N 3Å; K610-Q614 VanDerWaalsContact O-N 3.15Å; K611-Q614 PolarHBondContact O-N 3.27Å; Q614-T616 PolarHBondContact O-N 2.91Å; Q614-T616 VanDerWaalsContact O-N 3.11Å; Q614-G617 PolarHBondContact O-N 2.79Å; Q614-G617 VanDerWaalsContact O-N 3.17Å; Q614-E618 HydrophobicContact CG-CG 4.06Å; Q614-E618 WeakPolarHBondContact CG-OE1 3.28Å; Q614-E618 PolarHBondContact NE2-OE1 2.83Å; Q614-E618 WeakPolarHBondContact O-CB 3.39Å; Q614-E618 WeakPolarHBondContact O-CG 3.02Å; Q614-E618 PolarHBondContact O-N 2.97Å
615	E	61.4	Low	62.1	Low	93 Å²	93	87.9 Å²	87.9	44%	0.435	49%	0.492	S	S	.	.	H	α-helix	trans	-59.2	-22.7	173.9	-73.9	-179.7	-145.7	0	0	112.7	K611 R619	K611-E615 PolarHBondContact O-N 3.36Å; E615-R619 WeakPolarHBondContact O-CD 3.4Å; E615-R619 WeakPolarHBondContact O-CG 3.43Å
616	T	60.9	Low	60.2	Low	78 Å²	78	91.6 Å²	91.6	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-81	-51.2	172.9	-53.8	0	0	0	0	111.3	A612 Q613 Q614 E618 R619 E620	A612-T616 PolarHBondContact O-N 2.77Å; A612-T616 VanDerWaalsContact O-N 3.16Å; A612-T616 PolarHBondContact O-OG1 3.38Å; Q613-T616 WeakPolarHBondContact O-CB 3.48Å; Q613-T616 PolarHBondContact O-N 2.68Å; Q614-T616 PolarHBondContact O-N 2.91Å; Q614-T616 VanDerWaalsContact O-N 3.11Å; T616-E618 VanDerWaalsContact C-N 3.34Å; T616-E618 PolarHBondContact O-N 3.22Å; T616-R619 WeakPolarHBondContact O-CB 3.33Å; T616-R619 PolarHBondContact O-N 3.48Å; T616-R619 VanDerWaalsContact O-N 3.16Å; T616-E620 PolarHBondContact O-N 2.87Å; T616-E620 VanDerWaalsContact O-N 3.11Å
617	G	54.4	Low	58.1	Low	36 Å²	36	94.2 Å²	94.2	37%	0.371	53%	0.533	S	S	.	.	H	α-helix	trans	-63.7	-34.1	-179.7	0	0	0	0	0	114.1	Q613 Q614 E620 A621	Q613-G617 PolarHBondContact O-N 2.92Å; Q614-G617 PolarHBondContact O-N 2.79Å; Q614-G617 VanDerWaalsContact O-N 3.17Å; G617-E620 PolarHBondContact O-N 3.49Å; G617-A621 WeakPolarHBondContact O-CB 3.39Å; G617-A621 PolarHBondContact O-N 3.12Å
618	E	56.5	Low	55.7	Low	114 Å²	114	99.7 Å²	99.7	53%	0.533	57%	0.569	S	S	.	*	H	α-helix	trans	-70.8	-31.2	175.5	-71.2	179.7	176.5	0	0	112.3	Q614 T616 S622	Q614-E618 HydrophobicContact CG-CG 4.06Å; Q614-E618 WeakPolarHBondContact CG-OE1 3.28Å; Q614-E618 PolarHBondContact NE2-OE1 2.83Å; Q614-E618 WeakPolarHBondContact O-CB 3.39Å; Q614-E618 WeakPolarHBondContact O-CG 3.02Å; Q614-E618 PolarHBondContact O-N 2.97Å; T616-E618 VanDerWaalsContact C-N 3.34Å; T616-E618 PolarHBondContact O-N 3.22Å; E618-S622 WeakPolarHBondContact O-CB 3.35Å; E618-S622 PolarHBondContact O-N 3.11Å
619	R	51.3	Low	53.4	Low	149 Å²	149	103.2 Å²	103.2	56%	0.562	59%	0.585	S	S	*	*	H	α-helix	trans	-66.8	-46.4	171.1	-74.7	169.7	-177.2	-122.9	-0.9	111.6	E615 T616 S622 C623	E615-R619 WeakPolarHBondContact O-CD 3.4Å; E615-R619 WeakPolarHBondContact O-CG 3.43Å; T616-R619 WeakPolarHBondContact O-CB 3.33Å; T616-R619 PolarHBondContact O-N 3.48Å; T616-R619 VanDerWaalsContact O-N 3.16Å; R619-S622 PolarHBondContact O-N 3.02Å; R619-S622 PolarHBondContact O-OG 3.33Å; R619-C623 PolarHBondContact O-N 3.26Å; R619-C623 PolarHBondContact O-SG 2.97Å
620	E	52.4	Low	51.2	Low	146 Å²	146	107.7 Å²	107.7	68%	0.682	61%	0.61	S	S	*	*	H	α-helix	trans	-63.5	-44	177.9	-68	-173	143.5	0	0	111.4	T616 G617 S622 C623	T616-E620 PolarHBondContact O-N 2.87Å; T616-E620 VanDerWaalsContact O-N 3.11Å; G617-E620 PolarHBondContact O-N 3.49Å; E620-S622 VanDerWaalsContact C-N 3.31Å; E620-S622 PolarHBondContact O-N 3.12Å; E620-C623 PolarHBondContact O-N 3.34Å; E620-C623 VanDerWaalsContact O-N 3.1Å
621	A	50.1	Low	49.2	Very low	75 Å²	75	109.1 Å²	109.1	62%	0.62	64%	0.638	S	S	*	*	H	α-helix	trans	-58.5	-40	174.4	0	0	0	0	0	112.5	G617 C623 G624	G617-A621 WeakPolarHBondContact O-CB 3.39Å; G617-A621 PolarHBondContact O-N 3.12Å; A621-C623 PolarHBondContact O-N 2.82Å; A621-C623 VanDerWaalsContact O-N 3.16Å; A621-G624 PolarHBondContact O-N 2.93Å
622	S	42.1	Very low	47.3	Very low	91 Å²	91	109.4 Å²	109.4	64%	0.636	65%	0.652	S	S	*	*	H	α-helix	trans	-65.1	-15.3	177.9	78.3	0	0	0	0	114.8	E618 R619 E620	E618-S622 WeakPolarHBondContact O-CB 3.35Å; E618-S622 PolarHBondContact O-N 3.11Å; R619-S622 PolarHBondContact O-N 3.02Å; R619-S622 PolarHBondContact O-OG 3.33Å; E620-S622 VanDerWaalsContact C-N 3.31Å; E620-S622 PolarHBondContact O-N 3.12Å
623	C	46.2	Very low	45.4	Very low	107 Å²	107	113.9 Å²	113.9	72%	0.723	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-4.1	-179.4	-66.7	0	0	0	0	114.3	R619 E620 A621	R619-C623 PolarHBondContact O-N 3.26Å; R619-C623 PolarHBondContact O-SG 2.97Å; E620-C623 PolarHBondContact O-N 3.34Å; E620-C623 VanDerWaalsContact O-N 3.1Å; A621-C623 PolarHBondContact O-N 2.82Å; A621-C623 VanDerWaalsContact O-N 3.16Å
624	G	46.3	Very low	44.1	Very low	55 Å²	55	111.7 Å²	111.7	57%	0.567	67%	0.669	S	S	*	*	S	Bend	trans	-73.8	-35.1	-178.4	0	0	0	0	0	115.2	A621 K626	A621-G624 PolarHBondContact O-N 2.93Å; G624-K626 VanDerWaalsContact C-N 3.29Å; G624-K626 PolarHBondContact O-N 2.99Å
625	D	43.4	Very low	42.7	Very low	161 Å²	161	115.8 Å²	115.8	86%	0.861	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	32.2	-161	-87.8	-12.7	0	0	0	116.1
626	K	45.4	Very low	41.2	Very low	206 Å²	206	116.5 Å²	116.5	90%	0.896	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.9	35.9	175.3	-77.1	-161.5	176.5	178.5	0	117	G624	G624-K626 VanDerWaalsContact C-N 3.29Å; G624-K626 PolarHBondContact O-N 2.99Å
627	A	37.6	Very low	39.8	Very low	88 Å²	88	118.5 Å²	118.5	73%	0.727	72%	0.719	S	S	*	*			trans	-154.2	80.5	165.2	0	0	0	0	0	115.9
628	T	32.4	Very low	38.5	Very low	144 Å²	144	126.6 Å²	126.6	88%	0.883	74%	0.738	S	S	*	*			trans	-152.8	99.5	155	-63.2	0	0	0	0	112.1
629	M	32.8	Very low	37.3	Very low	183 Å²	183	125.7 Å²	125.7	90%	0.901	75%	0.75	S	S	*	*	S	Bend	trans	-160.1	134.2	145.9	-92.1	-123.8	75	0	0	109.3
630	S	30.2	Very low	36.3	Very low	129 Å²	129	126.1 Å²	126.1	90%	0.902	76%	0.756	S	S	*	*	S	Bend	trans	71.5	145.6	176.7	-156.5	0	0	0	0	117.6
631	G	28.5	Very low	35.6	Very low	73 Å²	73	125.9 Å²	125.9	75%	0.753	76%	0.759	S	S	*	*			trans	108.6	80	162.9	0	0	0	0	0	117.1
632	S	29.6	Very low	34.8	Very low	106 Å²	106	129 Å²	129	74%	0.741	77%	0.766	S	S	*	*			trans	-76.2	142.2	165.2	-48.4	0	0	0	0	111.6
633	N	31.1	Very low	34.6	Very low	148 Å²	148	133.2 Å²	133.2	79%	0.791	78%	0.775	S	S	*	*				161.4	131.7	117.9	-79.9	-24.6	0	0	0	116
634	S	34	Very low	34.4	Very low	96 Å²	96	135.4 Å²	135.4	67%	0.671	78%	0.78	S	S	*	*			trans	58.3	127.9	134.1	71.8	0	0	0	0	124.5
635	I	30.6	Very low	34.1	Very low	153 Å²	153	140.8 Å²	140.8	79%	0.785	80%	0.795	S	S	*	*			trans	74.8	97.4	131.8	-60.8	167.7	0	0	0	119.6
636	S	30	Very low	34.1	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	79%	0.792	S	S	*	*				59.1	155.4	107.2	-147.1	0	0	0	0	124.1
637	V	30.5	Very low	34.4	Very low	120 Å²	120	134.7 Å²	134.7	73%	0.727	78%	0.775	S	S	*	*			trans	83	90.5	159.2	-165.5	0	0	0	0	120.6
638	R	28.3	Very low	34.9	Very low	206 Å²	206	137.3 Å²	137.3	78%	0.777	78%	0.776	S	S	*	*				44.3	110	114.7	-172.1	-162.2	-161.5	172.2	4.8	121.5	F640	R638-F640 HydrophobicContact CG-CD2 4.2Å
639	A	31.2	Very low	36.1	Very low	95 Å²	95	137.2 Å²	137.2	79%	0.785	77%	0.766	S	S	*	*			trans	-155.5	139.4	133	0	0	0	0	0	107.7
640	F	30.3	Very low	37.2	Very low	157 Å²	157	133.2 Å²	133.2	69%	0.689	75%	0.745	S	S	*	*			cis	84.5	116.4	37	-92.9	-63.3	0	0	0	116	R638	R638-F640 HydrophobicContact CG-CD2 4.2Å
641	L	37.1	Very low	38.7	Very low	142 Å²	142	131.9 Å²	131.9	74%	0.743	73%	0.727	S	S	*	*			trans	70.4	152.6	160.3	-55.9	-171.6	0	0	0	116.8
642	D	33.1	Very low	39.7	Very low	141 Å²	141	135.1 Å²	135.1	75%	0.754	72%	0.72	S	S	*	*			cis	-141.1	-178.5	2.2	-114.3	-30.8	0	0	0	111.6
643	E	38.4	Very low	41	Very low	178 Å²	178	135.4 Å²	135.4	83%	0.832	71%	0.713	S	S	*	*			trans	-86	164.9	-172.9	-57.2	-166	142.6	0	0	116.3
644	D	41.8	Very low	42.1	Very low	154 Å²	154	136.8 Å²	136.8	82%	0.824	71%	0.707	S	S	*	*			trans	17.4	118.3	156.9	-67.3	-4.9	0	0	0	121.5
645	D	40.6	Very low	42.9	Very low	167 Å²	167	139.5 Å²	139.5	89%	0.893	71%	0.709	S	S	*	*				-162.6	110	121.3	-130.4	-19.7	0	0	0	112	S647	D645-S647 PolarHBondContact O-N 2.8Å
646	M	43.2	Very low	43.9	Very low	162 Å²	162	137.2 Å²	137.2	80%	0.798	70%	0.699	S	S	*	*			trans	-92.7	97.4	-178.7	-169.6	179.5	-64.3	0	0	111.6
647	S	50.9	Low	44.8	Very low	78 Å²	78	135.9 Å²	135.9	55%	0.545	69%	0.694	S	S	.	*			trans	-64.2	146.5	-172.5	78.2	0	0	0	0	115.1	D645 E649 E650	D645-S647 PolarHBondContact O-N 2.8Å; S647-E649 PolarHBondContact O-N 2.94Å; S647-E650 PolarHBondContact O-N 3.43Å
648	L	49.4	Very low	45.4	Very low	142 Å²	142	134.6 Å²	134.6	74%	0.743	70%	0.696	S	S	*	*	H	α-helix	trans	-65.4	-7.6	-175.8	-108.8	161.4	0	0	0	115.4
649	E	56.6	Low	46.1	Very low	142 Å²	142	135.4 Å²	135.4	66%	0.664	70%	0.699	S	S	*	*	H	α-helix	trans	-78.3	-31.1	179.1	-65.2	-154.6	112.9	0	0	113.4	S647 I651 K652 N653	S647-E649 PolarHBondContact O-N 2.94Å; E649-I651 PolarHBondContact O-N 2.97Å; E649-K652 PolarHBondContact O-N 3.19Å; E649-N653 PolarHBondContact O-N 2.7Å
650	E	56	Low	46.5	Very low	99 Å²	99	137.1 Å²	137.1	46%	0.463	70%	0.695	S	S	.	*	H	α-helix	trans	-69.5	-36.1	-178.3	-170.1	169.1	176	0	0	112.1	S647 K652 N653 R654	S647-E650 PolarHBondContact O-N 3.43Å; E650-K652 VanDerWaalsContact C-N 3.29Å; E650-K652 PolarHBondContact O-N 3.28Å; E650-N653 PolarHBondContact O-N 2.61Å; E650-R654 WeakPolarHBondContact O-CG 3.38Å; E650-R654 PolarHBondContact O-N 2.91Å; E650-R654 IonicContact OE1-CZ 3.41Å; E650-R654 IonicContact OE1-NE 3.78Å; E650-R654 PolarHBondContact OE1-NE 2.62Å; E650-R654 IonicContact OE1-NH2 2.73Å; E650-R654 PolarHBondContact OE1-NH2 3.35Å
651	I	60.7	Low	46.6	Very low	101 Å²	101	137.9 Å²	137.9	52%	0.518	71%	0.706	S	S	.	*	H	α-helix	trans	-61	-40.8	173.5	-61	174	0	0	0	110.5	E649 R654	E649-I651 PolarHBondContact O-N 2.97Å; I651-R654 PolarHBondContact O-N 3.24Å
652	K	51.6	Low	46.7	Very low	141 Å²	141	136.5 Å²	136.5	61%	0.613	71%	0.709	S	S	*	*	H	α-helix	trans	-70.4	-37.2	-178.3	-166.4	176.2	-179.2	-177.3	0	112.5	E649 E650 Q655 N656	E649-K652 PolarHBondContact O-N 3.19Å; E650-K652 VanDerWaalsContact C-N 3.29Å; E650-K652 PolarHBondContact O-N 3.28Å; K652-Q655 PolarHBondContact O-N 2.82Å; K652-N656 PolarHBondContact O-ND2 3.12Å
653	N	56.4	Low	47.1	Very low	112 Å²	112	135.7 Å²	135.7	60%	0.599	71%	0.711	S	S	*	*	H	α-helix	trans	-68	-33.9	176.7	-79.5	-31	0	0	0	112.9	E649 E650 Q655 N656	E649-N653 PolarHBondContact O-N 2.7Å; E650-N653 PolarHBondContact O-N 2.61Å; N653-Q655 PolarHBondContact O-N 3.49Å; N653-N656 PolarHBondContact O-N 3.16Å
654	R	54.6	Low	47.3	Very low	178 Å²	178	132.8 Å²	132.8	67%	0.672	71%	0.708	S	S	*	*	H	α-helix	trans	-68.5	-29.8	178.2	-68	177.6	-174	-169.3	2.7	113.5	E650 I651	E650-R654 WeakPolarHBondContact O-CG 3.38Å; E650-R654 PolarHBondContact O-N 2.91Å; E650-R654 IonicContact OE1-CZ 3.41Å; E650-R654 IonicContact OE1-NE 3.78Å; E650-R654 PolarHBondContact OE1-NE 2.62Å; E650-R654 IonicContact OE1-NH2 2.73Å; E650-R654 PolarHBondContact OE1-NH2 3.35Å; I651-R654 PolarHBondContact O-N 3.24Å
655	Q	50.1	Low	46.7	Very low	152 Å²	152	131.6 Å²	131.6	71%	0.71	71%	0.706	S	S	*	*	H	α-helix	trans	-73	-31	175	-77.2	-169.5	-15.2	0	0	113.8	K652 N653	K652-Q655 PolarHBondContact O-N 2.82Å; N653-Q655 PolarHBondContact O-N 3.49Å
656	N	51.8	Low	46.1	Very low	106 Å²	106	130.6 Å²	130.6	57%	0.567	71%	0.706	S	S	*	*	H	α-helix	trans	-75.3	-24.1	-179.1	-72.8	-34.6	0	0	0	113.4	K652 N653 A658	K652-N656 PolarHBondContact O-ND2 3.12Å; N653-N656 PolarHBondContact O-N 3.16Å; N656-A658 VanDerWaalsContact C-N 3.28Å; N656-A658 PolarHBondContact O-N 2.84Å
657	A	47.9	Very low	45.3	Very low	80 Å²	80	126.2 Å²	126.2	66%	0.661	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-67.6	-25	176.9	0	0	0	0	0	113.6	R659	A657-R659 VanDerWaalsContact C-N 3.31Å; A657-R659 PolarHBondContact O-N 2.99Å
658	A	44.4	Very low	44.1	Very low	93 Å²	93	126.8 Å²	126.8	77%	0.769	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-84.4	7.5	-172.8	0	0	0	0	0	115	N656	N656-A658 VanDerWaalsContact C-N 3.28Å; N656-A658 PolarHBondContact O-N 2.84Å
659	R	42.4	Very low	43	Very low	224 Å²	224	130.6 Å²	130.6	85%	0.845	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-124.4	-3.7	-169.3	-136.6	174.7	-174.5	173.7	1.5	116.4	A657	A657-R659 VanDerWaalsContact C-N 3.31Å; A657-R659 PolarHBondContact O-N 2.99Å
660	N	38.5	Very low	41.4	Very low	131 Å²	131	127.7 Å²	127.7	70%	0.701	73%	0.73	S	S	*	*			trans	-120.7	100.4	-179.4	-70.5	-27.4	0	0	0	111
661	N	33.3	Very low	40	Very low	172 Å²	172	134.4 Å²	134.4	92%	0.92	75%	0.753	S	S	*	*			trans	172.7	90.9	140.2	-89.4	-20.6	0	0	0	110.9
662	S	38.2	Very low	38.4	Very low	114 Å²	114	134.2 Å²	134.2	80%	0.797	77%	0.767	S	S	*	*			trans	-131.3	136	160.3	52.7	0	0	0	0	109.4
663	P	42.5	Very low	37	Very low	124 Å²	124	138.2 Å²	138.2	81%	0.805	78%	0.778	S	S	*	*			trans	-82.6	155.8	179.8	32.9	-34.7	0	0	0	112.5
664	P	41.6	Very low	35.5	Very low	117 Å²	117	137.9 Å²	137.9	76%	0.76	78%	0.784	S	S	*	*			trans	-94.4	135.7	-169.2	35.1	-35.4	0	0	0	116.6
665	T	29	Very low	34	Very low	129 Å²	129	134.1 Å²	134.1	79%	0.791	79%	0.785	S	S	*	*			trans	26.9	128.7	130.5	-29.2	0	0	0	0	122
666	V	29.4	Very low	32.9	Very low	146 Å²	146	134.6 Å²	134.6	89%	0.885	79%	0.79	S	S	*	*				160.9	138.1	116.5	161	0	0	0	0	111.4
667	G	25.9	Very low	31.8	Very low	70 Å²	70	139.1 Å²	139.1	72%	0.722	81%	0.805	S	S	*	*			trans	125.2	76.4	169.7	0	0	0	0	0	114.5
668	A	26.2	Very low	31.4	Very low	90 Å²	90	140.6 Å²	140.6	74%	0.744	81%	0.808	S	S	*	*				92.8	103.6	67.9	0	0	0	0	0	114.7
669	F	25	Very low	30.6	Very low	222 Å²	222	143.1 Å²	143.1	97%	0.974	81%	0.808	S	S	*	*			trans	52.3	127	156.3	-65.3	-85.6	0	0	0	122.1
670	G	24.9	Very low	29.8	Very low	80 Å²	80	139.7 Å²	139.7	83%	0.825	80%	0.802	S	S	*	*			trans	-178.2	129.5	161.7	0	0	0	0	0	113.9
671	Y	24.8	Very low	29.3	Very low	240 Å²	240	140.7 Å²	140.7	94%	0.941	80%	0.802	S	S	*	*			trans	-104.4	129.4	179.6	-103.5	-104.5	0	0	0	111.9
672	A	27.6	Very low	29	Very low	98 Å²	98	140.3 Å²	140.3	81%	0.81	80%	0.795	S	S	*	*			trans	175.9	128.5	144	0	0	0	0	0	108
673	R	22.6	Very low	28.5	Very low	225 Å²	225	139.6 Å²	139.6	85%	0.849	80%	0.795	S	S	*	*			cis	94.5	114	22.3	-155.5	-160.2	-166.3	-176.2	6.5	114.4
674	C	24.1	Very low	27.8	Very low	105 Å²	105	140.7 Å²	140.7	71%	0.709	79%	0.794	S	S	*	*			trans	72.2	157	162.4	-73.4	0	0	0	0	119.1
675	S	24.3	Very low	27.1	Very low	99 Å²	99	142.1 Å²	142.1	69%	0.692	80%	0.795	S	S	*	*			cis	-178.9	178.5	-28.2	-92.9	0	0	0	0	109.6
676	I	25.7	Very low	27.1	Very low	161 Å²	161	142.9 Å²	142.9	83%	0.826	79%	0.793	S	S	*	*			trans	92.8	114.4	154.3	-49.9	-168	0	0	0	118.2
677	F	30.3	Very low	26.9	Very low	201 Å²	201	144.5 Å²	144.5	88%	0.882	79%	0.791	S	S	*	*			trans	-86.1	154.1	154.1	-71.4	-90.6	0	0	0	109.4
678	P	38.5	Very low	26.9	Very low	112 Å²	112	145.8 Å²	145.8	73%	0.727	80%	0.795	S	S	*	*				-153.1	159.9	82.8	45.7	-25.9	0	0	0	113.8
679	L	27.7	Very low	26.9	Very low	145 Å²	145	146.5 Å²	146.5	76%	0.759	80%	0.8	S	S	*	*				105.8	161.9	70.7	-177.6	61.8	0	0	0	113.3
680	E	26.6	Very low	27.1	Very low	153 Å²	153	144.3 Å²	144.3	72%	0.715	79%	0.793	S	S	*	*			trans	69	148.2	170.3	-82	141.4	-133.7	0	0	118.2
681	Q	27.1	Very low	27.7	Very low	151 Å²	151	146.4 Å²	146.4	71%	0.706	79%	0.792	S	S	*	*			cis	-158.1	131.5	-21.9	-119.2	-175.7	-47.3	0	0	106.9
682	E	27.2	Very low	27.7	Very low	165 Å²	165	138.5 Å²	138.5	77%	0.771	78%	0.783	S	S	*	*				71	108.9	89.3	-167.7	170.5	-130.6	0	0	116.6
683	A	27.7	Very low	27.5	Very low	98 Å²	98	137.4 Å²	137.4	81%	0.81	78%	0.782	S	S	*	*			trans	175.8	102.6	152.3	0	0	0	0	0	115.4
684	D	26.9	Very low	28.3	Very low	147 Å²	147	131.8 Å²	131.8	79%	0.786	78%	0.775	S	S	*	*			trans	31.3	125.9	135.4	-72.8	-8	0	0	0	127.2
685	L	28.3	Very low	28.5	Very low	147 Å²	147	135.2 Å²	135.2	77%	0.77	78%	0.78	S	S	*	*				85.8	147.6	120.6	-70.6	173.7	0	0	0	125.9
686	I	28.4	Very low	28.6	Very low	146 Å²	146	135.2 Å²	135.2	75%	0.749	78%	0.78	S	S	*	*			trans	83.2	95.9	156.9	-65.1	149.4	0	0	0	120.9
687	E	26	Very low	28.7	Very low	180 Å²	180	132.9 Å²	132.9	84%	0.841	78%	0.778	S	S	*	*				40.1	114.4	115.1	-146.5	167.3	-159.9	0	0	123.7
688	A	25.7	Very low	28.5	Very low	97 Å²	97	133.2 Å²	133.2	80%	0.802	77%	0.773	S	S	*	*			trans	74.3	153.6	137.6	0	0	0	0	0	124.8
689	A	25.7	Very low	28.1	Very low	104 Å²	104	135.3 Å²	135.3	86%	0.86	78%	0.778	S	S	*	*			trans	100	115.7	161.1	0	0	0	0	0	120.7
690	E	28.2	Very low	28	Very low	176 Å²	176	131.6 Å²	131.6	82%	0.822	78%	0.775	S	S	*	*			trans	-60.6	172.6	155.4	-76	-85.3	158.3	0	0	112.2
691	P	38.3	Very low	27.8	Very low	124 Å²	124	132.4 Å²	132.4	81%	0.805	78%	0.784	S	S	*	*			cis	-143	176	17.7	42.5	-24	0	0	0	118.3
692	G	24.6	Very low	27.7	Very low	74 Å²	74	129.5 Å²	129.5	76%	0.763	78%	0.779	S	S	*	*			trans	122.9	132.1	142.9	0	0	0	0	0	118.8
693	G	23.7	Very low	27.4	Very low	76 Å²	76	130 Å²	130	78%	0.784	78%	0.781	S	S	*	*			trans	-99.7	-151.4	171.8	0	0	0	0	0	113.4
694	P	39.4	Very low	27.6	Very low	106 Å²	106	130.3 Å²	130.3	69%	0.688	78%	0.775	S	S	*	*			cis	-140.1	-154.5	9.3	41.6	-20.2	0	0	0	115
695	H	27.2	Very low	27.5	Very low	177 Å²	177	127.5 Å²	127.5	82%	0.819	76%	0.759	S	S	*	*			trans	83.6	152.7	172.1	-46.6	-69.6	0	0	0	118.2
696	S	27.2	Very low	27.2	Very low	99 Å²	99	124.8 Å²	124.8	69%	0.692	75%	0.752	S	S	*	*			cis	-171	134.8	-34.4	-173.9	0	0	0	0	111.7
697	S	27	Very low	27.2	Very low	112 Å²	112	126 Å²	126	78%	0.783	76%	0.755	S	S	*	*			trans	67	161.3	167	84.4	0	0	0	0	116.7
698	R	27.3	Very low	27	Very low	209 Å²	209	122.6 Å²	122.6	79%	0.789	75%	0.75	S	S	*	*			cis	-157.9	133.8	10.8	-171.4	172.4	173.6	-179.1	-3.1	111.5
699	N	29.3	Very low	26.9	Very low	155 Å²	155	129.3 Å²	129.3	83%	0.829	76%	0.755	S	S	*	*			trans	41.9	137.8	158.1	-51.8	11.4	0	0	0	120.6
700	G	25.7	Very low	26.8	Very low	68 Å²	68	130.6 Å²	130.6	70%	0.701	75%	0.753	S	S	*	*			cis	154.6	149.4	-6.1	0	0	0	0	0	113
701	L	23.8	Very low	26.7	Very low	169 Å²	169	130.5 Å²	130.5	89%	0.885	76%	0.757	S	S	*	*			trans	45.6	141.6	149.7	-45.3	177.1	0	0	0	120.9
702	C	23.4	Very low	26.3	Very low	91 Å²	91	131.2 Å²	131.2	62%	0.615	76%	0.759	S	S	*	*			cis	-172.7	138.2	-6	-107.4	0	0	0	0	112.2
703	H	21.7	Very low	26.4	Very low	176 Å²	176	131.2 Å²	131.2	82%	0.815	76%	0.758	S	S	*	*			trans	50.8	-176.6	145.2	-68.7	-63.3	0	0	0	120.9
704	P	32.8	Very low	26.6	Very low	103 Å²	103	137.4 Å²	137.4	67%	0.669	76%	0.764	S	S	*	*			cis	-129.6	169.3	-11	17.3	8.4	0	0	0	117.4
705	L	23.6	Very low	26	Very low	88 Å²	88	143.9 Å²	143.9	46%	0.461	77%	0.774	S	S	.	*			trans	53.2	114.9	146.2	-64.6	167.2	0	0	0	120.1
706	S	23.3	Very low	25.9	Very low	90 Å²	90	141.4 Å²	141.4	63%	0.629	77%	0.774	S	S	*	*				84.3	142.8	72.7	-67.6	0	0	0	0	113.9
707	H	26.9	Very low	25.9	Very low	173 Å²	173	146.8 Å²	146.8	80%	0.801	79%	0.785	S	S	*	*			cis	-135.2	-160.5	10.6	-42.2	-114.5	0	0	0	109
708	S	23.1	Very low	25.8	Very low	107 Å²	107	145.6 Å²	145.6	75%	0.748	78%	0.782	S	S	*	*			cis	-168.2	134	-3.9	40.5	0	0	0	0	110.2
709	R	23.8	Very low	25.7	Very low	239 Å²	239	141.6 Å²	141.6	90%	0.902	78%	0.783	S	S	*	*			trans	-170.4	125.5	134.9	-116.6	180	178.8	164.9	1.2	114.1
710	T	23.1	Very low	25.7	Very low	131 Å²	131	146.5 Å²	146.5	80%	0.804	79%	0.79	S	S	*	*			trans	18	115.9	148.2	53.6	0	0	0	0	119.4
711	L	26.2	Very low	25.7	Very low	174 Å²	174	146 Å²	146	91%	0.911	78%	0.784	S	S	*	*			trans	-132.7	141.2	155.5	-162.6	75.7	0	0	0	109.5
712	V	30	Very low	25.9	Very low	139 Å²	139	147.9 Å²	147.9	84%	0.842	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-75.4	123.5	176.9	175.7	0	0	0	0	109.6
713	G	26.3	Very low	26.1	Very low	73 Å²	73	149.5 Å²	149.5	75%	0.753	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-77.7	134.3	-179	0	0	0	0	0	113
714	K	27	Very low	26.4	Very low	207 Å²	207	143.6 Å²	143.6	90%	0.9	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-79.6	139.4	169.7	-68.6	-178.1	177.3	-179.5	0	110.3
715	R	26.9	Very low	26.5	Very low	241 Å²	241	144.7 Å²	144.7	91%	0.909	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-71.7	136	174	-148.8	177.3	-161.2	174.6	4.6	110.4
716	P	26.2	Very low	27.2	Very low	125 Å²	125	143.5 Å²	143.5	81%	0.812	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-63.3	155.6	168.9	-22	34.3	0	0	0	112
717	K	26.4	Very low	27.8	Very low	213 Å²	213	140.6 Å²	140.6	93%	0.926	74%	0.737	S	S	*	*			trans	-104	116.2	-175.2	-159.1	173.7	-169.4	174.4	0	110.3
718	A	25.5	Very low	28.2	Very low	87 Å²	87	135 Å²	135	72%	0.719	72%	0.716	S	S	*	*			trans	-72.5	148.8	-176.7	0	0	0	0	0	113
719	P	24.8	Very low	29	Very low	124 Å²	124	131.4 Å²	131.4	81%	0.805	69%	0.69	S	S	*	*			trans	-72.5	156.9	167.9	32.5	-34.7	0	0	0	111.3	G721	P719-G721 PolarHBondContact O-N 3.01Å
720	R	29.9	Very low	29.7	Very low	259 Å²	259	123.6 Å²	123.6	98%	0.977	67%	0.672	S	S	*	*			trans	-93.7	91.7	-168.4	-163	-179	-158.2	-126.8	5.5	112.2
721	G	24.6	Very low	30.8	Very low	57 Å²	57	121.6 Å²	121.6	59%	0.588	66%	0.656	S	S	*	*			trans	-97.7	158.5	170	0	0	0	0	0	113.1	P719 E723	P719-G721 PolarHBondContact O-N 3.01Å; G721-E723 VanDerWaalsContact C-N 3.32Å; G721-E723 PolarHBondContact O-N 2.82Å
722	E	28.2	Very low	32	Very low	209 Å²	209	114.1 Å²	114.1	98%	0.977	62%	0.617	S	S	*	*			trans	-86.5	63.3	176.4	-66.8	-169.6	131	0	0	112.1
723	E	27.1	Very low	33	Very low	125 Å²	125	109 Å²	109	58%	0.584	59%	0.586	S	S	*	*			trans	-96.5	135.1	174.5	-68.5	-170.3	162.7	0	0	112	G721 H725	G721-E723 VanDerWaalsContact C-N 3.32Å; G721-E723 PolarHBondContact O-N 2.82Å; E723-H725 VanDerWaalsContact C-N 3.31Å; E723-H725 PolarHBondContact O-N 2.76Å
724	A	29.8	Very low	34.3	Very low	51 Å²	51	109.1 Å²	109.1	42%	0.421	57%	0.572	S	S	.	*			trans	-79.6	76.5	-177.8	0	0	0	0	0	111	L726	A724-L726 PolarHBondContact O-N 3.14Å; A724-L726 VanDerWaalsContact O-N 3.11Å
725	H	33	Very low	35.6	Very low	126 Å²	126	101.4 Å²	101.4	58%	0.583	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-46.7	118	-179.7	-65.8	-67.8	0	0	0	112.4	R368 E723	R368-H725 PolarHBondContact NH2-O 3.11Å; E723-H725 VanDerWaalsContact C-N 3.31Å; E723-H725 PolarHBondContact O-N 2.76Å
726	L	38.3	Very low	36.8	Very low	63 Å²	63	91 Å²	91	33%	0.33	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-66.6	162	175.8	-60.2	-178.5	0	0	0	110.9	P526 P576 V578 A724	P526-L726 HydrophobicContact CG-CD2 4.37Å; P576-L726 HydrophobicContact CB-CD1 4.47Å; P576-L726 HydrophobicContact CB-CD2 4.12Å; P576-L726 HydrophobicContact CG-CD2 4.35Å; V578-L726 HydrophobicContact CG2-CD1 4.24Å; A724-L726 PolarHBondContact O-N 3.14Å; A724-L726 VanDerWaalsContact O-N 3.11Å
727	P	36.1	Very low	37.7	Very low	30 Å²	30	89.2 Å²	89.2	20%	0.195	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-62	157.6	161.1	29.5	-35.7	0	0	0	110.2	V729 L732	P727-V729 PolarHBondContact O-N 3.34Å; P727-L732 HydrophobicContact CG-CD1 4.35Å
728	P	36.3	Very low	38.7	Very low	54 Å²	54	83.7 Å²	83.7	35%	0.351	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-57.2	124.4	174.8	-19.5	31.6	0	0	0	110.4	S730 D731	P728-S730 PolarHBondContact O-N 3.08Å; P728-S730 VanDerWaalsContact O-N 3.09Å; P728-D731 WeakPolarHBondContact CB-OD2 3.47Å; P728-D731 PolarHBondContact O-N 3Å
729	V	40.7	Very low	39.3	Very low	33 Å²	33	83 Å²	83	20%	0.2	44%	0.444	C	S	.	.	H	α-helix	trans	-63.3	-21.1	-177.9	-174.5	0	0	0	0	111.5	F523 F587 P727 D731 L732 T733	F523-V729 HydrophobicContact CE1-CG1 3.89Å; F523-V729 HydrophobicContact CZ-CG1 3.76Å; F523-V729 HydrophobicContact CZ-CG2 4.43Å; F587-V729 HydrophobicContact CB-CG1 3.64Å; F587-V729 HydrophobicContact CG-CG1 4.25Å; P727-V729 PolarHBondContact O-N 3.34Å; V729-D731 VanDerWaalsContact C-N 3.32Å; V729-D731 PolarHBondContact O-N 3.01Å; V729-L732 PolarHBondContact O-N 3.37Å; V729-T733 HydrophobicContact CG1-CG2 4.35Å; V729-T733 PolarHBondContact O-N 3.2Å; V729-T733 PolarHBondContact O-OG1 3.18Å
730	S	37.3	Very low	39.7	Very low	74 Å²	74	80.3 Å²	80.3	52%	0.517	42%	0.423	S	S	.	.	H	α-helix	trans	-45.2	-50.6	170.1	-48.3	0	0	0	0	113.3	P728 T733 V734	P728-S730 PolarHBondContact O-N 3.08Å; P728-S730 VanDerWaalsContact O-N 3.09Å; S730-T733 VanDerWaalsContact C-OG1 3.32Å; S730-T733 WeakPolarHBondContact CA-OG1 3.35Å; S730-T733 PolarHBondContact O-N 3.27Å; S730-T733 PolarHBondContact O-OG1 3.33Å; S730-V734 WeakPolarHBondContact O-CG2 3.47Å; S730-V734 PolarHBondContact O-N 2.96Å
731	D	45.4	Very low	39.7	Very low	89 Å²	89	74.1 Å²	74.1	48%	0.476	41%	0.408	S	S	.	.	H	α-helix	trans	-74.7	-36.9	-171	-49.1	-48.8	0	0	0	110.5	P728 V729 V734 E735	P728-D731 WeakPolarHBondContact CB-OD2 3.47Å; P728-D731 PolarHBondContact O-N 3Å; V729-D731 VanDerWaalsContact C-N 3.32Å; V729-D731 PolarHBondContact O-N 3.01Å; D731-V734 PolarHBondContact O-N 3.21Å; D731-E735 PolarHBondContact O-N 3.09Å
732	L	52.5	Low	39.9	Very low	17 Å²	17	77.8 Å²	77.8	9%	0.089	41%	0.41	C	S	.	.	H	α-helix	trans	-61.4	-44	170.1	-66	173.5	0	0	0	111.4	Y477 W495 F523 P727 V729 V734 E735 F736	Y477-L732 HydrophobicContact CE1-CD1 3.78Å; Y477-L732 HydrophobicContact CE2-CD2 4.37Å; W495-L732 HydrophobicContact CH2-CD2 3.78Å; W495-L732 HydrophobicContact CZ3-CD2 3.62Å; F523-L732 HydrophobicContact CE2-CD1 4.49Å; F523-L732 HydrophobicContact CZ-CD1 4.31Å; P727-L732 HydrophobicContact CG-CD1 4.35Å; V729-L732 PolarHBondContact O-N 3.37Å; L732-V734 VanDerWaalsContact C-N 3.34Å; L732-V734 PolarHBondContact O-N 3.29Å; L732-E735 PolarHBondContact O-N 3.12Å; L732-F736 WeakPolarHBondContact O-CD2 3.43Å; L732-F736 PolarHBondContact O-N 3.08Å
733	T	51	Low	40.1	Very low	33 Å²	33	74.4 Å²	74.4	20%	0.202	40%	0.399	C	S	.	.	H	α-helix	trans	-62.9	-40.2	176.4	45.3	0	0	0	0	112.4	F587 V729 S730 E735 F736 D737	F587-T733 HydrophobicContact CD2-CG2 3.48Å; F587-T733 VanDerWaalsContact CD2-CG2 3.48Å; F587-T733 HydrophobicContact CE2-CG2 3.52Å; F587-T733 HydrophobicContact CG-CG2 4.45Å; V729-T733 HydrophobicContact CG1-CG2 4.35Å; V729-T733 PolarHBondContact O-N 3.2Å; V729-T733 PolarHBondContact O-OG1 3.18Å; S730-T733 VanDerWaalsContact C-OG1 3.32Å; S730-T733 WeakPolarHBondContact CA-OG1 3.35Å; S730-T733 PolarHBondContact O-N 3.27Å; S730-T733 PolarHBondContact O-OG1 3.33Å; T733-E735 PolarHBondContact O-N 2.76Å; T733-F736 PolarHBondContact O-N 3.42Å; T733-D737 PolarHBondContact O-N 3.29Å
734	V	53.9	Low	40.2	Very low	74 Å²	74	74.4 Å²	74.4	45%	0.448	41%	0.407	S	S	.	.	H	α-helix	trans	-64.9	-36.7	176.5	168.7	0	0	0	0	111.9	S730 D731 L732 K738	S730-V734 WeakPolarHBondContact O-CG2 3.47Å; S730-V734 PolarHBondContact O-N 2.96Å; D731-V734 PolarHBondContact O-N 3.21Å; L732-V734 VanDerWaalsContact C-N 3.34Å; L732-V734 PolarHBondContact O-N 3.29Å; V734-K738 HydrophobicContact CG1-CD 4.25Å; V734-K738 VanDerWaalsContact CG1-CE 3.49Å; V734-K738 WeakPolarHBondContact O-CB 3.46Å; V734-K738 WeakPolarHBondContact O-CD 3.38Å; V734-K738 WeakPolarHBondContact O-CG 3.39Å; V734-K738 PolarHBondContact O-N 3Å
735	E	53	Low	40.1	Very low	45 Å²	45	75.4 Å²	75.4	21%	0.21	42%	0.423	C	S	.	.	H	α-helix	trans	-69.5	-39.2	172.7	-70.8	-59.3	119.1	0	0	113.1	W495 D731 L732 T733 K738 L739	W495-E735 HydrophobicContact CH2-CB 4.44Å; W495-E735 HydrophobicContact CZ2-CB 4.11Å; D731-E735 PolarHBondContact O-N 3.09Å; L732-E735 PolarHBondContact O-N 3.12Å; T733-E735 PolarHBondContact O-N 2.76Å; E735-K738 PolarHBondContact O-N 3.04Å; E735-K738 VanDerWaalsContact OE1-CD 3.24Å; E735-K738 WeakPolarHBondContact OE1-CD 3.36Å; E735-K738 WeakPolarHBondContact OE1-CE 3.45Å; E735-K738 IonicContact OE1-NZ 3.36Å; E735-K738 PolarHBondContact OE1-NZ 3.34Å; E735-L739 PolarHBondContact O-N 3.26Å
736	F	52.7	Low	39.8	Very low	23 Å²	23	74.6 Å²	74.6	10%	0.101	43%	0.431	C	S	.	.	H	α-helix	trans	-64.5	-39.5	173.2	-82	-67.6	0	0	0	112.3	W495 L520 L732 T733 L739 N740	W495-F736 HydrophobicContact CB-CE1 4.43Å; W495-F736 HydrophobicContact CB-CZ 4.27Å; W495-F736 HydrophobicContact CD2-CE1 4.14Å; W495-F736 HydrophobicContact CD2-CE2 4.38Å; W495-F736 AromaticContact CD2-CZ 3.74Å; W495-F736 HydrophobicContact CD2-CZ 3.74Å; W495-F736 HydrophobicContact CE3-CE2 4.3Å; W495-F736 AromaticContact CE3-CZ 3.97Å; W495-F736 HydrophobicContact CE3-CZ 3.97Å; W495-F736 AromaticContact CG-CE1 3.95Å; W495-F736 HydrophobicContact CG-CE1 3.95Å; W495-F736 AromaticContact CG-CZ 3.88Å; W495-F736 HydrophobicContact CG-CZ 3.88Å; L520-F736 HydrophobicContact CD2-CB 4.37Å; L520-F736 HydrophobicContact CD2-CD1 4.47Å; L520-F736 HydrophobicContact CD2-CD2 3.62Å; L520-F736 HydrophobicContact CD2-CE2 3.98Å; L520-F736 HydrophobicContact CD2-CG 3.91Å; L732-F736 WeakPolarHBondContact O-CD2 3.43Å; L732-F736 PolarHBondContact O-N 3.08Å; T733-F736 PolarHBondContact O-N 3.42Å; F736-L739 WeakPolarHBondContact O-CB 3.48Å; F736-L739 PolarHBondContact O-N 2.9Å; F736-N740 PolarHBondContact O-N 2.91Å
737	D	46	Very low	39	Very low	88 Å²	88	77.3 Å²	77.3	47%	0.471	46%	0.455	S	S	.	.	H	α-helix	trans	-73.4	-31.9	177.6	-74.5	-29.5	0	0	0	113.1	T733 L739 N740 L741	T733-D737 PolarHBondContact O-N 3.29Å; D737-L739 PolarHBondContact O-N 3.24Å; D737-N740 WeakPolarHBondContact O-CB 3.43Å; D737-N740 PolarHBondContact O-N 3.49Å; D737-N740 VanDerWaalsContact O-N 3.16Å; D737-N740 PolarHBondContact OD1-ND2 2.99Å; D737-L741 WeakPolarHBondContact O-CG 3.41Å; D737-L741 PolarHBondContact O-N 2.92Å
738	K	45.9	Very low	38.5	Very low	97 Å²	97	82.6 Å²	82.6	42%	0.422	49%	0.487	S	S	.	.	H	α-helix	trans	-59	-34.5	168.2	-78.5	165.7	-172.7	168.4	0	112.2	V734 E735 Q742	V734-K738 HydrophobicContact CG1-CD 4.25Å; V734-K738 VanDerWaalsContact CG1-CE 3.49Å; V734-K738 WeakPolarHBondContact O-CB 3.46Å; V734-K738 WeakPolarHBondContact O-CD 3.38Å; V734-K738 WeakPolarHBondContact O-CG 3.39Å; V734-K738 PolarHBondContact O-N 3Å; E735-K738 PolarHBondContact O-N 3.04Å; E735-K738 VanDerWaalsContact OE1-CD 3.24Å; E735-K738 WeakPolarHBondContact OE1-CD 3.36Å; E735-K738 WeakPolarHBondContact OE1-CE 3.45Å; E735-K738 IonicContact OE1-NZ 3.36Å; E735-K738 PolarHBondContact OE1-NZ 3.34Å; K738-Q742 WeakPolarHBondContact O-CG 3.41Å; K738-Q742 PolarHBondContact O-N 3.27Å; K738-Q742 PolarHBondContact O-NE2 3.4Å
739	L	38.4	Very low	37.9	Very low	73 Å²	73	84.5 Å²	84.5	38%	0.382	50%	0.501	S	S	.	.	H	α-helix	trans	-72.3	-35.1	175.2	-70.3	169.4	0	0	0	112.3	E735 F736 D737 N743	E735-L739 PolarHBondContact O-N 3.26Å; F736-L739 WeakPolarHBondContact O-CB 3.48Å; F736-L739 PolarHBondContact O-N 2.9Å; D737-L739 PolarHBondContact O-N 3.24Å; L739-N743 PolarHBondContact O-ND2 2.93Å; L739-N743 VanDerWaalsContact O-ND2 3.16Å
740	N	34.2	Very low	37.1	Very low	66 Å²	66	92.7 Å²	92.7	35%	0.353	53%	0.534	S	S	.	.	H	α-helix	trans	-63.5	-46.4	173.9	-72	-34.1	0	0	0	111.7	F736 D737 N743	F736-N740 PolarHBondContact O-N 2.91Å; D737-N740 WeakPolarHBondContact O-CB 3.43Å; D737-N740 PolarHBondContact O-N 3.49Å; D737-N740 VanDerWaalsContact O-N 3.16Å; D737-N740 PolarHBondContact OD1-ND2 2.99Å; N740-N743 PolarHBondContact O-ND2 3.32Å
741	L	29.9	Very low	36.4	Very low	129 Å²	129	95.2 Å²	95.2	68%	0.675	55%	0.547	S	S	*	.	H	α-helix	trans	-71.8	-29.8	-173.2	-69.4	169.7	0	0	0	114.6	D737 N743 V744	D737-L741 WeakPolarHBondContact O-CG 3.41Å; D737-L741 PolarHBondContact O-N 2.92Å; L741-N743 PolarHBondContact O-N 3.25Å; L741-V744 PolarHBondContact O-N 3.28Å
742	Q	29.4	Very low	35.5	Very low	135 Å²	135	96.6 Å²	96.6	63%	0.631	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-64.3	-21.8	-176.8	-80.7	171.5	69.7	0	0	114.1	K738 V744	K738-Q742 WeakPolarHBondContact O-CG 3.41Å; K738-Q742 PolarHBondContact O-N 3.27Å; K738-Q742 PolarHBondContact O-NE2 3.4Å; Q742-V744 PolarHBondContact O-N 2.8Å
743	N	31	Very low	34	Very low	137 Å²	137	102.9 Å²	102.9	73%	0.733	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-70.3	-12.2	-178.9	-66.1	-58.9	0	0	0	114.7	L739 N740 L741	L739-N743 PolarHBondContact O-ND2 2.93Å; L739-N743 VanDerWaalsContact O-ND2 3.16Å; N740-N743 PolarHBondContact O-ND2 3.32Å; L741-N743 PolarHBondContact O-N 3.25Å
744	V	30.3	Very low	32.9	Very low	126 Å²	126	110.5 Å²	110.5	76%	0.764	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-94.5	-15.1	-174.2	-171.9	0	0	0	0	112.6	L741 Q742	L741-V744 PolarHBondContact O-N 3.28Å; Q742-V744 PolarHBondContact O-N 2.8Å
745	G	28.1	Very low	31.4	Very low	72 Å²	72	112.7 Å²	112.7	74%	0.742	64%	0.637	S	S	*	*	S	Bend	trans	-88.6	-4.5	-156.1	0	0	0	0	0	119.3
746	S	25.4	Very low	30.1	Very low	109 Å²	109	117.6 Å²	117.6	76%	0.762	67%	0.67	S	S	*	*			trans	-144.1	103.1	-167.2	54.3	0	0	0	0	116.3
747	S	22.8	Very low	28.8	Very low	120 Å²	120	124.8 Å²	124.8	84%	0.839	70%	0.701	S	S	*	*			trans	-160.5	90.5	161.3	50.3	0	0	0	0	114.9
748	V	23.8	Very low	27.7	Very low	140 Å²	140	126.8 Å²	126.8	85%	0.848	72%	0.717	S	S	*	*			trans	-141.7	109.7	159.5	179.5	0	0	0	0	112.6
749	S	24	Very low	26.7	Very low	95 Å²	95	130.3 Å²	130.3	66%	0.664	73%	0.732	S	S	*	*			trans	82.7	132	148.7	82	0	0	0	0	123.2
750	K	24	Very low	26.1	Very low	204 Å²	204	132 Å²	132	89%	0.887	74%	0.742	S	S	*	*			trans	81.1	118.1	145.1	-71.3	167.7	-178.2	177.9	0	121.3
751	T	22.8	Very low	25.7	Very low	127 Å²	127	138.5 Å²	138.5	78%	0.779	77%	0.767	S	S	*	*			trans	-85.6	171.9	158.9	54.8	0	0	0	0	110.8
752	P	26	Very low	25.7	Very low	119 Å²	119	139.5 Å²	139.5	77%	0.773	77%	0.771	S	S	*	*				-139	179.5	88	38.5	-23.8	0	0	0	115
753	D	22.2	Very low	25.5	Very low	148 Å²	148	141.2 Å²	141.2	79%	0.791	78%	0.784	S	S	*	*			trans	-62.5	164.9	177.3	-53.5	-94.3	0	0	0	113.1
754	E	26.4	Very low	25.2	Very low	194 Å²	194	140.4 Å²	140.4	91%	0.907	78%	0.784	S	S	*	*				-160.1	-175.4	63.7	-127.3	-159.5	142.8	0	0	117.8
755	N	22.8	Very low	25	Very low	120 Å²	120	140.1 Å²	140.1	64%	0.642	79%	0.788	S	S	*	*			trans	-87.5	154.3	-162.8	-136.3	-49.6	0	0	0	114.6
756	T	25.8	Very low	24.8	Very low	147 Å²	147	146.7 Å²	146.7	90%	0.902	79%	0.79	S	S	*	*				-168.1	163.4	129.7	12.7	0	0	0	0	112.5
757	K	25	Very low	25	Very low	175 Å²	175	147.5 Å²	147.5	76%	0.761	78%	0.784	S	S	*	*			trans	-121.4	173.3	-166.2	-83.3	177.7	172.8	168.8	0	113.8
758	T	24.6	Very low	25.1	Very low	130 Å²	130	148.1 Å²	148.1	80%	0.798	78%	0.778	S	S	*	*			trans	102.5	144.4	149.2	73.9	0	0	0	0	118.1
759	K	24.6	Very low	25.2	Very low	170 Å²	170	145.2 Å²	145.2	74%	0.739	77%	0.769	S	S	*	*			cis	-161	160.3	-25.1	-119.7	-166.5	164.3	-152.9	0	112.7
760	D	25.7	Very low	25.3	Very low	110 Å²	110	146.6 Å²	146.6	59%	0.588	77%	0.773	S	S	*	*			trans	-3.1	132.1	156.8	-24.9	-38.4	0	0	0	119.6
761	K	26.1	Very low	25.4	Very low	202 Å²	202	143.6 Å²	143.6	88%	0.878	76%	0.762	S	S	*	*				-177.8	149.8	100.7	-99.2	165.8	-173.8	176	0	115.8
762	I	29.9	Very low	25.6	Very low	149 Å²	149	146.9 Å²	146.9	76%	0.764	76%	0.76	S	S	*	*			trans	-111.4	147.6	164.8	-65.3	163.7	0	0	0	107.6
763	L	23.6	Very low	25.6	Very low	172 Å²	172	147.7 Å²	147.7	90%	0.901	76%	0.758	S	S	*	*			trans	-146.4	150.5	151.7	-151.7	75	0	0	0	111.7
764	T	25.1	Very low	25.9	Very low	119 Å²	119	147.1 Å²	147.1	73%	0.73	75%	0.754	S	S	*	*			trans	-117.9	149.8	-172.5	52.7	0	0	0	0	112.3
765	S	25.5	Very low	25.9	Very low	121 Å²	121	145.7 Å²	145.7	85%	0.846	75%	0.752	S	S	*	*			trans	-150.2	156.8	154	56.4	0	0	0	0	110.5
766	R	25	Very low	26	Very low	210 Å²	210	148.4 Å²	148.4	79%	0.792	76%	0.761	S	S	*	*			cis	164.8	106.7	-43.5	170.1	173	179.7	-177.2	-0.5	106.8
767	I	28.5	Very low	26.9	Very low	125 Å²	125	146.1 Å²	146.1	64%	0.641	75%	0.749	S	S	*	*			trans	71.6	155.2	143.1	-106.9	160.2	0	0	0	116.6
768	D	25.3	Very low	27.4	Very low	133 Å²	133	143.5 Å²	143.5	71%	0.711	75%	0.75	S	S	*	*			cis	-149.8	170.5	15.2	-133.7	-29.5	0	0	0	115.1
769	A	26.2	Very low	28	Very low	79 Å²	79	142.8 Å²	142.8	65%	0.653	75%	0.747	S	S	*	*			trans	16.1	161	153.6	0	0	0	0	0	122.9
770	V	26.4	Very low	29.1	Very low	124 Å²	124	140.5 Å²	140.5	75%	0.752	75%	0.75	S	S	*	*			cis	-165.4	154.6	45.5	165.6	0	0	0	0	106.5
771	E	26.7	Very low	29.1	Very low	141 Å²	141	140.2 Å²	140.2	66%	0.659	76%	0.762	S	S	*	*			cis	168.2	165.8	-13.4	-173.4	-163.9	-136.7	0	0	105.6
772	R	26.6	Very low	29.1	Very low	196 Å²	196	138 Å²	138	74%	0.74	76%	0.76	S	S	*	*			trans	84.2	146.6	167.2	-63.2	172.9	-152.1	160.8	12.8	116.7
773	D	25.5	Very low	29	Very low	137 Å²	137	139.4 Å²	139.4	73%	0.733	76%	0.764	S	S	*	*			cis	161.4	153.2	-15.4	-108.2	13.9	0	0	0	103.5
774	L	28.7	Very low	29.2	Very low	135 Å²	135	138.9 Å²	138.9	71%	0.707	76%	0.761	S	S	*	*			cis	-166.8	173.1	-14.9	-130.5	-179.1	0	0	0	107.9
775	L	26.2	Very low	29.3	Very low	165 Å²	165	136.1 Å²	136.1	86%	0.864	76%	0.756	S	S	*	*			trans	78.4	163.8	162.9	-62.1	165.2	0	0	0	120
776	E	24.6	Very low	29.6	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	76%	0.757	S	S	*	*			trans	-155.2	-162.6	-159	-159.7	-162.5	-148.7	0	0	109.5
777	P	45.4	Very low	29.7	Very low	100 Å²	100	130.1 Å²	130.1	65%	0.649	76%	0.755	S	S	*	*				-78.9	-158.9	-105.8	39.8	-26.1	0	0	0	114
778	P	34.7	Very low	29.7	Very low	120 Å²	120	133.2 Å²	133.2	78%	0.779	76%	0.759	S	S	*	*			cis	-139.3	-126.1	11.4	43.5	-16.7	0	0	0	115.8
779	P	36.8	Very low	29.9	Very low	114 Å²	114	137.7 Å²	137.7	74%	0.74	77%	0.765	S	S	*	*			trans	-133.9	-148.9	-141.9	45.6	-21.1	0	0	0	113.9
780	P	48.7	Very low	30	Very low	123 Å²	123	142.7 Å²	142.7	80%	0.799	77%	0.768	S	S	*	*			cis	-121.8	170.2	-32.5	38.5	-24.8	0	0	0	113.9
781	A	25.7	Very low	30.3	Very low	103 Å²	103	141.1 Å²	141.1	85%	0.851	76%	0.758	S	S	*	*			trans	-160	161.6	159.7	0	0	0	0	0	112.4
782	D	26	Very low	30.5	Very low	156 Å²	156	142.2 Å²	142.2	83%	0.834	76%	0.763	S	S	*	*			trans	-93.9	173.9	-167.3	-80.8	-63.6	0	0	0	117
783	Q	28.5	Very low	30.9	Very low	178 Å²	178	137.6 Å²	137.6	83%	0.832	76%	0.761	S	S	*	*			trans	89.2	147	157.6	-57.3	-167	71.9	0	0	119.1
784	L	27.6	Very low	31.2	Very low	161 Å²	161	136.7 Å²	136.7	84%	0.843	75%	0.753	S	S	*	*			cis	-165.4	133.9	-38.2	-141.2	146.3	0	0	0	108.4
785	G	26.9	Very low	31.6	Very low	62 Å²	62	134.9 Å²	134.9	64%	0.639	74%	0.742	S	S	*	*			trans	176.9	121.5	177.4	0	0	0	0	0	113.3	G787	G785-G787 PolarHBondContact O-N 2.93Å
786	P	31.8	Very low	32.1	Very low	131 Å²	131	131 Å²	131	85%	0.851	73%	0.729	S	S	*	*			trans	-88.9	105.7	-161.8	32.4	-35.2	0	0	0	114.9
787	G	27.1	Very low	32.5	Very low	73 Å²	73	125.3 Å²	125.3	75%	0.753	71%	0.711	S	S	*	*			trans	-78	113	161.4	0	0	0	0	0	111.4	G785 R789	G785-G787 PolarHBondContact O-N 2.93Å; G787-R789 PolarHBondContact O-N 3.13Å
788	R	28.5	Very low	32.1	Very low	191 Å²	191	130 Å²	130	72%	0.721	72%	0.716	S	S	*	*			trans	-76	90.1	-174.2	-169.7	-175.6	-175.8	-159.8	1.6	112.8	R790	R788-R790 PolarHBondContact O-N 3.36Å
789	R	29.8	Very low	32.4	Very low	226 Å²	226	130.9 Å²	130.9	85%	0.853	71%	0.712	S	S	*	*			trans	-69.5	123.3	162.6	-62.9	-174.3	-173.8	-174.9	2.6	109.4	G787	G787-R789 PolarHBondContact O-N 3.13Å
790	R	28.3	Very low	32.2	Very low	185 Å²	185	128.1 Å²	128.1	70%	0.698	70%	0.7	S	S	*	*			trans	-73.3	130.3	160.7	-94.3	179	170.4	171	-5.8	108.1	R788 M795	R788-R790 PolarHBondContact O-N 3.36Å; R790-M795 VanDerWaalsContact CZ-CE 3.45Å
791	T	32.6	Very low	31.5	Very low	90 Å²	90	128.6 Å²	128.6	55%	0.552	70%	0.695	S	S	*	*			trans	-116	142.5	165.6	50.2	0	0	0	0	108.7	S793 E794	T791-S793 PolarHBondContact O-N 2.73Å; T791-S793 VanDerWaalsContact O-N 3.09Å; T791-E794 PolarHBondContact O-N 3.04Å; T791-E794 VanDerWaalsContact O-N 3.11Å
792	E	30	Very low	31.8	Very low	164 Å²	164	132.3 Å²	132.3	77%	0.766	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-26.4	-171.4	-65.6	149.9	172.1	0	0	112.8	E794	E792-E794 VanDerWaalsContact C-N 3.29Å; E792-E794 PolarHBondContact O-N 3.02Å
793	S	35.4	Very low	32.3	Very low	100 Å²	100	129.5 Å²	129.5	70%	0.699	69%	0.69	S	S	*	*	H	α-helix	trans	-63.1	-26.1	177.4	-166.4	0	0	0	0	114.6	T791 M795	T791-S793 PolarHBondContact O-N 2.73Å; T791-S793 VanDerWaalsContact O-N 3.09Å; S793-M795 VanDerWaalsContact C-N 3.34Å; S793-M795 PolarHBondContact O-N 3.24Å
794	E	32.3	Very low	32.4	Very low	118 Å²	118	128.3 Å²	128.3	55%	0.551	69%	0.688	S	S	*	*	H	α-helix	trans	-80.5	-13.3	-173.7	-150	-177.4	-134.1	0	0	113.5	T791 E792	T791-E794 PolarHBondContact O-N 3.04Å; T791-E794 VanDerWaalsContact O-N 3.11Å; E792-E794 VanDerWaalsContact C-N 3.29Å; E792-E794 PolarHBondContact O-N 3.02Å
795	M	36.7	Very low	32.4	Very low	97 Å²	97	126.2 Å²	126.2	48%	0.478	69%	0.687	S	S	.	*	H	α-helix	trans	-88.5	-36.4	-179.5	-74.3	177.6	164	0	0	113.2	R790 S793 A797 R798	R790-M795 VanDerWaalsContact CZ-CE 3.45Å; S793-M795 VanDerWaalsContact C-N 3.34Å; S793-M795 PolarHBondContact O-N 3.24Å; M795-A797 PolarHBondContact O-N 2.84Å; M795-R798 PolarHBondContact O-N 3.17Å
796	S	37.3	Very low	32.7	Very low	84 Å²	84	129.7 Å²	129.7	59%	0.587	70%	0.698	S	S	*	*	H	α-helix	trans	-55.2	-34.6	175.1	-53.4	0	0	0	0	112.6	R798 A800	S796-R798 VanDerWaalsContact C-N 3.31Å; S796-R798 PolarHBondContact O-N 2.88Å; S796-A800 PolarHBondContact O-N 3.42Å
797	A	33.7	Very low	32.7	Very low	55 Å²	55	128.7 Å²	128.7	46%	0.455	69%	0.694	S	S	.	*	H	α-helix	trans	-70.7	-19	178.4	0	0	0	0	0	114.5	M795 N801	M795-A797 PolarHBondContact O-N 2.84Å; A797-N801 PolarHBondContact O-ND2 3.02Å; A797-N801 VanDerWaalsContact O-ND2 3.17Å
798	R	35.7	Very low	32.8	Very low	198 Å²	198	131 Å²	131	75%	0.747	70%	0.699	S	S	*	*	H	α-helix	trans	-84.7	-36.2	176.9	-75.8	-171.1	168.4	-144.4	-6.7	112.7	M795 S796 A800 N801	M795-R798 PolarHBondContact O-N 3.17Å; S796-R798 VanDerWaalsContact C-N 3.31Å; S796-R798 PolarHBondContact O-N 2.88Å; R798-A800 VanDerWaalsContact C-N 3.33Å; R798-N801 PolarHBondContact O-N 3.45Å
799	I	42.1	Very low	33.5	Very low	139 Å²	139	128.2 Å²	128.2	71%	0.713	71%	0.706	S	S	*	*	H	α-helix	trans	-67.1	-37.2	178.8	-61.4	173.2	0	0	0	110.6	N801	I799-N801 PolarHBondContact O-N 3.07Å; I799-N801 VanDerWaalsContact O-N 3.16Å
800	A	32.1	Very low	33.3	Very low	57 Å²	57	120.8 Å²	120.8	47%	0.471	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.8	-15	178.3	0	0	0	0	0	115.3	S796 R798	S796-A800 PolarHBondContact O-N 3.42Å; R798-A800 VanDerWaalsContact C-N 3.33Å
801	N	33.6	Very low	33.2	Very low	132 Å²	132	121.2 Å²	121.2	71%	0.706	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	7.3	-170.2	-77.3	-19.3	0	0	0	115	A797 R798 I799	A797-N801 PolarHBondContact O-ND2 3.02Å; A797-N801 VanDerWaalsContact O-ND2 3.17Å; R798-N801 PolarHBondContact O-N 3.45Å; I799-N801 PolarHBondContact O-N 3.07Å; I799-N801 VanDerWaalsContact O-N 3.16Å
802	M	32.9	Very low	33.3	Very low	182 Å²	182	126 Å²	126	90%	0.897	73%	0.725	S	S	*	*	S	Bend	trans	-100.3	3.6	174.2	-70	-163.4	71.4	0	0	114.4
803	S	36	Very low	33	Very low	96 Å²	96	121.4 Å²	121.4	67%	0.671	72%	0.722	S	S	*	*	S	Bend	trans	-129.3	34.2	-170.8	63.9	0	0	0	0	114.9
804	L	29.7	Very low	33.1	Very low	154 Å²	154	126.3 Å²	126.3	81%	0.806	73%	0.734	S	S	*	*			trans	-134.3	128.3	171.9	-75.1	176.5	0	0	0	112.6
805	S	27.6	Very low	32.9	Very low	116 Å²	116	128.4 Å²	128.4	81%	0.811	75%	0.748	S	S	*	*			trans	-141.4	150.1	160.7	-75.6	0	0	0	0	108.4
806	P	34.6	Very low	32.4	Very low	135 Å²	135	131.2 Å²	131.2	88%	0.877	76%	0.76	S	S	*	*			trans	-76.7	145.4	-155.7	-19.4	34.5	0	0	0	115.2
807	S	30.5	Very low	32.3	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	78%	0.778	S	S	*	*			trans	-78.6	153.1	-179.7	55.1	0	0	0	0	114.6
808	S	29.3	Very low	31.9	Very low	122 Å²	122	136.7 Å²	136.7	85%	0.853	78%	0.784	S	S	*	*			trans	-150.9	153.8	148.5	-81.6	0	0	0	0	110.6
809	P	44	Very low	31.9	Very low	132 Å²	132	138.1 Å²	138.1	86%	0.857	79%	0.789	S	S	*	*			trans	-116.1	162.5	-140.8	40.1	-32.2	0	0	0	116
810	G	24.4	Very low	31.4	Very low	71 Å²	71	140.7 Å²	140.7	73%	0.732	80%	0.798	S	S	*	*			trans	-177.3	118.1	168	0	0	0	0	0	115.8
811	H	26.7	Very low	31.6	Very low	194 Å²	194	142.6 Å²	142.6	90%	0.898	81%	0.808	S	S	*	*			trans	64.9	146.5	162.9	-84.7	-70.3	0	0	0	122.5
812	E	34.6	Very low	32	Very low	190 Å²	190	140.2 Å²	140.2	89%	0.888	81%	0.807	S	S	*	*			trans	-75.2	144.5	174.3	-58.2	161.9	123.4	0	0	111
813	G	24.6	Very low	33	Very low	67 Å²	67	138 Å²	138	69%	0.691	79%	0.789	S	S	*	*			trans	-160.7	94	177.6	0	0	0	0	0	111	L815	G813-L815 PolarHBondContact O-N 3.11Å
814	Q	37	Very low	34	Very low	204 Å²	204	139.8 Å²	139.8	95%	0.953	78%	0.781	S	S	*	*			trans	-68.4	97.5	175.6	-179.2	-179.8	2.3	0	0	109.4
815	L	27.5	Very low	35.8	Very low	161 Å²	161	134 Å²	134	84%	0.843	75%	0.75	S	S	*	*			trans	-123.8	135.2	177.9	-100.7	162.1	0	0	0	112	G813	G813-L815 PolarHBondContact O-N 3.11Å
816	E	26.6	Very low	38.3	Very low	157 Å²	157	128.5 Å²	128.5	73%	0.734	71%	0.712	S	S	*	*			trans	-70.8	144.5	-156.8	-64.2	163.4	108.1	0	0	114.3	T818	E816-T818 VanDerWaalsContact C-N 3.33Å; E816-T818 VanDerWaalsContact C-OG1 3.28Å; E816-T818 WeakPolarHBondContact CB-OG1 3.28Å; E816-T818 PolarHBondContact O-N 3.28Å; E816-T818 PolarHBondContact O-OG1 3.36Å
817	V	35.2	Very low	40.4	Very low	160 Å²	160	122.2 Å²	122.2	97%	0.97	67%	0.671	S	S	*	*			trans	-63.3	91.8	165.4	178.3	0	0	0	0	108.9
818	T	26.1	Very low	42.3	Very low	93 Å²	93	122.3 Å²	122.3	57%	0.571	66%	0.657	S	S	*	*			trans	-132.8	99.7	-169.9	-30.7	0	0	0	0	113	E816 E820	E816-T818 VanDerWaalsContact C-N 3.33Å; E816-T818 VanDerWaalsContact C-OG1 3.28Å; E816-T818 WeakPolarHBondContact CB-OG1 3.28Å; E816-T818 PolarHBondContact O-N 3.28Å; E816-T818 PolarHBondContact O-OG1 3.36Å; T818-E820 PolarHBondContact O-N 3.43Å
819	R	34.7	Very low	44.2	Very low	228 Å²	228	117.8 Å²	117.8	86%	0.86	63%	0.63	S	S	*	*			trans	50.9	51.5	148.9	-67.2	-178.8	163.4	176.2	-5.5	118.7
820	E	31.3	Very low	45.4	Very low	193 Å²	193	117.8 Å²	117.8	90%	0.902	62%	0.619	S	S	*	*			trans	-102.8	62.7	139.2	-70.9	-154.5	140.5	0	0	110.6	T818 A822	T818-E820 PolarHBondContact O-N 3.43Å; E820-A822 PolarHBondContact O-N 3.13Å
821	S	36.3	Very low	47.7	Very low	97 Å²	97	121.8 Å²	121.8	68%	0.678	62%	0.618	S	S	*	*			trans	-71.8	63.1	159.4	58.1	0	0	0	0	109.6	R823	S821-R823 PolarHBondContact O-N 2.98Å
822	A	42.5	Very low	50.4	Low	83 Å²	83	113.7 Å²	113.7	69%	0.686	58%	0.583	S	S	*	*			trans	-57.5	106.4	164.8	0	0	0	0	0	106.7	E820 R824	E820-A822 PolarHBondContact O-N 3.13Å; A822-R824 PolarHBondContact O-N 2.96Å
823	R	53.5	Low	52.8	Low	136 Å²	136	105 Å²	105	51%	0.513	54%	0.543	S	S	.	.			trans	-61	123.7	-164.5	-59.9	175.5	-164.3	176.7	-0.3	108.6	S821 L825	S821-R823 PolarHBondContact O-N 2.98Å; R823-L825 VanDerWaalsContact C-N 3.34Å; R823-L825 PolarHBondContact O-N 3.05Å
824	R	58.3	Low	55.6	Low	133 Å²	133	103 Å²	103	50%	0.502	52%	0.515	S	S	.	.			trans	-73.1	95.4	-178.1	-62	-174.7	-178.1	-178.3	0.6	107.9	A822 F826 Y866	A822-R824 PolarHBondContact O-N 2.96Å; R824-F826 HydrophobicContact CB-CD2 4.16Å; R824-F826 HydrophobicContact CB-CE2 3.4Å; R824-F826 VanDerWaalsContact CB-CE2 3.4Å; R824-F826 HydrophobicContact CB-CZ 3.72Å; R824-F826 WeakPolarHBondContact O-CD2 3.28Å; R824-F826 PolarHBondContact O-N 3.3Å; R824-Y866 PolarHBondContact NH1-OH 3.4Å
825	L	65.9	Low	57.8	Low	32 Å²	32	94.3 Å²	94.3	17%	0.168	48%	0.475	C	S	.	.			trans	-75	115.4	177	-67.4	159.6	0	0	0	107.6	E607 K610 R823	E607-L825 HydrophobicContact CG-CD1 3.45Å; E607-L825 VanDerWaalsContact CG-CD1 3.45Å; E607-L825 HydrophobicContact CG-CD2 4.17Å; E607-L825 HydrophobicContact CG-CG 4.46Å; E607-L825 VanDerWaalsContact OE1-CD1 3.32Å; E607-L825 WeakPolarHBondContact OE1-CD1 3.47Å; K610-L825 HydrophobicContact CD-CD2 3.97Å; R823-L825 VanDerWaalsContact C-N 3.34Å; R823-L825 PolarHBondContact O-N 3.05Å
826	F	81.8	Confident	60.6	Low	1 Å²	1	86.6 Å²	86.6	0%	0.004	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-117.4	155.8	171.9	-61.2	-68.1	0	0	0	109	Q606 R824 F828 G829 E830 E831 P832 D836 V863 Y866	Q606-F826 PolarHBondContact NE2-O 3.25Å; R824-F826 HydrophobicContact CB-CD2 4.16Å; R824-F826 HydrophobicContact CB-CE2 3.4Å; R824-F826 VanDerWaalsContact CB-CE2 3.4Å; R824-F826 HydrophobicContact CB-CZ 3.72Å; R824-F826 WeakPolarHBondContact O-CD2 3.28Å; R824-F826 PolarHBondContact O-N 3.3Å; F826-F828 PolarHBondContact O-N 3.14Å; F826-G829 PolarHBondContact O-N 2.92Å; F826-E830 WeakPolarHBondContact CD2-O 3.44Å; F826-E831 WeakPolarHBondContact CB-O 3.49Å; F826-P832 HydrophobicContact CD1-CB 3.9Å; F826-P832 HydrophobicContact CD2-CB 4.2Å; F826-P832 HydrophobicContact CE1-CB 3.72Å; F826-P832 HydrophobicContact CE2-CB 4.01Å; F826-P832 HydrophobicContact CE2-CG 4.26Å; F826-P832 HydrophobicContact CG-CB 4.13Å; F826-P832 HydrophobicContact CZ-CB 3.76Å; F826-P832 HydrophobicContact CZ-CG 4.2Å; F826-D836 WeakPolarHBondContact CA-OD1 3.46Å; F826-D836 WeakPolarHBondContact CB-OD1 3.35Å; F826-V863 HydrophobicContact CD1-CG2 4.03Å; F826-V863 HydrophobicContact CE1-CG2 4Å; F826-Y866 HydrophobicContact CE1-CE2 4.36Å; F826-Y866 AromaticContact CZ-CE2 3.85Å; F826-Y866 HydrophobicContact CZ-CE2 3.85Å
827	L	78.1	Confident	63.3	Low	2 Å²	2	80.8 Å²	80.8	1%	0.01	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.6	-174.8	-64.7	170.3	0	0	0	111.5	F583 L599 Y602 L603 Q606 L835 D836 V839 W859	F583-L827 HydrophobicContact CD2-CD2 4.47Å; F583-L827 HydrophobicContact CE2-CD2 3.94Å; F583-L827 HydrophobicContact CZ-CD1 4.29Å; F583-L827 HydrophobicContact CZ-CD2 4.34Å; L599-L827 HydrophobicContact CD1-CD2 4Å; Y602-L827 HydrophobicContact CD1-CD2 4.09Å; Y602-L827 HydrophobicContact CE1-CD2 3.95Å; Y602-L827 PolarHBondContact OH-O 2.85Å; L603-L827 HydrophobicContact CD2-CD2 3.89Å; Q606-L827 PolarHBondContact NE2-O 3.3Å; Q606-L827 VanDerWaalsContact NE2-O 3.17Å; L827-L835 HydrophobicContact CB-CD2 3.88Å; L827-L835 HydrophobicContact CB-CG 4.41Å; L827-L835 HydrophobicContact CD1-CD2 4.17Å; L827-L835 HydrophobicContact CD1-CG 3.93Å; L827-D836 WeakPolarHBondContact CG-OD1 3.49Å; L827-D836 PolarHBondContact N-OD1 3.4Å; L827-V839 HydrophobicContact CD1-CB 3.81Å; L827-V839 HydrophobicContact CD1-CG1 4.12Å; L827-V839 HydrophobicContact CD1-CG2 3.59Å; L827-W859 HydrophobicContact CD1-CZ2 4.18Å
828	F	70.9	Confident	65.7	Low	112 Å²	112	73.6 Å²	73.6	49%	0.491	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	40.1	-179.2	-116.1	-87.6	0	0	0	115.2	F826 L835 P877	F826-F828 PolarHBondContact O-N 3.14Å; F828-L835 HydrophobicContact CD2-CD2 3.79Å; F828-L835 HydrophobicContact CE2-CD2 4.3Å; F828-P877 HydrophobicContact CD1-CB 4.34Å; F828-P877 HydrophobicContact CD2-CB 4.2Å; F828-P877 HydrophobicContact CD2-CG 4.34Å; F828-P877 HydrophobicContact CE1-CB 4.45Å; F828-P877 HydrophobicContact CE2-CB 4.31Å; F828-P877 HydrophobicContact CG-CB 4.21Å; F828-P877 HydrophobicContact CZ-CB 4.43Å
829	G	68.9	Low	68.5	Low	27 Å²	27	69.1 Å²	69.1	28%	0.278	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	125.6	-121.2	166.9	0	0	0	0	0	113.4	K610 F826	K610-G829 PolarHBondContact NZ-O 2.95Å; F826-G829 PolarHBondContact O-N 2.92Å
830	E	68.3	Low	70.9	Confident	133 Å²	133	59.1 Å²	59.1	62%	0.621	30%	0.3	S	S	*	.	S	Bend	trans	-121.9	-4.2	176	-55.6	-161	145.5	0	0	112.8	F826	F826-E830 WeakPolarHBondContact CD2-O 3.44Å
831	E	74.1	Confident	73.4	Confident	155 Å²	155	50.7 Å²	50.7	72%	0.724	26%	0.264	S	S	*	.	S	Bend	trans	-104.2	144.7	170.5	-64.8	-174.4	157.2	0	0	109.6	F826	F826-E831 WeakPolarHBondContact CB-O 3.49Å
832	P	81.9	Confident	75.7	Confident	24 Å²	24	46.2 Å²	46.2	16%	0.156	23%	0.233	C	C	.	.			trans	-72.1	135.1	177.1	29.9	-33.8	0	0	0	111	F826 Y866 W874	F826-P832 HydrophobicContact CD1-CB 3.9Å; F826-P832 HydrophobicContact CD2-CB 4.2Å; F826-P832 HydrophobicContact CE1-CB 3.72Å; F826-P832 HydrophobicContact CE2-CB 4.01Å; F826-P832 HydrophobicContact CE2-CG 4.26Å; F826-P832 HydrophobicContact CG-CB 4.13Å; F826-P832 HydrophobicContact CZ-CB 3.76Å; F826-P832 HydrophobicContact CZ-CG 4.2Å; P832-Y866 HydrophobicContact CG-CE1 4.49Å; P832-W874 HydrophobicContact CB-CD2 3.69Å; P832-W874 VanDerWaalsContact CB-CE2 3.45Å; P832-W874 HydrophobicContact CB-CE3 3.87Å; P832-W874 HydrophobicContact CB-CG 4.38Å; P832-W874 HydrophobicContact CB-CH2 3.52Å; P832-W874 HydrophobicContact CB-CZ2 3.37Å; P832-W874 HydrophobicContact CB-CZ3 3.79Å; P832-W874 HydrophobicContact CG-CD2 4.2Å; P832-W874 HydrophobicContact CG-CH2 4.44Å; P832-W874 HydrophobicContact CG-CZ2 3.81Å
833	S	85.1	Confident	77.8	Confident	7 Å²	7	42.3 Å²	42.3	5%	0.049	20%	0.2	C	C	.	.			trans	-116.5	163.1	-177.8	74.7	0	0	0	0	111.6	L835 D836 W874	S833-L835 PolarHBondContact O-N 3.42Å; S833-L835 VanDerWaalsContact O-N 3.14Å; S833-L835 WeakPolarHBondContact OG-CB 3.32Å; S833-L835 PolarHBondContact OG-N 3.26Å; S833-D836 WeakPolarHBondContact CB-OD2 3.17Å; S833-D836 PolarHBondContact N-OD2 3.12Å; S833-D836 WeakPolarHBondContact O-CB 3.47Å; S833-D836 PolarHBondContact O-N 2.92Å; S833-D836 PolarHBondContact OG-OD2 2.86Å; S833-W874 VanDerWaalsContact O-CE3 3.3Å
834	K	83.8	Confident	78.9	Confident	24 Å²	24	43.4 Å²	43.4	10%	0.104	21%	0.211	C	C	.	.	H	α-helix	trans	-56.4	-31.2	173.9	-166.3	-164.3	162.4	-168.6	0	112.5	D557 E559 D836 Q837 D838 P875	D557-K834 IonicContact OD1-NZ 2.79Å; D557-K834 PolarHBondContact OD1-NZ 3.36Å; E559-K834 WeakPolarHBondContact OE2-CD 3.17Å; E559-K834 IonicContact OE2-NZ 2.82Å; E559-K834 PolarHBondContact OE2-NZ 3.08Å; K834-D836 PolarHBondContact O-N 2.9Å; K834-Q837 WeakPolarHBondContact O-CA 3.29Å; K834-Q837 WeakPolarHBondContact O-CB 3.42Å; K834-Q837 PolarHBondContact O-N 3.45Å; K834-D838 VanDerWaalsContact CE-OD2 3.3Å; K834-D838 WeakPolarHBondContact CE-OD2 3.46Å; K834-D838 IonicContact NZ-OD2 3.4Å; K834-D838 PolarHBondContact O-N 3.1Å; K834-P875 PolarHBondContact N-O 2.98Å
835	L	83.4	Confident	79.4	Confident	22 Å²	22	42.3 Å²	42.3	12%	0.115	22%	0.223	C	C	.	.	H	α-helix	trans	-58.2	-36	174.9	-178.8	69.1	0	0	0	112.1	W581 F583 L827 F828 S833 Q837 D838 V839 P877	W581-L835 HydrophobicContact CE3-CD1 4.06Å; W581-L835 HydrophobicContact CZ3-CD1 3.88Å; F583-L835 HydrophobicContact CB-CD2 4.12Å; F583-L835 HydrophobicContact CD1-CD1 3.9Å; F583-L835 HydrophobicContact CD1-CD2 3.71Å; F583-L835 HydrophobicContact CD1-CG 4.24Å; F583-L835 HydrophobicContact CE1-CD1 4.12Å; F583-L835 HydrophobicContact CE1-CD2 4.34Å; F583-L835 HydrophobicContact CE1-CG 4.48Å; F583-L835 HydrophobicContact CG-CD2 4.01Å; L827-L835 HydrophobicContact CB-CD2 3.88Å; L827-L835 HydrophobicContact CB-CG 4.41Å; L827-L835 HydrophobicContact CD1-CD2 4.17Å; L827-L835 HydrophobicContact CD1-CG 3.93Å; F828-L835 HydrophobicContact CD2-CD2 3.79Å; F828-L835 HydrophobicContact CE2-CD2 4.3Å; S833-L835 PolarHBondContact O-N 3.42Å; S833-L835 VanDerWaalsContact O-N 3.14Å; S833-L835 WeakPolarHBondContact OG-CB 3.32Å; S833-L835 PolarHBondContact OG-N 3.26Å; L835-Q837 VanDerWaalsContact C-N 3.31Å; L835-Q837 PolarHBondContact O-N 3.47Å; L835-D838 PolarHBondContact O-N 3.37Å; L835-V839 HydrophobicContact CD1-CG2 4.2Å; L835-V839 HydrophobicContact CG-CG2 4.38Å; L835-V839 WeakPolarHBondContact O-CB 3.47Å; L835-V839 WeakPolarHBondContact O-CG2 3.43Å; L835-V839 PolarHBondContact O-N 3.24Å; L835-P877 HydrophobicContact CB-CG 3.89Å
836	D	85.1	Confident	80	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-33.9	175.7	-60.4	-90.4	0	0	0	111.8	F826 L827 S833 K834 L840 W859 V863 W874	F826-D836 WeakPolarHBondContact CA-OD1 3.46Å; F826-D836 WeakPolarHBondContact CB-OD1 3.35Å; L827-D836 WeakPolarHBondContact CG-OD1 3.49Å; L827-D836 PolarHBondContact N-OD1 3.4Å; S833-D836 WeakPolarHBondContact CB-OD2 3.17Å; S833-D836 PolarHBondContact N-OD2 3.12Å; S833-D836 WeakPolarHBondContact O-CB 3.47Å; S833-D836 PolarHBondContact O-N 2.92Å; S833-D836 PolarHBondContact OG-OD2 2.86Å; K834-D836 PolarHBondContact O-N 2.9Å; D836-L840 VanDerWaalsContact O-CB 3.31Å; D836-L840 WeakPolarHBondContact O-CB 3.48Å; D836-L840 PolarHBondContact O-N 3.38Å; D836-L840 VanDerWaalsContact O-N 3.13Å; D836-W859 HydrophobicContact CB-CZ2 4.24Å; D836-W859 WeakPolarHBondContact O-CZ2 3.45Å; D836-W859 PolarHBondContact OD1-NE1 3.06Å; D836-V863 HydrophobicContact CB-CG2 4.09Å; D836-W874 HydrophobicContact CB-CE3 4.34Å; D836-W874 HydrophobicContact CB-CZ3 3.82Å
837	Q	84.4	Confident	79.8	Confident	34 Å²	34	48.8 Å²	48.8	16%	0.159	26%	0.259	C	S	.	.	H	α-helix	trans	-70.7	-42.5	172	-171.6	-177.5	25.9	0	0	111.8	K834 L835 L840 A841 R871 W874	K834-Q837 WeakPolarHBondContact O-CA 3.29Å; K834-Q837 WeakPolarHBondContact O-CB 3.42Å; K834-Q837 PolarHBondContact O-N 3.45Å; L835-Q837 VanDerWaalsContact C-N 3.31Å; L835-Q837 PolarHBondContact O-N 3.47Å; Q837-L840 PolarHBondContact O-N 2.91Å; Q837-A841 WeakPolarHBondContact O-CB 3.13Å; Q837-A841 PolarHBondContact O-N 3.36Å; Q837-R871 HydrophobicContact CG-CB 4.34Å; Q837-R871 PolarHBondContact OE1-O 3.29Å; Q837-W874 HydrophobicContact CB-CE3 4.29Å
838	D	84.9	Confident	80	Confident	9 Å²	9	49.1 Å²	49.1	5%	0.048	26%	0.261	C	S	.	.	H	α-helix	trans	-71.1	-36.3	-177.5	-72.2	-24.9	0	0	0	112.5	R560 R564 W581 K834 L835 A841 A842	R560-D838 HydrophobicContact CG-CB 4.46Å; R564-D838 IonicContact CZ-OD1 3.82Å; R564-D838 IonicContact NH2-OD1 3.85Å; R564-D838 PolarHBondContact NH2-OD1 2.92Å; W581-D838 HydrophobicContact CH2-CB 4.49Å; K834-D838 VanDerWaalsContact CE-OD2 3.3Å; K834-D838 WeakPolarHBondContact CE-OD2 3.46Å; K834-D838 IonicContact NZ-OD2 3.4Å; K834-D838 PolarHBondContact O-N 3.1Å; L835-D838 PolarHBondContact O-N 3.37Å; D838-A841 PolarHBondContact O-N 2.99Å; D838-A842 PolarHBondContact O-N 3.18Å; D838-A842 VanDerWaalsContact O-N 3.14Å
839	V	85.8	Confident	80.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.5	-38.3	170.7	169.8	0	0	0	0	111.1	W581 F583 L590 L599 L827 L835 A841 A842 L843 W859	W581-V839 HydrophobicContact CE3-CG2 3.98Å; W581-V839 HydrophobicContact CH2-CG2 3.78Å; W581-V839 HydrophobicContact CZ3-CG2 3.49Å; W581-V839 VanDerWaalsContact CZ3-CG2 3.49Å; F583-V839 HydrophobicContact CE1-CG2 3.72Å; F583-V839 HydrophobicContact CZ-CG2 3.95Å; L590-V839 HydrophobicContact CD1-CB 4.31Å; L590-V839 HydrophobicContact CD1-CG1 3.81Å; L590-V839 HydrophobicContact CD1-CG2 3.88Å; L599-V839 HydrophobicContact CD2-CG1 4.05Å; L827-V839 HydrophobicContact CD1-CB 3.81Å; L827-V839 HydrophobicContact CD1-CG1 4.12Å; L827-V839 HydrophobicContact CD1-CG2 3.59Å; L835-V839 HydrophobicContact CD1-CG2 4.2Å; L835-V839 HydrophobicContact CG-CG2 4.38Å; L835-V839 WeakPolarHBondContact O-CB 3.47Å; L835-V839 WeakPolarHBondContact O-CG2 3.43Å; L835-V839 PolarHBondContact O-N 3.24Å; V839-A841 VanDerWaalsContact C-N 3.3Å; V839-A841 PolarHBondContact O-N 3.46Å; V839-A842 WeakPolarHBondContact O-CB 3.47Å; V839-A842 PolarHBondContact O-N 2.91Å; V839-L843 HydrophobicContact CG1-CD1 3.81Å; V839-L843 HydrophobicContact CG1-CG 4.5Å; V839-L843 WeakPolarHBondContact O-CG 3.5Å; V839-L843 PolarHBondContact O-N 3.23Å; V839-W859 HydrophobicContact CB-CH2 4.12Å; V839-W859 HydrophobicContact CB-CZ2 4.2Å; V839-W859 HydrophobicContact CG1-CH2 3.62Å; V839-W859 HydrophobicContact CG1-CZ2 3.97Å; V839-W859 HydrophobicContact CG1-CZ3 4.23Å
840	L	84.9	Confident	81.3	Confident	17 Å²	17	48 Å²	48	9%	0.089	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-40.6	173.9	-172.6	80.2	0	0	0	111.3	D836 Q837 A842 L843 E844 W859 K860 V863 L864 R871	D836-L840 VanDerWaalsContact O-CB 3.31Å; D836-L840 WeakPolarHBondContact O-CB 3.48Å; D836-L840 PolarHBondContact O-N 3.38Å; D836-L840 VanDerWaalsContact O-N 3.13Å; Q837-L840 PolarHBondContact O-N 2.91Å; L840-A842 PolarHBondContact O-N 3.31Å; L840-L843 CarbonylContact O-C 3.4Å; L840-L843 PolarHBondContact O-N 3.33Å; L840-E844 PolarHBondContact O-N 2.98Å; L840-W859 HydrophobicContact CB-CH2 4.03Å; L840-W859 HydrophobicContact CD1-CH2 4.26Å; L840-W859 HydrophobicContact CD1-CZ3 4.38Å; L840-K860 HydrophobicContact CD1-CG 3.94Å; L840-V863 HydrophobicContact CB-CG1 4.34Å; L840-V863 HydrophobicContact CD1-CG1 4.32Å; L840-V863 HydrophobicContact CD2-CG1 3.93Å; L840-V863 HydrophobicContact CG-CG1 4.43Å; L840-L864 HydrophobicContact CD1-CD2 4.37Å; L840-L864 HydrophobicContact CD1-CG 4.26Å; L840-L864 HydrophobicContact CD2-CD2 3.98Å; L840-R871 VanDerWaalsContact CD2-NH1 3.25Å
841	A	84.7	Confident	81.9	Confident	17 Å²	17	49.9 Å²	49.9	14%	0.14	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-9.7	174.8	0	0	0	0	0	113.8	R564 R567 Q837 D838 V839	R564-A841 VanDerWaalsContact NH1-CB 3.32Å; R567-A841 VanDerWaalsContact NH2-C 3.25Å; R567-A841 PolarHBondContact NH2-O 2.68Å; Q837-A841 WeakPolarHBondContact O-CB 3.13Å; Q837-A841 PolarHBondContact O-N 3.36Å; D838-A841 PolarHBondContact O-N 2.99Å; V839-A841 VanDerWaalsContact C-N 3.3Å; V839-A841 PolarHBondContact O-N 3.46Å
842	A	84.6	Confident	82.4	Confident	3 Å²	3	47.4 Å²	47.4	3%	0.025	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-29.5	165.6	0	0	0	0	0	111.9	W581 L590 D838 V839 L840	W581-A842 HydrophobicContact CH2-CB 4.35Å; W581-A842 HydrophobicContact CZ2-CB 3.87Å; L590-A842 HydrophobicContact CB-CB 4.17Å; L590-A842 HydrophobicContact CD1-CB 4.36Å; D838-A842 PolarHBondContact O-N 3.18Å; D838-A842 VanDerWaalsContact O-N 3.14Å; V839-A842 WeakPolarHBondContact O-CB 3.47Å; V839-A842 PolarHBondContact O-N 2.91Å; L840-A842 PolarHBondContact O-N 3.31Å
843	L	84.9	Confident	82.6	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	25%	0.249	C	C	.	.	S	Bend	trans	-94.7	10	-179.3	-65.6	169.9	0	0	0	114.2	L590 L596 L599 V839 L840 A846 V856 W859 K860	L590-L843 HydrophobicContact CB-CD2 4.19Å; L590-L843 WeakPolarHBondContact O-CD2 3.33Å; L596-L843 HydrophobicContact CD2-CD2 3.54Å; L599-L843 HydrophobicContact CD2-CD1 3.68Å; V839-L843 HydrophobicContact CG1-CD1 3.81Å; V839-L843 HydrophobicContact CG1-CG 4.5Å; V839-L843 WeakPolarHBondContact O-CG 3.5Å; V839-L843 PolarHBondContact O-N 3.23Å; L840-L843 CarbonylContact O-C 3.4Å; L840-L843 PolarHBondContact O-N 3.33Å; L843-A846 HydrophobicContact CD2-CB 4.22Å; L843-A846 PolarHBondContact O-N 2.87Å; L843-V856 HydrophobicContact CD1-CG1 4.27Å; L843-W859 HydrophobicContact CD1-CE3 4.48Å; L843-W859 HydrophobicContact CD1-CH2 4.14Å; L843-W859 HydrophobicContact CD1-CZ3 3.58Å; L843-K860 PolarHBondContact O-NZ 2.99Å
844	E	77.3	Confident	82.7	Confident	158 Å²	158	48.8 Å²	48.8	74%	0.738	26%	0.262	S	S	*	.	S	Bend	trans	-71.7	-34.1	-176.6	-174.4	160.6	-158.9	0	0	112.4	L840	L840-E844 PolarHBondContact O-N 2.98Å
845	C	68.7	Low	82.7	Confident	111 Å²	111	47.8 Å²	47.8	75%	0.75	26%	0.259	S	S	*	.	S	Bend	trans	-88.7	-6.6	173.9	-63.9	0	0	0	0	113.9
846	A	78.7	Confident	82.8	Confident	13 Å²	13	46.8 Å²	46.8	11%	0.107	25%	0.253	C	S	.	.			trans	-95.6	125.9	-174.4	0	0	0	0	0	111.8	L843 K860	L843-A846 HydrophobicContact CD2-CB 4.22Å; L843-A846 PolarHBondContact O-N 2.87Å; A846-K860 PolarHBondContact O-NZ 2.93Å
847	D	77.3	Confident	82.8	Confident	156 Å²	156	50.1 Å²	50.1	83%	0.834	27%	0.269	S	S	*	.			trans	-75.2	136	165.2	-160.6	1.1	0	0	0	109.3
848	V	81.9	Confident	82.8	Confident	9 Å²	9	53.8 Å²	53.8	6%	0.055	28%	0.281	C	S	.	.			trans	-127	91.2	-170.9	179.9	0	0	0	0	108	L596 P850 F853 V856 H857 K860	L596-V848 HydrophobicContact CD2-CG2 3.98Å; V848-P850 VanDerWaalsContact O-CD 3.29Å; V848-P850 WeakPolarHBondContact O-CD 3.38Å; V848-F853 HydrophobicContact CG1-CB 4.03Å; V848-V856 HydrophobicContact CG1-CB 4.24Å; V848-V856 HydrophobicContact CG1-CG1 3.96Å; V848-H857 HydrophobicContact CG1-CB 4.48Å; V848-K860 HydrophobicContact CB-CD 4.4Å; V848-K860 HydrophobicContact CG2-CD 4.03Å
849	D	83.7	Confident	83	Confident	53 Å²	53	53.4 Å²	53.4	28%	0.283	28%	0.279	S	S	.	.			trans	-57.5	115.6	177.6	178.6	-3.7	0	0	0	110.4	H851 Q852 F853	D849-H851 PolarHBondContact O-N 3.28Å; D849-H851 VanDerWaalsContact O-N 3.11Å; D849-H851 WeakPolarHBondContact OD1-CB 3.28Å; D849-H851 IonicContact OD1-CD2 2.65Å; D849-H851 PolarHBondContact OD1-CD2 3.45Å; D849-H851 IonicContact OD1-CG 3.48Å; D849-H851 PolarHBondContact OD1-N 3.5Å; D849-Q852 HydrophobicContact CB-CB 4.16Å; D849-Q852 HydrophobicContact CB-CG 4.36Å; D849-Q852 PolarHBondContact O-N 3.02Å; D849-Q852 VanDerWaalsContact O-N 3.15Å; D849-Q852 WeakPolarHBondContact OD2-CG 3.34Å; D849-Q852 PolarHBondContact OD2-NE2 2.9Å; D849-F853 PolarHBondContact O-N 3.48Å
850	P	83.9	Confident	83	Confident	62 Å²	62	55 Å²	55	40%	0.403	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.2	-179.9	-19.5	30.8	0	0	0	114	V848 H857	V848-P850 VanDerWaalsContact O-CD 3.29Å; V848-P850 WeakPolarHBondContact O-CD 3.38Å; P850-H857 HydrophobicContact CB-CB 4.41Å
851	H	81.2	Confident	83	Confident	173 Å²	173	57.5 Å²	57.5	80%	0.801	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-28.9	178.6	-60.8	-74.4	0	0	0	113	D849	D849-H851 PolarHBondContact O-N 3.28Å; D849-H851 VanDerWaalsContact O-N 3.11Å; D849-H851 WeakPolarHBondContact OD1-CB 3.28Å; D849-H851 IonicContact OD1-CD2 2.65Å; D849-H851 PolarHBondContact OD1-CD2 3.45Å; D849-H851 IonicContact OD1-CG 3.48Å; D849-H851 PolarHBondContact OD1-N 3.5Å
852	Q	84.1	Confident	83.1	Confident	103 Å²	103	57.6 Å²	57.6	48%	0.481	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-37.7	176.8	-71	177.4	72.3	0	0	112.4	D849 P854	D849-Q852 HydrophobicContact CB-CB 4.16Å; D849-Q852 HydrophobicContact CB-CG 4.36Å; D849-Q852 PolarHBondContact O-N 3.02Å; D849-Q852 VanDerWaalsContact O-N 3.15Å; D849-Q852 WeakPolarHBondContact OD2-CG 3.34Å; D849-Q852 PolarHBondContact OD2-NE2 2.9Å; Q852-P854 VanDerWaalsContact C-CD 3.41Å; Q852-P854 WeakPolarHBondContact O-CD 3.48Å
853	F	86.7	Confident	83.1	Confident	9 Å²	9	57.5 Å²	57.5	4%	0.039	30%	0.302	C	S	.	.			trans	-126.2	63.7	-174.4	-55.5	-63.3	0	0	0	112.2	L596 Q597 E600 V848 D849 A855 V856 H857	L596-F853 HydrophobicContact CB-CD1 4.02Å; L596-F853 HydrophobicContact CB-CD2 3.97Å; L596-F853 HydrophobicContact CB-CE1 3.73Å; L596-F853 HydrophobicContact CB-CE2 3.65Å; L596-F853 HydrophobicContact CB-CG 4.14Å; L596-F853 HydrophobicContact CB-CZ 3.52Å; L596-F853 HydrophobicContact CD1-CD2 3.97Å; L596-F853 HydrophobicContact CD1-CE2 3.64Å; L596-F853 HydrophobicContact CD1-CZ 4.29Å; L596-F853 HydrophobicContact CG-CD2 4.46Å; L596-F853 HydrophobicContact CG-CE2 4.26Å; Q597-F853 HydrophobicContact CB-CE1 4.39Å; Q597-F853 HydrophobicContact CG-CE1 3.67Å; Q597-F853 HydrophobicContact CG-CZ 4.07Å; E600-F853 HydrophobicContact CB-CD1 3.99Å; E600-F853 HydrophobicContact CG-CD1 4.34Å; E600-F853 VanDerWaalsContact OE2-CA 3.32Å; E600-F853 WeakPolarHBondContact OE2-CA 3.41Å; V848-F853 HydrophobicContact CG1-CB 4.03Å; D849-F853 PolarHBondContact O-N 3.48Å; F853-A855 PolarHBondContact O-N 2.74Å; F853-V856 HydrophobicContact CB-CB 4.01Å; F853-V856 HydrophobicContact CB-CG2 4.2Å; F853-V856 PolarHBondContact O-N 3.48Å; F853-H857 VanDerWaalsContact O-CB 3.31Å; F853-H857 WeakPolarHBondContact O-CB 3.47Å; F853-H857 PolarHBondContact O-N 3.29Å
854	P	86.6	Confident	83.2	Confident	51 Å²	51	61.7 Å²	61.7	33%	0.331	32%	0.324	S	S	.	.	H	α-helix	trans	-67.8	-31.7	-171.1	28	-36.2	0	0	0	113.7	E600 Q852 R858	E600-P854 VanDerWaalsContact OE1-CD 3.32Å; E600-P854 WeakPolarHBondContact OE1-CD 3.42Å; E600-P854 WeakPolarHBondContact OE1-CG 3.43Å; Q852-P854 VanDerWaalsContact C-CD 3.41Å; Q852-P854 WeakPolarHBondContact O-CD 3.48Å; P854-R858 WeakPolarHBondContact O-CG 3.48Å; P854-R858 PolarHBondContact O-N 3.34Å; P854-R858 PolarHBondContact O-NH1 3.14Å
855	A	83.2	Confident	83.5	Confident	3 Å²	3	58.5 Å²	58.5	3%	0.025	32%	0.318	C	S	.	.	H	α-helix	trans	-76.6	-41.7	175.1	0	0	0	0	0	112.1	E600 L603 T604 F853 H857 R858 W859	E600-A855 VanDerWaalsContact CD-CB 3.5Å; E600-A855 VanDerWaalsContact CD-N 3.28Å; E600-A855 WeakPolarHBondContact OE1-CB 3.46Å; E600-A855 PolarHBondContact OE1-N 3.41Å; E600-A855 WeakPolarHBondContact OE2-CA 3.44Å; E600-A855 WeakPolarHBondContact OE2-CB 3.3Å; E600-A855 PolarHBondContact OE2-N 3.05Å; L603-A855 HydrophobicContact CB-CB 3.84Å; T604-A855 HydrophobicContact CG2-CB 3.91Å; F853-A855 PolarHBondContact O-N 2.74Å; A855-H857 VanDerWaalsContact C-N 3.27Å; A855-H857 PolarHBondContact O-N 2.88Å; A855-R858 PolarHBondContact O-N 3.12Å; A855-W859 WeakPolarHBondContact O-CB 3.32Å; A855-W859 PolarHBondContact O-N 3.23Å
856	V	85.8	Confident	84.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.9	-42.3	171.6	-176.7	0	0	0	0	110	L596 L599 E600 L603 L843 V848 F853 W859 K860	L596-V856 HydrophobicContact CD2-CG1 4.38Å; L599-V856 HydrophobicContact CB-CG2 4.06Å; L599-V856 HydrophobicContact CD2-CG1 3.91Å; L599-V856 HydrophobicContact CD2-CG2 4.04Å; L599-V856 HydrophobicContact CG-CG2 3.97Å; E600-V856 HydrophobicContact CB-CG2 3.97Å; E600-V856 WeakPolarHBondContact OE2-CG2 3.4Å; E600-V856 PolarHBondContact OE2-N 2.95Å; L603-V856 HydrophobicContact CD1-CB 4.45Å; L603-V856 HydrophobicContact CD1-CG2 4.09Å; L843-V856 HydrophobicContact CD1-CG1 4.27Å; V848-V856 HydrophobicContact CG1-CB 4.24Å; V848-V856 HydrophobicContact CG1-CG1 3.96Å; F853-V856 HydrophobicContact CB-CB 4.01Å; F853-V856 HydrophobicContact CB-CG2 4.2Å; F853-V856 PolarHBondContact O-N 3.48Å; V856-W859 HydrophobicContact CG1-CE3 4.49Å; V856-W859 PolarHBondContact O-N 3.28Å; V856-K860 WeakPolarHBondContact O-CB 3.39Å; V856-K860 PolarHBondContact O-N 3.05Å
857	H	85.4	Confident	84.5	Confident	71 Å²	71	57.2 Å²	57.2	33%	0.329	30%	0.302	S	S	.	.	H	α-helix	trans	-63	-46.2	176.1	-175.4	-88.2	0	0	0	112.5	V848 P850 F853 A855 W859 K860 T861	V848-H857 HydrophobicContact CG1-CB 4.48Å; P850-H857 HydrophobicContact CB-CB 4.41Å; F853-H857 VanDerWaalsContact O-CB 3.31Å; F853-H857 WeakPolarHBondContact O-CB 3.47Å; F853-H857 PolarHBondContact O-N 3.29Å; A855-H857 VanDerWaalsContact C-N 3.27Å; A855-H857 PolarHBondContact O-N 2.88Å; H857-W859 PolarHBondContact O-N 3.49Å; H857-K860 PolarHBondContact O-N 3.21Å; H857-T861 PolarHBondContact O-N 3.41Å; H857-T861 PolarHBondContact O-OG1 2.92Å
858	R	85	Confident	84.6	Confident	110 Å²	110	53.9 Å²	53.9	42%	0.415	29%	0.289	S	S	.	.	H	α-helix	trans	-56.2	-48.9	174.3	-79.2	-170.8	-58.3	-78	11.8	111.8	E607 P854 A855 T861 A862	E607-R858 IonicContact OE1-CZ 2.75Å; E607-R858 IonicContact OE1-NE 2.97Å; E607-R858 PolarHBondContact OE1-NE 3.47Å; E607-R858 IonicContact OE1-NH2 3.9Å; E607-R858 PolarHBondContact OE1-NH2 2.92Å; E607-R858 IonicContact OE2-NH2 3.72Å; P854-R858 WeakPolarHBondContact O-CG 3.48Å; P854-R858 PolarHBondContact O-N 3.34Å; P854-R858 PolarHBondContact O-NH1 3.14Å; A855-R858 PolarHBondContact O-N 3.12Å; R858-T861 PolarHBondContact O-N 3.4Å; R858-A862 WeakPolarHBondContact O-CB 3.26Å; R858-A862 PolarHBondContact O-N 3.12Å
859	W	88.9	Confident	84.6	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-62.6	-47.1	177.7	167.3	89.2	0	0	0	111.5	L603 L827 D836 V839 L840 L843 A855 V856 H857 T861 A862 V863	L603-W859 HydrophobicContact CD1-CB 3.82Å; L603-W859 HydrophobicContact CD1-CG 4.13Å; L603-W859 HydrophobicContact CD2-CB 4.34Å; L603-W859 HydrophobicContact CD2-CG 4.3Å; L827-W859 HydrophobicContact CD1-CZ2 4.18Å; D836-W859 HydrophobicContact CB-CZ2 4.24Å; D836-W859 WeakPolarHBondContact O-CZ2 3.45Å; D836-W859 PolarHBondContact OD1-NE1 3.06Å; V839-W859 HydrophobicContact CB-CH2 4.12Å; V839-W859 HydrophobicContact CB-CZ2 4.2Å; V839-W859 HydrophobicContact CG1-CH2 3.62Å; V839-W859 HydrophobicContact CG1-CZ2 3.97Å; V839-W859 HydrophobicContact CG1-CZ3 4.23Å; L840-W859 HydrophobicContact CB-CH2 4.03Å; L840-W859 HydrophobicContact CD1-CH2 4.26Å; L840-W859 HydrophobicContact CD1-CZ3 4.38Å; L843-W859 HydrophobicContact CD1-CE3 4.48Å; L843-W859 HydrophobicContact CD1-CH2 4.14Å; L843-W859 HydrophobicContact CD1-CZ3 3.58Å; A855-W859 WeakPolarHBondContact O-CB 3.32Å; A855-W859 PolarHBondContact O-N 3.23Å; V856-W859 HydrophobicContact CG1-CE3 4.49Å; V856-W859 PolarHBondContact O-N 3.28Å; H857-W859 PolarHBondContact O-N 3.49Å; W859-T861 VanDerWaalsContact C-N 3.31Å; W859-T861 PolarHBondContact O-N 3.12Å; W859-A862 PolarHBondContact O-N 3.42Å; W859-A862 VanDerWaalsContact O-N 3.1Å; W859-V863 HydrophobicContact CD2-CG2 4.28Å; W859-V863 HydrophobicContact CZ2-CG2 3.88Å; W859-V863 WeakPolarHBondContact O-CG2 3.45Å; W859-V863 PolarHBondContact O-N 2.92Å
860	K	86.4	Confident	84.4	Confident	34 Å²	34	59 Å²	59	15%	0.148	32%	0.323	C	S	.	.	H	α-helix	trans	-59.7	-41.2	179.1	-171.5	167.2	-178	171.2	0	110.8	L840 L843 A846 V848 V856 H857 L864	L840-K860 HydrophobicContact CD1-CG 3.94Å; L843-K860 PolarHBondContact O-NZ 2.99Å; A846-K860 PolarHBondContact O-NZ 2.93Å; V848-K860 HydrophobicContact CB-CD 4.4Å; V848-K860 HydrophobicContact CG2-CD 4.03Å; V856-K860 WeakPolarHBondContact O-CB 3.39Å; V856-K860 PolarHBondContact O-N 3.05Å; H857-K860 PolarHBondContact O-N 3.21Å; K860-L864 HydrophobicContact CG-CD1 4.05Å; K860-L864 VanDerWaalsContact O-CB 3.3Å; K860-L864 WeakPolarHBondContact O-CB 3.41Å; K860-L864 WeakPolarHBondContact O-CD1 3.36Å; K860-L864 WeakPolarHBondContact O-CG 3.29Å; K860-L864 PolarHBondContact O-N 3.03Å
861	T	85.1	Confident	84.3	Confident	68 Å²	68	57.7 Å²	57.7	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-63.6	-49.7	172.8	-56.8	0	0	0	0	111.6	H857 R858 W859 V863 L864 C865	H857-T861 PolarHBondContact O-N 3.41Å; H857-T861 PolarHBondContact O-OG1 2.92Å; R858-T861 PolarHBondContact O-N 3.4Å; W859-T861 VanDerWaalsContact C-N 3.31Å; W859-T861 PolarHBondContact O-N 3.12Å; T861-V863 VanDerWaalsContact C-N 3.32Å; T861-V863 PolarHBondContact O-N 3.18Å; T861-L864 PolarHBondContact O-N 2.86Å; T861-L864 VanDerWaalsContact O-N 3.13Å; T861-C865 PolarHBondContact O-N 3.43Å; T861-C865 VanDerWaalsContact O-N 3.09Å; T861-C865 PolarHBondContact O-SG 3.39Å
862	A	84.9	Confident	84.2	Confident	20 Å²	20	55.5 Å²	55.5	17%	0.165	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-35.8	-177.7	0	0	0	0	0	113.4	R858 W859 Y866	R858-A862 WeakPolarHBondContact O-CB 3.26Å; R858-A862 PolarHBondContact O-N 3.12Å; W859-A862 PolarHBondContact O-N 3.42Å; W859-A862 VanDerWaalsContact O-N 3.1Å; A862-Y866 WeakPolarHBondContact O-CD2 3.19Å; A862-Y866 WeakPolarHBondContact O-CE2 3.25Å
863	V	85.8	Confident	84	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-71.2	-40.5	173.6	171.6	0	0	0	0	111.4	F826 D836 L840 W859 T861 C865 Y866 W874	F826-V863 HydrophobicContact CD1-CG2 4.03Å; F826-V863 HydrophobicContact CE1-CG2 4Å; D836-V863 HydrophobicContact CB-CG2 4.09Å; L840-V863 HydrophobicContact CB-CG1 4.34Å; L840-V863 HydrophobicContact CD1-CG1 4.32Å; L840-V863 HydrophobicContact CD2-CG1 3.93Å; L840-V863 HydrophobicContact CG-CG1 4.43Å; W859-V863 HydrophobicContact CD2-CG2 4.28Å; W859-V863 HydrophobicContact CZ2-CG2 3.88Å; W859-V863 WeakPolarHBondContact O-CG2 3.45Å; W859-V863 PolarHBondContact O-N 2.92Å; T861-V863 VanDerWaalsContact C-N 3.32Å; T861-V863 PolarHBondContact O-N 3.18Å; V863-C865 PolarHBondContact O-N 3.33Å; V863-Y866 PolarHBondContact O-N 3.01Å; V863-W874 HydrophobicContact CG1-CH2 3.93Å; V863-W874 HydrophobicContact CG1-CZ3 3.99Å
864	L	85.9	Confident	83.8	Confident	90 Å²	90	55.9 Å²	55.9	47%	0.471	31%	0.311	S	S	.	.	H	α-helix	trans	-70	-15.1	178.5	-74	170.9	0	0	0	114.1	L840 K860 T861 Y866	L840-L864 HydrophobicContact CD1-CD2 4.37Å; L840-L864 HydrophobicContact CD1-CG 4.26Å; L840-L864 HydrophobicContact CD2-CD2 3.98Å; K860-L864 HydrophobicContact CG-CD1 4.05Å; K860-L864 VanDerWaalsContact O-CB 3.3Å; K860-L864 WeakPolarHBondContact O-CB 3.41Å; K860-L864 WeakPolarHBondContact O-CD1 3.36Å; K860-L864 WeakPolarHBondContact O-CG 3.29Å; K860-L864 PolarHBondContact O-N 3.03Å; T861-L864 PolarHBondContact O-N 2.86Å; T861-L864 VanDerWaalsContact O-N 3.13Å; L864-Y866 PolarHBondContact O-N 3.15Å; L864-Y866 VanDerWaalsContact O-N 3.15Å
865	C	85.2	Confident	83.4	Confident	90 Å²	90	57.4 Å²	57.4	61%	0.608	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-10.7	170.6	-66.6	0	0	0	0	114.5	T861 V863	T861-C865 PolarHBondContact O-N 3.43Å; T861-C865 VanDerWaalsContact O-N 3.09Å; T861-C865 PolarHBondContact O-SG 3.39Å; V863-C865 PolarHBondContact O-N 3.33Å
866	Y	83.4	Confident	83	Confident	51 Å²	51	60 Å²	60	20%	0.2	34%	0.339	C	S	.	.	S	Bend	trans	-105.5	144.9	179.1	-63.9	-104.4	0	0	0	111	R824 F826 P832 A862 V863 L864 R871 W874	R824-Y866 PolarHBondContact NH1-OH 3.4Å; F826-Y866 HydrophobicContact CE1-CE2 4.36Å; F826-Y866 AromaticContact CZ-CE2 3.85Å; F826-Y866 HydrophobicContact CZ-CE2 3.85Å; P832-Y866 HydrophobicContact CG-CE1 4.49Å; A862-Y866 WeakPolarHBondContact O-CD2 3.19Å; A862-Y866 WeakPolarHBondContact O-CE2 3.25Å; V863-Y866 PolarHBondContact O-N 3.01Å; L864-Y866 PolarHBondContact O-N 3.15Å; L864-Y866 VanDerWaalsContact O-N 3.15Å; Y866-R871 PolarHBondContact O-NE 3.36Å; Y866-R871 PolarHBondContact O-NH2 2.94Å; Y866-W874 AromaticContact CD1-CZ2 3.9Å; Y866-W874 HydrophobicContact CD1-CZ2 3.9Å; Y866-W874 HydrophobicContact CD2-CH2 4.22Å; Y866-W874 AromaticContact CD2-CZ2 3.8Å; Y866-W874 HydrophobicContact CD2-CZ2 3.8Å; Y866-W874 HydrophobicContact CE1-CZ2 4.35Å; Y866-W874 HydrophobicContact CE2-CZ2 4.29Å; Y866-W874 HydrophobicContact CG-CH2 4.37Å; Y866-W874 AromaticContact CG-CZ2 3.59Å; Y866-W874 HydrophobicContact CG-CZ2 3.59Å
867	S	84.1	Confident	82	Confident	46 Å²	46	62 Å²	62	32%	0.322	35%	0.352	S	S	.	.			trans	-66.3	159.7	179.9	80.9	0	0	0	0	111.4	S869 D870 R871	S867-S869 PolarHBondContact O-N 2.9Å; S867-S869 PolarHBondContact OG-N 3.39Å; S867-D870 WeakPolarHBondContact CB-OD2 3.21Å; S867-D870 PolarHBondContact N-OD2 3.33Å; S867-D870 PolarHBondContact O-N 3.4Å; S867-D870 PolarHBondContact OG-N 3.08Å; S867-D870 VanDerWaalsContact OG-N 3.16Å; S867-D870 PolarHBondContact OG-OD2 3.19Å; S867-R871 PolarHBondContact O-N 3.29Å; S867-R871 PolarHBondContact O-NE 2.86Å
868	P	79.9	Confident	80.2	Confident	87 Å²	87	62.5 Å²	62.5	57%	0.565	37%	0.369	S	S	*	.	H	α-helix	trans	-56.6	-37	175	-24.5	34.8	0	0	0	112.5	R871 Q872	P868-R871 PolarHBondContact O-N 2.8Å; P868-Q872 PolarHBondContact O-N 3.32Å
869	S	80.6	Confident	78.2	Confident	92 Å²	92	62.6 Å²	62.6	64%	0.643	38%	0.381	S	S	*	.	H	α-helix	trans	-66.7	-43.2	177.8	-51.6	0	0	0	0	112.4	S867 Q872 S873	S867-S869 PolarHBondContact O-N 2.9Å; S867-S869 PolarHBondContact OG-N 3.39Å; S869-Q872 PolarHBondContact O-N 3.02Å; S869-S873 PolarHBondContact O-N 3.01Å
870	D	80.3	Confident	75.8	Confident	76 Å²	76	72.7 Å²	72.7	41%	0.406	43%	0.425	S	S	.	.	H	α-helix	trans	-63.8	-45.4	176.8	-53.9	-48.1	0	0	0	110	S867 Q872 S873 W874	S867-D870 WeakPolarHBondContact CB-OD2 3.21Å; S867-D870 PolarHBondContact N-OD2 3.33Å; S867-D870 PolarHBondContact O-N 3.4Å; S867-D870 PolarHBondContact OG-N 3.08Å; S867-D870 VanDerWaalsContact OG-N 3.16Å; S867-D870 PolarHBondContact OG-OD2 3.19Å; D870-Q872 VanDerWaalsContact C-N 3.32Å; D870-Q872 PolarHBondContact O-N 3.48Å; D870-S873 WeakPolarHBondContact O-CB 3.38Å; D870-S873 PolarHBondContact O-N 3.42Å; D870-S873 PolarHBondContact O-OG 3.47Å; D870-W874 PolarHBondContact O-NE1 2.91Å
871	R	82.4	Confident	73.2	Confident	36 Å²	36	73.4 Å²	73.4	14%	0.136	44%	0.442	C	S	.	.	H	α-helix	trans	-57.6	-42.3	178.1	-79.6	-178.4	-87.3	148	-8.1	112.6	Q837 L840 Y866 S867 P868 S873 W874	Q837-R871 HydrophobicContact CG-CB 4.34Å; Q837-R871 PolarHBondContact OE1-O 3.29Å; L840-R871 VanDerWaalsContact CD2-NH1 3.25Å; Y866-R871 PolarHBondContact O-NE 3.36Å; Y866-R871 PolarHBondContact O-NH2 2.94Å; S867-R871 PolarHBondContact O-N 3.29Å; S867-R871 PolarHBondContact O-NE 2.86Å; P868-R871 PolarHBondContact O-N 2.8Å; R871-S873 PolarHBondContact O-N 2.92Å; R871-W874 HydrophobicContact CB-CD2 4.38Å; R871-W874 HydrophobicContact CB-CE3 4.39Å; R871-W874 HydrophobicContact CG-CD2 4.22Å; R871-W874 HydrophobicContact CG-CE3 4.12Å; R871-W874 HydrophobicContact CG-CH2 3.56Å; R871-W874 HydrophobicContact CG-CZ2 3.59Å; R871-W874 HydrophobicContact CG-CZ3 3.81Å; R871-W874 WeakPolarHBondContact O-CB 3.43Å; R871-W874 VanDerWaalsContact O-CG 3.28Å; R871-W874 PolarHBondContact O-N 3.3Å; R871-W874 VanDerWaalsContact O-N 3.17Å
872	Q	78.3	Confident	70.5	Confident	127 Å²	127	79.3 Å²	79.3	59%	0.593	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-3.5	177.9	-160.5	163.8	19.3	0	0	114.2	P868 S869 D870	P868-Q872 PolarHBondContact O-N 3.32Å; S869-Q872 PolarHBondContact O-N 3.02Å; D870-Q872 VanDerWaalsContact C-N 3.32Å; D870-Q872 PolarHBondContact O-N 3.48Å
873	S	79.4	Confident	67.7	Low	92 Å²	92	88.2 Å²	88.2	64%	0.643	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-1.8	170.9	76.7	0	0	0	0	114.3	S869 D870 R871	S869-S873 PolarHBondContact O-N 3.01Å; D870-S873 WeakPolarHBondContact O-CB 3.38Å; D870-S873 PolarHBondContact O-N 3.42Å; D870-S873 PolarHBondContact O-OG 3.47Å; R871-S873 PolarHBondContact O-N 2.92Å
874	W	83.8	Confident	64.9	Low	27 Å²	27	96.9 Å²	96.9	10%	0.102	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-69.2	144	-176.4	-66.8	-9.2	0	0	0	113	P832 S833 D836 Q837 V863 Y866 D870 R871	P832-W874 HydrophobicContact CB-CD2 3.69Å; P832-W874 VanDerWaalsContact CB-CE2 3.45Å; P832-W874 HydrophobicContact CB-CE3 3.87Å; P832-W874 HydrophobicContact CB-CG 4.38Å; P832-W874 HydrophobicContact CB-CH2 3.52Å; P832-W874 HydrophobicContact CB-CZ2 3.37Å; P832-W874 HydrophobicContact CB-CZ3 3.79Å; P832-W874 HydrophobicContact CG-CD2 4.2Å; P832-W874 HydrophobicContact CG-CH2 4.44Å; P832-W874 HydrophobicContact CG-CZ2 3.81Å; S833-W874 VanDerWaalsContact O-CE3 3.3Å; D836-W874 HydrophobicContact CB-CE3 4.34Å; D836-W874 HydrophobicContact CB-CZ3 3.82Å; Q837-W874 HydrophobicContact CB-CE3 4.29Å; V863-W874 HydrophobicContact CG1-CH2 3.93Å; V863-W874 HydrophobicContact CG1-CZ3 3.99Å; Y866-W874 AromaticContact CD1-CZ2 3.9Å; Y866-W874 HydrophobicContact CD1-CZ2 3.9Å; Y866-W874 HydrophobicContact CD2-CH2 4.22Å; Y866-W874 AromaticContact CD2-CZ2 3.8Å; Y866-W874 HydrophobicContact CD2-CZ2 3.8Å; Y866-W874 HydrophobicContact CE1-CZ2 4.35Å; Y866-W874 HydrophobicContact CE2-CZ2 4.29Å; Y866-W874 HydrophobicContact CG-CH2 4.37Å; Y866-W874 AromaticContact CG-CZ2 3.59Å; Y866-W874 HydrophobicContact CG-CZ2 3.59Å; D870-W874 PolarHBondContact O-NE1 2.91Å; R871-W874 HydrophobicContact CB-CD2 4.38Å; R871-W874 HydrophobicContact CB-CE3 4.39Å; R871-W874 HydrophobicContact CG-CD2 4.22Å; R871-W874 HydrophobicContact CG-CE3 4.12Å; R871-W874 HydrophobicContact CG-CH2 3.56Å; R871-W874 HydrophobicContact CG-CZ2 3.59Å; R871-W874 HydrophobicContact CG-CZ3 3.81Å; R871-W874 WeakPolarHBondContact O-CB 3.43Å; R871-W874 VanDerWaalsContact O-CG 3.28Å; R871-W874 PolarHBondContact O-N 3.3Å; R871-W874 VanDerWaalsContact O-N 3.17Å
875	P	78.4	Confident	62	Low	83 Å²	83	98 Å²	98	54%	0.539	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-72.6	139.7	-175	29.1	-35.1	0	0	0	112.5	K834	K834-P875 PolarHBondContact N-O 2.98Å
876	S	73.2	Confident	59.1	Low	57 Å²	57	104.5 Å²	104.5	40%	0.399	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-59.4	134.7	165.8	-62.4	0	0	0	0	109.9	E559 A878	E559-S876 PolarHBondContact OE1-OG 3.1Å; E559-S876 PolarHBondContact OE2-OG 3.22Å; S876-A878 PolarHBondContact O-N 2.97Å
877	P	64.9	Low	56.5	Low	42 Å²	42	109.2 Å²	109.2	27%	0.273	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-55.6	125.3	179.2	-26	33.4	0	0	0	112.6	F828 L835 V879	F828-P877 HydrophobicContact CD1-CB 4.34Å; F828-P877 HydrophobicContact CD2-CB 4.2Å; F828-P877 HydrophobicContact CD2-CG 4.34Å; F828-P877 HydrophobicContact CE1-CB 4.45Å; F828-P877 HydrophobicContact CE2-CB 4.31Å; F828-P877 HydrophobicContact CG-CB 4.21Å; F828-P877 HydrophobicContact CZ-CB 4.43Å; L835-P877 HydrophobicContact CB-CG 3.89Å; P877-V879 PolarHBondContact O-N 3.41Å; P877-V879 VanDerWaalsContact O-N 3.08Å
878	A	47.9	Very low	53.9	Low	83 Å²	83	112.7 Å²	112.7	69%	0.686	61%	0.611	S	S	*	*			trans	-72.3	104.5	177.8	0	0	0	0	0	110.5	S876 K880	S876-A878 PolarHBondContact O-N 2.97Å; A878-K880 PolarHBondContact O-N 3.19Å
879	V	43.8	Very low	51.2	Low	111 Å²	111	116.2 Å²	116.2	67%	0.673	63%	0.625	S	S	*	*			trans	-57.6	99.3	-179.6	-177.3	0	0	0	0	111.2	P877 G881	P877-V879 PolarHBondContact O-N 3.41Å; P877-V879 VanDerWaalsContact O-N 3.08Å; V879-G881 PolarHBondContact O-N 2.88Å
880	K	37.3	Very low	48.8	Very low	215 Å²	215	120.1 Å²	120.1	94%	0.935	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	63.2	172.8	-75.7	-176.9	174.9	175.3	0	110.9	A878	A878-K880 PolarHBondContact O-N 3.19Å
881	G	33.7	Very low	46.3	Very low	49 Å²	49	122.3 Å²	122.3	51%	0.505	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-146	-0.8	-174.5	0	0	0	0	0	116.1	V879 F883	V879-G881 PolarHBondContact O-N 2.88Å; G881-F883 PolarHBondContact O-N 2.69Å
882	K	28.1	Very low	43.6	Very low	191 Å²	191	124.1 Å²	124.1	83%	0.83	69%	0.689	S	S	*	*			trans	-79.6	85.7	178.1	-70.3	-168.7	176.7	-176.8	0	111.8	K884	K882-K884 VanDerWaalsContact C-N 3.34Å; K882-K884 PolarHBondContact O-N 3.13Å
883	F	25.8	Very low	41.5	Very low	207 Å²	207	123.4 Å²	123.4	91%	0.908	70%	0.695	S	S	*	*			trans	-57.1	97.8	158.1	-90.8	-82.3	0	0	0	109.2	G881 S885	G881-F883 PolarHBondContact O-N 2.69Å; F883-S885 PolarHBondContact O-N 3.27Å; F883-S885 VanDerWaalsContact O-N 3.09Å
884	K	26.3	Very low	39	Very low	183 Å²	183	127.5 Å²	127.5	80%	0.796	70%	0.704	S	S	*	*			trans	-68.8	104.5	165.1	-72.4	-175.8	178.1	179.9	0	107.4	K882 R886	K882-K884 VanDerWaalsContact C-N 3.34Å; K882-K884 PolarHBondContact O-N 3.13Å; K884-R886 PolarHBondContact O-N 3.13Å
885	S	25.1	Very low	36.2	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	73%	0.734	S	S	*	*			trans	-62.6	82.8	166.6	39.8	0	0	0	0	109.9	F883 L887	F883-S885 PolarHBondContact O-N 3.27Å; F883-S885 VanDerWaalsContact O-N 3.09Å; S885-L887 PolarHBondContact O-N 3.1Å
886	R	24.9	Very low	33.8	Very low	227 Å²	227	137.2 Å²	137.2	86%	0.857	75%	0.747	S	S	*	*			trans	-66.8	100.6	165.8	-79.8	-172.5	168.3	-155	-1.6	108	K884 P888	K884-R886 PolarHBondContact O-N 3.13Å; R886-P888 WeakPolarHBondContact O-CD 3.49Å
887	L	27.6	Very low	31.7	Very low	150 Å²	150	139.5 Å²	139.5	79%	0.785	76%	0.763	S	S	*	*			trans	-56.9	132.3	154	-105.8	72.3	0	0	0	108	S885 D889	S885-L887 PolarHBondContact O-N 3.1Å; L887-D889 PolarHBondContact O-N 2.85Å
888	P	29.5	Very low	30.5	Very low	118 Å²	118	143.4 Å²	143.4	77%	0.766	79%	0.789	S	S	*	*			trans	-76.6	114	168.4	-12.5	29	0	0	0	109.7	R886 L890	R886-P888 WeakPolarHBondContact O-CD 3.49Å; P888-L890 PolarHBondContact O-N 3.06Å
889	D	24.1	Very low	29.4	Very low	161 Å²	161	143.1 Å²	143.1	86%	0.861	79%	0.794	S	S	*	*			trans	-68.6	124.8	166.2	-79.4	-44.5	0	0	0	110	L887	L887-D889 PolarHBondContact O-N 2.85Å
890	L	30.6	Very low	28.9	Very low	174 Å²	174	149.8 Å²	149.8	91%	0.911	81%	0.807	S	S	*	*			trans	-86.4	139.5	167.9	-72.4	169.9	0	0	0	109.9	P888	P888-L890 PolarHBondContact O-N 3.06Å
891	S	26.7	Very low	28.5	Very low	123 Å²	123	146.7 Å²	146.7	86%	0.86	80%	0.801	S	S	*	*			trans	-110.5	125.6	-159.2	48.9	0	0	0	0	115.7
892	G	25.7	Very low	28.2	Very low	73 Å²	73	149.9 Å²	149.9	75%	0.753	82%	0.815	S	S	*	*			trans	88.6	171	157.2	0	0	0	0	0	117.2
893	P	35	Very low	28.3	Very low	112 Å²	112	145.6 Å²	145.6	73%	0.727	82%	0.815	S	S	*	*			cis	-120.6	151.1	15	14.2	9.8	0	0	0	117.6
894	H	26.9	Very low	28.6	Very low	179 Å²	179	141 Å²	141	83%	0.829	82%	0.815	S	S	*	*			trans	43.9	124.5	146	-49.8	-51.9	0	0	0	123.4
895	S	25.9	Very low	28.8	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	81%	0.812	S	S	*	*				-175.1	130.7	106.4	-82.7	0	0	0	0	116.3
896	Y	26.3	Very low	29	Very low	207 Å²	207	136.2 Å²	136.2	81%	0.812	82%	0.816	S	S	*	*			trans	36.1	102.9	150.8	-63.9	-79.9	0	0	0	124.2
897	S	29.2	Very low	29.3	Very low	105 Å²	105	132.8 Å²	132.8	73%	0.734	82%	0.815	S	S	*	*				64.3	171.8	114	-49.8	0	0	0	0	121.1
898	P	39.3	Very low	30.4	Very low	125 Å²	125	131.8 Å²	131.8	81%	0.812	82%	0.818	S	S	*	*				-137.5	144.6	-80.6	39	-21.1	0	0	0	117.7
899	G	26.7	Very low	30.3	Very low	76 Å²	76	129.9 Å²	129.9	78%	0.784	82%	0.819	S	S	*	*			trans	81.3	137.9	130	0	0	0	0	0	122.1
900	R	32.2	Very low	31	Very low	252 Å²	252	132 Å²	132	95%	0.951	82%	0.821	S	S	*	*			trans	-157.1	156.1	136.3	-123.8	-178.9	178	-152.4	-2.4	111.6
901	N	28.1	Very low	31.8	Very low	150 Å²	150	129.8 Å²	129.8	80%	0.802	82%	0.817	S	S	*	*			trans	-108.1	179.5	-168	-63.8	-7.8	0	0	0	113.3
902	S	29	Very low	31.9	Very low	116 Å²	116	127.3 Å²	127.3	81%	0.811	81%	0.811	S	S	*	*			trans	83.2	118.2	167.1	-51.3	0	0	0	0	115.4
903	A	30.1	Very low	32.8	Very low	100 Å²	100	130.6 Å²	130.6	83%	0.826	82%	0.818	S	S	*	*			cis	99.5	132.1	15.5	0	0	0	0	0	116.5
904	A	32.3	Very low	32.5	Very low	111 Å²	111	128.9 Å²	128.9	92%	0.917	82%	0.822	S	S	*	*			trans	62.6	147.3	177.5	0	0	0	0	0	117.7
905	G	29.3	Very low	33	Very low	71 Å²	71	126.1 Å²	126.1	73%	0.732	82%	0.822	S	S	*	*			cis	173.6	161.9	-9.3	0	0	0	0	0	114.3
906	S	30.5	Very low	34	Very low	124 Å²	124	127.7 Å²	127.7	87%	0.867	83%	0.83	S	S	*	*			trans	57.7	105.2	155.4	-55.2	0	0	0	0	122.7
907	N	30.6	Very low	34.2	Very low	156 Å²	156	121.4 Å²	121.4	83%	0.834	83%	0.828	S	S	*	*				7.7	164.5	120.7	-72.7	-3.6	0	0	0	121.3
908	P	50.6	Low	34.5	Very low	129 Å²	129	127.8 Å²	127.8	84%	0.838	84%	0.836	S	S	*	*			cis	-138.8	-176	-25.9	38.2	-19.6	0	0	0	114.3
909	G	28.4	Very low	34.1	Very low	77 Å²	77	132.7 Å²	132.7	79%	0.794	84%	0.84	S	S	*	*			trans	-172.6	139.7	168.1	0	0	0	0	0	117.4
910	K	37.4	Very low	34.4	Very low	206 Å²	206	134.2 Å²	134.2	90%	0.896	84%	0.839	S	S	*	*			trans	-165.7	169.9	175.1	-109.3	-174.2	-179.5	-179.1	0	108.1
911	P	48.5	Very low	35.5	Very low	128 Å²	128	128.3 Å²	128.3	83%	0.831	83%	0.833	S	S	*	*			cis	-128.5	-175.6	-4.9	40.2	-23.5	0	0	0	114.2
912	G	28.9	Very low	35.5	Very low	71 Å²	71	126.1 Å²	126.1	73%	0.732	84%	0.836	S	S	*	*			trans	-166.5	146.3	168.3	0	0	0	0	0	112.3
913	P	43.1	Very low	35.7	Very low	141 Å²	141	129.8 Å²	129.8	92%	0.916	84%	0.84	S	S	*	*			trans	-106.7	160.8	-167.5	39.6	-34.8	0	0	0	115.6
914	G	29.8	Very low	35.5	Very low	77 Å²	77	128.8 Å²	128.8	79%	0.794	84%	0.839	S	S	*	*			trans	176.5	110.5	168.4	0	0	0	0	0	116.1
915	S	36.5	Very low	35.5	Very low	121 Å²	121	130.4 Å²	130.4	85%	0.846	83%	0.832	S	S	*	*			trans	-147.6	143.6	164.5	-83.1	0	0	0	0	105.9
916	P	48.1	Very low	35.5	Very low	138 Å²	138	135.3 Å²	135.3	90%	0.896	84%	0.836	S	S	*	*				-147.4	-177.2	54.5	41.7	-22.8	0	0	0	115.9
917	G	30	Very low	35.6	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	83%	0.826	S	S	*	*			trans	162.9	134.4	163.6	0	0	0	0	0	113.9
918	R	35.1	Very low	35.7	Very low	239 Å²	239	137.9 Å²	137.9	90%	0.902	82%	0.824	S	S	*	*			trans	-114.6	145.7	169.3	-61.7	-177.2	-178.8	-156.1	1.4	109.2
919	Y	30.2	Very low	34.7	Very low	228 Å²	228	141.3 Å²	141.3	89%	0.894	82%	0.82	S	S	*	*				168	155.1	127.4	-102.5	-79.3	0	0	0	111.1
920	S	32.9	Very low	34.8	Very low	107 Å²	107	145 Å²	145	75%	0.748	82%	0.819	S	S	*	*			trans	-140.8	-179.5	-179.4	-53.2	0	0	0	0	108.8
921	P	55.7	Low	34.4	Very low	129 Å²	129	139.7 Å²	139.7	84%	0.838	81%	0.813	S	S	*	*				-123.7	176.8	-57.3	37.3	-23.7	0	0	0	111.8
922	A	28.9	Very low	33.6	Very low	104 Å²	104	144 Å²	144	86%	0.86	81%	0.813	S	S	*	*			trans	-146	158.8	171.7	0	0	0	0	0	113.6
923	H	33	Very low	33.5	Very low	192 Å²	192	147.4 Å²	147.4	89%	0.889	81%	0.813	S	S	*	*			trans	-92.5	162.9	-174	-90.7	1.3	0	0	0	114.9
924	G	26.9	Very low	32.9	Very low	79 Å²	79	145.8 Å²	145.8	81%	0.814	81%	0.812	S	S	*	*			trans	-161	80.8	167.9	0	0	0	0	0	114
925	N	30.6	Very low	33	Very low	145 Å²	145	150 Å²	150	78%	0.775	81%	0.811	S	S	*	*			trans	-90.7	149.4	169.3	-84.5	-31.2	0	0	0	110.9
926	Q	30.2	Very low	32.7	Very low	175 Å²	175	151.4 Å²	151.4	82%	0.818	81%	0.808	S	S	*	*				173.9	167.2	125.2	-99.9	-177.4	9.4	0	0	115.8
927	L	31.5	Very low	31.8	Very low	124 Å²	124	150 Å²	150	65%	0.649	81%	0.808	S	S	*	*			trans	77.5	138.2	170.2	-45.2	-175	0	0	0	115.1
928	R	32.6	Very low	32.2	Very low	209 Å²	209	150.8 Å²	150.8	79%	0.789	81%	0.808	S	S	*	*			cis	-163.1	176.5	-2.7	-111.1	167.1	-171.1	157.3	5.5	106.6
929	R	30.8	Very low	32.2	Very low	201 Å²	201	151.3 Å²	151.3	76%	0.758	83%	0.827	S	S	*	*			cis	-163	151.9	9.7	-142.9	-170.3	175.7	169.6	-2.5	109.3
930	M	29.7	Very low	32.3	Very low	156 Å²	156	147.5 Å²	147.5	77%	0.768	82%	0.824	S	S	*	*			trans	68.3	130.8	160.4	-52	-167.7	-56.8	0	0	117.2
931	A	30	Very low	32.2	Very low	93 Å²	93	149.6 Å²	149.6	77%	0.769	83%	0.828	S	S	*	*			cis	83.2	139.4	43.3	0	0	0	0	0	113.1
932	R	30.7	Very low	30.9	Very low	219 Å²	219	150.8 Å²	150.8	83%	0.826	83%	0.827	S	S	*	*			cis	-169.2	158.2	-12.5	-133.9	-170.6	-179.4	-166.8	2.2	107.4
933	L	28	Very low	31.1	Very low	142 Å²	142	153.5 Å²	153.5	74%	0.743	83%	0.825	S	S	*	*			trans	50.1	109.3	154.7	-63	169.2	0	0	0	120.1
934	A	29.4	Very low	30.9	Very low	108 Å²	108	151.1 Å²	151.1	89%	0.893	82%	0.821	S	S	*	*				-153.2	157	119.6	0	0	0	0	0	108.3
935	E	32.2	Very low	31.2	Very low	165 Å²	165	155.9 Å²	155.9	77%	0.771	82%	0.822	S	S	*	*			trans	-138.4	165.2	-166	-138.7	-176.2	160.5	0	0	111.4
936	L	30	Very low	31.2	Very low	150 Å²	150	156.7 Å²	156.7	79%	0.785	83%	0.825	S	S	*	*			trans	56.6	102.8	159.2	-60.9	169.1	0	0	0	118.9
937	A	30	Very low	31.3	Very low	108 Å²	108	155.3 Å²	155.3	89%	0.893	83%	0.825	S	S	*	*				-148.3	141.7	106.1	0	0	0	0	0	108.3
938	A	37.4	Very low	31.3	Very low	94 Å²	94	157.9 Å²	157.9	78%	0.777	84%	0.84	S	S	*	*			trans	-119.4	137.9	-174.3	0	0	0	0	0	111.7
939	L	34.9	Very low	31.2	Very low	250 Å²	250	153.3 Å²	153.3	100%	1.309	85%	0.845	S	S	*	*			trans	-159	0	134.2	-104.2	166.3	0	0	0	108.9

Retrieved 939 of 939 residues in 600.7 ms (Link to these results)

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