A0A087YAF2_POEFO Loading...

Leucine zipper like post translational regulator 1

AlphaFold DB , UniProt , Accession A0A087YAF2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 780 aa.

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(Predicted Aligned Error values between residue pairs)

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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	39.7	Very low	26.1	Very low	249 Å²	249	141.8 Å²	141.8	100%	1.227	83%	0.826	S	S	*	*				0	113.6	0	-67.7	-173.4	-150.1	0	0	108.2
2	S	25.1	Very low	26.1	Very low	120 Å²	120	140.5 Å²	140.5	84%	0.839	82%	0.82	S	S	*	*			trans	165.4	117.5	152.9	-176.4	0	0	0	0	108.1
3	C	25.1	Very low	25.7	Very low	124 Å²	124	139.3 Å²	139.3	84%	0.838	81%	0.809	S	S	*	*			trans	-65.8	139.9	175.9	-64.8	0	0	0	0	111.7
4	K	25.1	Very low	25.7	Very low	209 Å²	209	142.5 Å²	142.5	91%	0.909	81%	0.809	S	S	*	*			trans	-122.6	111	153.8	-80.2	-173.1	176.2	-177.2	0	107.2
5	S	24.2	Very low	25.6	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	81%	0.805	S	S	*	*			trans	-94.6	114.2	173.3	173.8	0	0	0	0	107.8
6	T	25.2	Very low	25.7	Very low	131 Å²	131	145.4 Å²	145.4	80%	0.804	81%	0.81	S	S	*	*			trans	-83.2	113.3	166.8	26	0	0	0	0	108.3	V8	T6-V8 PolarHBondContact O-N 3.3Å
7	K	25.5	Very low	25.7	Very low	200 Å²	200	141.8 Å²	141.8	87%	0.87	80%	0.797	S	S	*	*			trans	-81	112.3	170.3	-80.2	-175.6	175	-178	0	109.1
8	V	26.5	Very low	26	Very low	133 Å²	133	140.4 Å²	140.4	81%	0.806	80%	0.796	S	S	*	*			trans	-82.6	141.9	165.5	179	0	0	0	0	107.8	T6	T6-V8 PolarHBondContact O-N 3.3Å
9	A	24.1	Very low	25.9	Very low	78 Å²	78	137.7 Å²	137.7	65%	0.645	79%	0.787	S	S	*	*			trans	-62.1	152.4	175.8	0	0	0	0	0	111.3	S11	A9-S11 PolarHBondContact O-N 3.32Å
10	P	23.4	Very low	25.9	Very low	130 Å²	130	139 Å²	139	84%	0.844	79%	0.792	S	S	*	*			trans	-69.9	106.5	179.4	28.2	-30.2	0	0	0	109.6
11	S	23.3	Very low	25.9	Very low	77 Å²	77	135.4 Å²	135.4	54%	0.538	78%	0.775	S	S	.	*			trans	-65.4	132.6	157.8	42.6	0	0	0	0	108	A9 D13	A9-S11 PolarHBondContact O-N 3.32Å; S11-D13 PolarHBondContact O-N 3.11Å; S11-D13 PolarHBondContact OG-OD2 3.22Å
12	V	25.6	Very low	25.6	Very low	126 Å²	126	130.1 Å²	130.1	76%	0.764	76%	0.756	S	S	*	*			trans	-77.7	80.7	163.3	-171.8	0	0	0	0	105.7	F14	V12-F14 HydrophobicContact CG1-CE2 4.4Å; V12-F14 PolarHBondContact O-N 2.85Å
13	D	21.9	Very low	26.1	Very low	125 Å²	125	131.9 Å²	131.9	67%	0.668	75%	0.751	S	S	*	*			trans	-72.4	109.9	171.2	-73	-45	0	0	0	107.8	S11 D15	S11-D13 PolarHBondContact O-N 3.11Å; S11-D13 PolarHBondContact OG-OD2 3.22Å; D13-D15 PolarHBondContact O-N 3.28Å; D13-D15 VanDerWaalsContact O-N 3.13Å
14	F	25.6	Very low	26.9	Very low	184 Å²	184	134.5 Å²	134.5	81%	0.807	75%	0.745	S	S	*	*			trans	-70.7	99.9	161.2	-87.6	-88.1	0	0	0	106.8	V12 H16	V12-F14 HydrophobicContact CG1-CE2 4.4Å; V12-F14 PolarHBondContact O-N 2.85Å; F14-H16 PolarHBondContact O-N 2.76Å; F14-H16 VanDerWaalsContact O-N 3.1Å
15	D	23.3	Very low	28	Very low	142 Å²	142	127 Å²	127	76%	0.759	71%	0.714	S	S	*	*			trans	-60.5	111.1	176.4	-119.9	-19.3	0	0	0	109.7	D13 S17	D13-D15 PolarHBondContact O-N 3.28Å; D13-D15 VanDerWaalsContact O-N 3.13Å; D15-S17 PolarHBondContact O-N 3.15Å
16	H	27.7	Very low	29.2	Very low	189 Å²	189	126 Å²	126	88%	0.875	70%	0.704	S	S	*	*			trans	-83.5	49.5	167.1	-82.2	-62.2	0	0	0	110.5	F14	F14-H16 PolarHBondContact O-N 2.76Å; F14-H16 VanDerWaalsContact O-N 3.1Å
17	S	25	Very low	30.7	Very low	85 Å²	85	120 Å²	120	59%	0.594	67%	0.667	S	S	*	*			trans	-94.4	103.1	169.7	63	0	0	0	0	109.3	D15 S19	D15-S17 PolarHBondContact O-N 3.15Å; S17-S19 PolarHBondContact O-N 3.45Å
18	C	31.1	Very low	31.9	Very low	116 Å²	116	117.1 Å²	117.1	78%	0.784	66%	0.661	S	S	*	*			trans	-55.8	103.3	167	-171.2	0	0	0	0	109.3
19	S	24.5	Very low	33	Very low	89 Å²	89	112.5 Å²	112.5	62%	0.622	63%	0.63	S	S	*	*			trans	-85.5	117.6	164.4	-179.9	0	0	0	0	107.9	S17 S21	S17-S19 PolarHBondContact O-N 3.45Å; S19-S21 PolarHBondContact O-N 3.47Å; S19-S21 PolarHBondContact OG-OG 3.34Å
20	D	25.9	Very low	34.2	Very low	164 Å²	164	110.7 Å²	110.7	88%	0.877	62%	0.619	S	S	*	*	S	Bend	trans	-69.4	51.3	173.6	-83.3	-31.7	0	0	0	112.5
21	S	26.7	Very low	35.3	Very low	63 Å²	63	110.9 Å²	110.9	44%	0.441	62%	0.62	S	S	.	*			trans	-133.1	100.2	170.2	52.7	0	0	0	0	106.6	S19 E23	S19-S21 PolarHBondContact O-N 3.47Å; S19-S21 PolarHBondContact OG-OG 3.34Å; S21-E23 PolarHBondContact O-N 3.41Å
22	V	32.3	Very low	36.8	Very low	138 Å²	138	113 Å²	113	84%	0.836	62%	0.62	S	S	*	*			trans	-61.5	87.1	168	-179	0	0	0	0	106.6	Y24	V22-Y24 PolarHBondContact O-N 3.28Å
23	E	35.1	Very low	38.6	Very low	157 Å²	157	109.5 Å²	109.5	73%	0.734	60%	0.595	S	S	*	*			trans	-63.2	107.8	169.4	-80.1	-174.9	155.4	0	0	106.5	S21 L25	S21-E23 PolarHBondContact O-N 3.41Å; E23-L25 PolarHBondContact O-N 2.84Å
24	Y	42.3	Very low	41.1	Very low	179 Å²	179	104.7 Å²	104.7	70%	0.702	57%	0.571	S	S	*	*			trans	-43.1	131.6	162.8	-65	-86.4	0	0	0	108.5	V22 T26	V22-Y24 PolarHBondContact O-N 3.28Å; Y24-T26 VanDerWaalsContact C-N 3.31Å; Y24-T26 PolarHBondContact O-N 3.35Å
25	L	49.7	Very low	43.9	Very low	51 Å²	51	97.2 Å²	97.2	27%	0.267	54%	0.54	S	S	.	.			trans	-37.4	82.3	-178.2	-74.3	158.4	0	0	0	114	E23 L27 F683 A684	E23-L25 PolarHBondContact O-N 2.84Å; L25-L27 PolarHBondContact O-N 3.43Å; L25-L27 VanDerWaalsContact O-N 3.16Å; L25-F683 HydrophobicContact CD2-CD1 3.31Å; L25-F683 HydrophobicContact CD2-CE1 3.73Å; L25-F683 HydrophobicContact CD2-CG 4.37Å; L25-A684 HydrophobicContact CD2-CB 4.41Å
26	T	48.9	Very low	47	Very low	88 Å²	88	92.4 Å²	92.4	54%	0.54	51%	0.513	S	S	.	.			trans	-79.7	99.8	167.9	48.8	0	0	0	0	106.7	Y24 N28 D727	Y24-T26 VanDerWaalsContact C-N 3.31Å; Y24-T26 PolarHBondContact O-N 3.35Å; T26-N28 PolarHBondContact O-N 3.23Å; T26-D727 WeakPolarHBondContact CA-OD2 3.21Å
27	L	57.3	Low	50.1	Low	7 Å²	7	86 Å²	86	4%	0.037	48%	0.481	C	S	.	.			trans	-74.5	82.1	174.7	-69.3	164.2	0	0	0	107.2	L25 F29 L680 F683 A725 D727 M728	L25-L27 PolarHBondContact O-N 3.43Å; L25-L27 VanDerWaalsContact O-N 3.16Å; L27-F29 VanDerWaalsContact C-N 3.25Å; L27-F29 HydrophobicContact CB-CD2 3.95Å; L27-F29 HydrophobicContact CB-CE2 3.36Å; L27-F29 HydrophobicContact CB-CZ 3.72Å; L27-F29 HydrophobicContact CD1-CE2 4.03Å; L27-F29 HydrophobicContact CD1-CZ 3.99Å; L27-F29 HydrophobicContact CD2-CZ 4.25Å; L27-F29 HydrophobicContact CG-CE2 4.23Å; L27-F29 HydrophobicContact CG-CZ 4.22Å; L27-F29 WeakPolarHBondContact O-CD2 3.29Å; L27-F29 PolarHBondContact O-N 3Å; L27-L680 HydrophobicContact CD1-CD2 4.29Å; L27-F683 HydrophobicContact CD2-CD1 4.06Å; L27-F683 HydrophobicContact CD2-CD2 3.77Å; L27-F683 HydrophobicContact CD2-CE1 3.61Å; L27-F683 HydrophobicContact CD2-CE2 3.33Å; L27-F683 HydrophobicContact CD2-CG 4.1Å; L27-F683 HydrophobicContact CD2-CZ 3.25Å; L27-A725 HydrophobicContact CD1-CB 4.15Å; L27-D727 HydrophobicContact CB-CB 4.41Å; L27-D727 PolarHBondContact N-OD2 2.9Å; L27-M728 HydrophobicContact CD1-CB 3.82Å; L27-M728 HydrophobicContact CD1-CE 4.3Å
28	N	49.9	Very low	53.5	Low	138 Å²	138	82 Å²	82	74%	0.738	45%	0.453	S	S	*	.			trans	-73.8	86.2	176.7	-132	-13.7	0	0	0	108.5	T26 G30 K701	T26-N28 PolarHBondContact O-N 3.23Å; N28-G30 PolarHBondContact O-N 2.93Å; N28-K701 PolarHBondContact O-NZ 2.79Å
29	F	50	Low	56.5	Low	36 Å²	36	80.1 Å²	80.1	16%	0.158	43%	0.429	C	S	.	.			trans	-72.6	112.8	171.5	-63.9	-70.8	0	0	0	107.7	L27 F32 K701 E705 M728	L27-F29 VanDerWaalsContact C-N 3.25Å; L27-F29 HydrophobicContact CB-CD2 3.95Å; L27-F29 HydrophobicContact CB-CE2 3.36Å; L27-F29 HydrophobicContact CB-CZ 3.72Å; L27-F29 HydrophobicContact CD1-CE2 4.03Å; L27-F29 HydrophobicContact CD1-CZ 3.99Å; L27-F29 HydrophobicContact CD2-CZ 4.25Å; L27-F29 HydrophobicContact CG-CE2 4.23Å; L27-F29 HydrophobicContact CG-CZ 4.22Å; L27-F29 WeakPolarHBondContact O-CD2 3.29Å; L27-F29 PolarHBondContact O-N 3Å; F29-F32 HydrophobicContact CB-CD1 4.43Å; F29-F32 HydrophobicContact CB-CE1 3.47Å; F29-F32 VanDerWaalsContact CB-CE1 3.47Å; F29-F32 HydrophobicContact CB-CE2 4.4Å; F29-F32 HydrophobicContact CB-CZ 3.45Å; F29-F32 VanDerWaalsContact CB-CZ 3.45Å; F29-F32 AromaticContact CD1-CE1 3.9Å; F29-F32 HydrophobicContact CD1-CE1 3.9Å; F29-F32 HydrophobicContact CD2-CE1 4.47Å; F29-F32 HydrophobicContact CD2-CZ 4.46Å; F29-F32 AromaticContact CG-CE1 3.71Å; F29-F32 HydrophobicContact CG-CE1 3.71Å; F29-F32 AromaticContact CG-CZ 3.95Å; F29-F32 HydrophobicContact CG-CZ 3.95Å; F29-K701 HydrophobicContact CD1-CG 4.28Å; F29-K701 HydrophobicContact CE1-CG 3.91Å; F29-E705 HydrophobicContact CD1-CG 3.43Å; F29-E705 VanDerWaalsContact CD1-CG 3.43Å; F29-E705 VanDerWaalsContact CD1-OE1 3.26Å; F29-E705 WeakPolarHBondContact CD1-OE1 3.46Å; F29-E705 HydrophobicContact CE1-CG 3.52Å; F29-M728 HydrophobicContact CE1-CE 4.43Å; F29-M728 HydrophobicContact CE2-CE 3.59Å; F29-M728 HydrophobicContact CZ-CE 3.33Å
30	G	48	Very low	60	Low	40 Å²	40	81.9 Å²	81.9	41%	0.412	42%	0.422	S	S	.	.			trans	-66.1	-176	167.9	0	0	0	0	0	110.8	N28 F32	N28-G30 PolarHBondContact O-N 2.93Å; G30-F32 PolarHBondContact O-N 3.2Å
31	P	46.5	Very low	63.4	Low	134 Å²	134	75.2 Å²	75.2	87%	0.87	39%	0.386	S	S	*	.	S	Bend	trans	-57.5	117.9	174.8	22.6	-30.3	0	0	0	110.4	E33	P31-E33 PolarHBondContact O-N 3.45Å
32	F	55.2	Low	66.7	Low	121 Å²	121	75.2 Å²	75.2	53%	0.531	39%	0.385	S	S	.	.			trans	-64.3	111.6	-174	-56.5	-86.1	0	0	0	111.4	F29 G30 E705	F29-F32 HydrophobicContact CB-CD1 4.43Å; F29-F32 HydrophobicContact CB-CE1 3.47Å; F29-F32 VanDerWaalsContact CB-CE1 3.47Å; F29-F32 HydrophobicContact CB-CE2 4.4Å; F29-F32 HydrophobicContact CB-CZ 3.45Å; F29-F32 VanDerWaalsContact CB-CZ 3.45Å; F29-F32 AromaticContact CD1-CE1 3.9Å; F29-F32 HydrophobicContact CD1-CE1 3.9Å; F29-F32 HydrophobicContact CD2-CE1 4.47Å; F29-F32 HydrophobicContact CD2-CZ 4.46Å; F29-F32 AromaticContact CG-CE1 3.71Å; F29-F32 HydrophobicContact CG-CE1 3.71Å; F29-F32 AromaticContact CG-CZ 3.95Å; F29-F32 HydrophobicContact CG-CZ 3.95Å; G30-F32 PolarHBondContact O-N 3.2Å; F32-E705 HydrophobicContact CD1-CB 4.25Å; F32-E705 HydrophobicContact CD1-CG 3.98Å; F32-E705 HydrophobicContact CE1-CG 4.06Å
33	E	63.7	Low	69.6	Low	54 Å²	54	71.5 Å²	71.5	25%	0.252	36%	0.364	S	S	.	.			trans	-130.3	120.7	172.5	-160.8	161.8	-154.4	0	0	111.8	P31 V35 R39 R350 Q352	P31-E33 PolarHBondContact O-N 3.45Å; E33-V35 PolarHBondContact O-N 3.4Å; E33-R39 IonicContact OE1-CZ 2.6Å; E33-R39 VanDerWaalsContact OE1-CZ 3.28Å; E33-R39 IonicContact OE1-NE 3.83Å; E33-R39 IonicContact OE1-NH1 3.13Å; E33-R39 PolarHBondContact OE1-NH1 3.4Å; E33-R39 IonicContact OE1-NH2 3.85Å; E33-R350 IonicContact OE1-CZ 3.58Å; E33-R350 IonicContact OE1-NH1 2.62Å; E33-R350 PolarHBondContact OE1-NH1 3.26Å; E33-R350 IonicContact OE1-NH2 2.83Å; E33-R350 IonicContact OE2-CZ 3.48Å; E33-R350 VanDerWaalsContact OE2-CZ 3.24Å; E33-R350 IonicContact OE2-NH1 2.56Å; E33-R350 PolarHBondContact OE2-NH1 3.46Å; E33-R350 IonicContact OE2-NH2 3.03Å; E33-R350 PolarHBondContact OE2-NH2 3.45Å; E33-Q352 HydrophobicContact CG-CG 4.2Å; E33-Q352 PolarHBondContact OE2-OE1 3.03Å
34	T	73.9	Confident	72.4	Confident	24 Å²	24	64.4 Å²	64.4	15%	0.147	33%	0.331	C	S	.	.			trans	-56.4	119.7	175.9	-50.3	0	0	0	0	110.6	R37 Q352 M706	T34-R37 HydrophobicContact CG2-CB 4.34Å; T34-R37 WeakPolarHBondContact O-CB 3.49Å; T34-Q352 WeakPolarHBondContact O-CB 3.47Å; T34-Q352 WeakPolarHBondContact O-CG 3.36Å; T34-M706 HydrophobicContact CG2-CE 3.41Å; T34-M706 VanDerWaalsContact CG2-CE 3.41Å; T34-M706 HydrophobicContact CG2-SD 4.13Å; T34-M706 WeakPolarHBondContact OG1-CE 3.29Å
35	V	84.4	Confident	74.8	Confident	27 Å²	27	60 Å²	60	16%	0.164	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	157.5	173.7	-60.8	0	0	0	0	111.9	E33 R37 Y356	E33-V35 PolarHBondContact O-N 3.4Å; V35-R37 PolarHBondContact O-N 2.97Å; V35-R37 VanDerWaalsContact O-N 3.09Å; V35-Y356 VanDerWaalsContact CG1-OH 3.23Å; V35-Y356 WeakPolarHBondContact CG1-OH 3.36Å; V35-Y356 HydrophobicContact CG2-CE2 4.3Å; V35-Y356 WeakPolarHBondContact CG2-OH 3.24Å
36	H	89.8	Confident	76.7	Confident	40 Å²	40	63.7 Å²	63.7	19%	0.185	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	22.2	-178.6	-54.4	162.9	0	0	0	113.5	I308 P310 S311 F351 Q352 S354	H36-I308 HydrophobicContact CB-CG2 3.91Å; H36-P310 VanDerWaalsContact O-CA 3.29Å; H36-P310 WeakPolarHBondContact O-CA 3.35Å; H36-S311 PolarHBondContact O-N 3.11Å; H36-S311 VanDerWaalsContact O-N 3.11Å; H36-F351 VanDerWaalsContact CA-CE2 3.49Å; H36-F351 HydrophobicContact CB-CE2 4.19Å; H36-F351 HydrophobicContact CB-CZ 4.14Å; H36-F351 AromaticContact CD2-CZ 3.91Å; H36-Q352 WeakPolarHBondContact CA-O 3.47Å; H36-Q352 PolarHBondContact N-O 3.19Å; H36-S354 VanDerWaalsContact NE2-CB 3.26Å; H36-S354 WeakPolarHBondContact NE2-CB 3.4Å; H36-S354 PolarHBondContact NE2-OG 3.41Å
37	R	91.5	Very high	78.7	Confident	56 Å²	56	66.9 Å²	66.9	21%	0.211	34%	0.343	C	S	.	.			trans	-91.1	128.8	177.6	-174.4	171.8	175	-179	-0.5	110.9	T34 V35 R39 S311 D313 S314 F351 Q352	T34-R37 HydrophobicContact CG2-CB 4.34Å; T34-R37 WeakPolarHBondContact O-CB 3.49Å; V35-R37 PolarHBondContact O-N 2.97Å; V35-R37 VanDerWaalsContact O-N 3.09Å; R37-R39 HydrophobicContact CG-CG 4.22Å; R37-S311 WeakPolarHBondContact CA-OG 3.4Å; R37-S311 WeakPolarHBondContact CB-OG 3.18Å; R37-S311 WeakPolarHBondContact CG-OG 3.4Å; R37-D313 WeakPolarHBondContact CD-OD2 3.5Å; R37-D313 IonicContact CZ-OD2 2.73Å; R37-D313 PolarHBondContact NE-O 3.32Å; R37-D313 IonicContact NE-OD1 3.72Å; R37-D313 IonicContact NE-OD2 2.77Å; R37-D313 PolarHBondContact NE-OD2 3.41Å; R37-D313 VanDerWaalsContact NE-OD2 3.11Å; R37-D313 IonicContact NH1-OD2 3.62Å; R37-D313 PolarHBondContact NH1-OD2 3.01Å; R37-D313 IonicContact NH2-OD2 3.53Å; R37-S314 WeakPolarHBondContact CA-OG 3.47Å; R37-F351 WeakPolarHBondContact O-CA 3.44Å; R37-Q352 PolarHBondContact O-N 3.29Å
38	W	95.9	Very high	80.4	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	134.9	163.4	-70.7	91.1	0	0	0	110.4	F283 L295 S314 E315 M316 P317 M332 I334 R350 F351	W38-F283 HydrophobicContact CH2-CD1 4.48Å; W38-F283 HydrophobicContact CH2-CD2 4.09Å; W38-F283 HydrophobicContact CH2-CE2 4.14Å; W38-F283 HydrophobicContact CH2-CG 4.27Å; W38-F283 HydrophobicContact CH2-CZ 4.41Å; W38-F283 AromaticContact CZ2-CD2 3.83Å; W38-F283 HydrophobicContact CZ2-CD2 3.83Å; W38-F283 AromaticContact CZ2-CE2 3.87Å; W38-F283 HydrophobicContact CZ2-CE2 3.87Å; W38-F283 HydrophobicContact CZ2-CG 4.42Å; W38-L295 HydrophobicContact CZ2-CD1 4.42Å; W38-L295 HydrophobicContact CZ2-CD2 4.14Å; W38-S314 PolarHBondContact N-OG 3.36Å; W38-S314 WeakPolarHBondContact O-CA 3.32Å; W38-E315 WeakPolarHBondContact CB-O 3.39Å; W38-E315 PolarHBondContact O-N 3.39Å; W38-M316 HydrophobicContact CB-SD 4.24Å; W38-M316 HydrophobicContact CG-SD 3.84Å; W38-P317 HydrophobicContact CD2-CG 3.89Å; W38-P317 HydrophobicContact CE3-CG 3.49Å; W38-P317 VanDerWaalsContact CE3-CG 3.49Å; W38-P317 HydrophobicContact CH2-CG 4.1Å; W38-P317 HydrophobicContact CZ2-CG 4.47Å; W38-P317 HydrophobicContact CZ3-CG 3.61Å; W38-M332 HydrophobicContact CH2-CE 3.44Å; W38-M332 VanDerWaalsContact CH2-CE 3.44Å; W38-M332 HydrophobicContact CZ2-CE 3.87Å; W38-M332 HydrophobicContact CZ3-CE 4.3Å; W38-I334 HydrophobicContact CH2-CD1 3.93Å; W38-I334 HydrophobicContact CH2-CG2 4.33Å; W38-I334 HydrophobicContact CZ3-CD1 3.64Å; W38-I334 HydrophobicContact CZ3-CG1 3.95Å; W38-I334 HydrophobicContact CZ3-CG2 4.39Å; W38-R350 CarbonylContact C-O 3.58Å; W38-R350 WeakPolarHBondContact CA-O 3.46Å; W38-F351 AromaticContact CD1-CD2 3.54Å; W38-F351 AromaticContact CD1-CE2 3.95Å; W38-F351 HydrophobicContact CD2-CB 3.84Å; W38-F351 AromaticContact CD2-CD2 3.67Å; W38-F351 HydrophobicContact CD2-CD2 3.67Å; W38-F351 HydrophobicContact CD2-CG 4.17Å; W38-F351 AromaticContact CE2-CD2 3.34Å; W38-F351 AromaticContact CE2-CG 3.87Å; W38-F351 HydrophobicContact CE3-CB 3.68Å; W38-F351 HydrophobicContact CE3-CD2 4.4Å; W38-F351 HydrophobicContact CE3-CG 4.48Å; W38-F351 AromaticContact CG-CD2 3.84Å; W38-F351 HydrophobicContact CG-CD2 3.84Å; W38-F351 HydrophobicContact CH2-CB 3.82Å; W38-F351 HydrophobicContact CH2-CG 4.35Å; W38-F351 HydrophobicContact CZ2-CB 3.93Å; W38-F351 AromaticContact CZ2-CD2 3.88Å; W38-F351 HydrophobicContact CZ2-CD2 3.88Å; W38-F351 AromaticContact CZ2-CG 3.98Å; W38-F351 HydrophobicContact CZ2-CG 3.98Å; W38-F351 HydrophobicContact CZ3-CB 3.67Å; W38-F351 AromaticContact NE1-CD2 3.24Å; W38-F351 AromaticContact NE1-CE2 3.6Å
39	R	95.6	Very high	82.5	Confident	77 Å²	77	60.8 Å²	60.8	29%	0.291	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	133.3	170.5	-67.7	-177.3	179.7	172.5	-2.8	109.3	E33 R37 Y349 R350	E33-R39 IonicContact OE1-CZ 2.6Å; E33-R39 VanDerWaalsContact OE1-CZ 3.28Å; E33-R39 IonicContact OE1-NE 3.83Å; E33-R39 IonicContact OE1-NH1 3.13Å; E33-R39 PolarHBondContact OE1-NH1 3.4Å; E33-R39 IonicContact OE1-NH2 3.85Å; R37-R39 HydrophobicContact CG-CG 4.22Å; R39-Y349 CarbonylContact O-C 3.54Å; R39-Y349 WeakPolarHBondContact O-CA 3.32Å; R39-R350 PolarHBondContact N-O 2.82Å; R39-R350 PolarHBondContact O-N 2.99Å
40	R	97	Very high	84.7	Confident	125 Å²	125	60.3 Å²	60.3	47%	0.472	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	127.3	170.6	-167.7	-179.6	-170.3	-166.9	5.4	108.2	E315 E347 Y349	R40-E315 HydrophobicContact CB-CB 4.23Å; R40-E315 VanDerWaalsContact CB-OE2 3.25Å; R40-E315 WeakPolarHBondContact CB-OE2 3.47Å; R40-E315 PolarHBondContact N-OE2 3.18Å; R40-E347 IonicContact CZ-OE1 3.74Å; R40-E347 IonicContact NE-OE1 2.79Å; R40-E347 IonicContact NH2-OE1 2.84Å; R40-E347 PolarHBondContact NH2-OE1 3.09Å; R40-Y349 HydrophobicContact CB-CD1 4.03Å; R40-Y349 HydrophobicContact CB-CE1 3.82Å; R40-Y349 HydrophobicContact CG-CD1 4.26Å; R40-Y349 HydrophobicContact CG-CE1 3.84Å
41	L	96.8	Very high	87.1	Confident	24 Å²	24	64.1 Å²	64.1	13%	0.126	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	163.9	175.3	-65.8	-178.9	0	0	0	110.1	F82 Y333 M348 R350	L41-F82 HydrophobicContact CB-CZ 4.26Å; L41-F82 HydrophobicContact CD1-CE1 3.9Å; L41-F82 HydrophobicContact CD1-CZ 3.92Å; L41-Y333 HydrophobicContact CD1-CD1 3.85Å; L41-Y333 HydrophobicContact CD1-CE1 3.74Å; L41-M348 HydrophobicContact CB-CB 4.1Å; L41-M348 HydrophobicContact CB-CG 4.1Å; L41-M348 HydrophobicContact CD1-CE 4.11Å; L41-M348 HydrophobicContact CD1-CG 4.07Å; L41-M348 HydrophobicContact CD1-SD 4.23Å; L41-M348 PolarHBondContact N-O 2.91Å; L41-R350 HydrophobicContact CD1-CB 3.88Å; L41-R350 HydrophobicContact CG-CB 4.17Å
42	P	95.9	Very high	89.5	Confident	63 Å²	63	57.8 Å²	57.8	41%	0.409	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-50.3	126.5	175	-30.4	38.8	0	0	0	111.1	C87 W89	P42-C87 HydrophobicContact CG-CB 4.42Å; P42-C87 WeakPolarHBondContact CG-O 3.35Å; P42-W89 PolarHBondContact O-NE1 3.27Å
43	P	93.8	Very high	91.5	Very high	60 Å²	60	52 Å²	52	39%	0.39	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-67.3	159.9	179.1	30.5	-35.2	0	0	0	110.3	D45 G346	P43-D45 PolarHBondContact O-N 3.39Å; P43-G346 WeakPolarHBondContact CA-O 3.33Å
44	C	94.5	Very high	93.1	Very high	8 Å²	8	51.4 Å²	51.4	5%	0.054	25%	0.245	C	C	.	.			trans	-77.4	111.8	171.4	-171.8	0	0	0	0	109.1	W89 F335 G346	C44-W89 HydrophobicContact CB-CD2 3.72Å; C44-W89 HydrophobicContact CB-CE3 4.14Å; C44-W89 HydrophobicContact CB-CG 4.04Å; C44-W89 HydrophobicContact CB-CH2 4.5Å; C44-W89 HydrophobicContact CB-CZ2 4.1Å; C44-F335 HydrophobicContact CB-CE2 3.75Å; C44-F335 HydrophobicContact CB-CZ 3.89Å; C44-G346 PolarHBondContact N-O 2.98Å
45	D	91.7	Very high	94.3	Very high	87 Å²	87	50.7 Å²	50.7	47%	0.465	24%	0.241	S	C	.	.			trans	-64.1	144.2	176.6	-72.1	-43.6	0	0	0	111.5	P43 F47 V48 G49	P43-D45 PolarHBondContact O-N 3.39Å; D45-F47 HydrophobicContact CB-CD1 3.52Å; D45-F47 HydrophobicContact CB-CE1 3.26Å; D45-F47 HydrophobicContact CB-CG 4.44Å; D45-F47 HydrophobicContact CB-CZ 4.03Å; D45-F47 PolarHBondContact O-N 3.39Å; D45-F47 VanDerWaalsContact O-N 3.09Å; D45-F47 WeakPolarHBondContact OD2-CE1 3.28Å; D45-V48 HydrophobicContact CB-CG2 4.43Å; D45-V48 WeakPolarHBondContact O-CA 3.36Å; D45-V48 WeakPolarHBondContact O-CB 3.41Å; D45-V48 PolarHBondContact O-N 3.26Å; D45-G49 PolarHBondContact O-N 3.27Å
46	E	90.5	Very high	95	Very high	128 Å²	128	50.2 Å²	50.2	60%	0.598	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.9	-174.6	-72.2	-175.4	-174.2	0	0	113.8	V48 R51	E46-V48 VanDerWaalsContact C-N 3.34Å; E46-R51 IonicContact OE1-CZ 2.93Å; E46-R51 IonicContact OE1-NE 2.89Å; E46-R51 PolarHBondContact OE1-NE 3.37Å; E46-R51 IonicContact OE1-NH2 2.71Å; E46-R51 PolarHBondContact OE1-NH2 3.48Å; E46-R51 VanDerWaalsContact OE1-NH2 3.13Å
47	F	90.7	Very high	95.4	Very high	156 Å²	156	49 Å²	49	68%	0.684	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-29.5	174.7	72.8	-94.9	0	0	0	112.3	D45 R91	D45-F47 HydrophobicContact CB-CD1 3.52Å; D45-F47 HydrophobicContact CB-CE1 3.26Å; D45-F47 HydrophobicContact CB-CG 4.44Å; D45-F47 HydrophobicContact CB-CZ 4.03Å; D45-F47 PolarHBondContact O-N 3.39Å; D45-F47 VanDerWaalsContact O-N 3.09Å; D45-F47 WeakPolarHBondContact OD2-CE1 3.28Å; F47-R91 PolarHBondContact O-NH2 3.35Å
48	V	93.6	Very high	95.7	Very high	14 Å²	14	46.8 Å²	46.8	9%	0.085	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-54.1	173.9	-175.3	0	0	0	0	109.5	D45 E46 W89 R91	D45-V48 HydrophobicContact CB-CG2 4.43Å; D45-V48 WeakPolarHBondContact O-CA 3.36Å; D45-V48 WeakPolarHBondContact O-CB 3.41Å; D45-V48 PolarHBondContact O-N 3.26Å; E46-V48 VanDerWaalsContact C-N 3.34Å; V48-W89 HydrophobicContact CG1-CB 4.07Å; V48-R91 HydrophobicContact CG1-CG 4.47Å; V48-R91 WeakPolarHBondContact O-CG 3.39Å; V48-R91 PolarHBondContact O-NE 3.08Å; V48-R91 PolarHBondContact O-NH2 3.5Å
49	G	94.2	Very high	95.8	Very high	2 Å²	2	48 Å²	48	2%	0.021	24%	0.236	C	C	.	.			trans	-158.9	145.3	-177.8	0	0	0	0	0	113	D45	D45-G49 PolarHBondContact O-N 3.27Å
50	A	96.1	Very high	95.9	Very high	27 Å²	27	45.9 Å²	45.9	22%	0.223	23%	0.228	C	C	.	.			trans	-68	147.4	178.4	0	0	0	0	0	112.1	R52 N71 L76	A50-R52 PolarHBondContact O-NE 3.2Å; A50-R52 PolarHBondContact O-NH2 2.94Å; A50-N71 HydrophobicContact CB-CB 4.03Å; A50-L76 HydrophobicContact CB-CD1 4.32Å
51	R	97.1	Very high	95.7	Very high	120 Å²	120	49 Å²	49	45%	0.453	24%	0.24	S	C	.	.			trans	-56.2	136.7	164.5	-51.9	-179.7	-162	-145.6	-3.2	109.4	E46 N71 R344	E46-R51 IonicContact OE1-CZ 2.93Å; E46-R51 IonicContact OE1-NE 2.89Å; E46-R51 PolarHBondContact OE1-NE 3.37Å; E46-R51 IonicContact OE1-NH2 2.71Å; E46-R51 PolarHBondContact OE1-NH2 3.48Å; E46-R51 VanDerWaalsContact OE1-NH2 3.13Å; R51-N71 WeakPolarHBondContact O-CA 3.28Å; R51-N71 WeakPolarHBondContact O-CB 3.41Å; R51-R344 HydrophobicContact CB-CB 3.96Å; R51-R344 WeakPolarHBondContact CB-O 3.34Å; R51-R344 VanDerWaalsContact CD-O 3.24Å; R51-R344 WeakPolarHBondContact CD-O 3.14Å
52	R	97.6	Very high	95.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.247	C	C	.	.			trans	-152	156.7	-168	62	-176.2	74.4	-156.7	1.8	114.8	A50 H55 G68 D70 L76 D78 F335 G337 S345	A50-R52 PolarHBondContact O-NE 3.2Å; A50-R52 PolarHBondContact O-NH2 2.94Å; R52-H55 HydrophobicContact CG-CB 4.35Å; R52-G68 WeakPolarHBondContact CD-O 3.43Å; R52-G68 PolarHBondContact NH1-O 3.05Å; R52-D70 CarbonylContact C-O 3.59Å; R52-D70 WeakPolarHBondContact CA-O 3.39Å; R52-L76 HydrophobicContact CB-CD1 4.05Å; R52-D78 IonicContact CZ-OD1 2.73Å; R52-D78 IonicContact CZ-OD2 3.65Å; R52-D78 IonicContact NH1-OD1 2.71Å; R52-D78 PolarHBondContact NH1-OD1 3.04Å; R52-D78 IonicContact NH1-OD2 3.69Å; R52-D78 VanDerWaalsContact NH2-CG 3.33Å; R52-D78 IonicContact NH2-OD1 3.23Å; R52-D78 PolarHBondContact NH2-OD1 3.37Å; R52-D78 VanDerWaalsContact NH2-OD1 3.15Å; R52-D78 IonicContact NH2-OD2 3.69Å; R52-D78 PolarHBondContact NH2-OD2 3.48Å; R52-F335 HydrophobicContact CG-CE1 3.89Å; R52-G337 PolarHBondContact O-N 3.19Å; R52-S345 PolarHBondContact N-O 2.95Å; R52-S345 VanDerWaalsContact N-O 3.16Å
53	S	97.7	Very high	95.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-133.7	169.4	167.8	66.1	0	0	0	0	111.2	H55 G69 D70 F322 T338	S53-H55 PolarHBondContact O-N 2.97Å; S53-G69 CarbonylContact O-C 3.5Å; S53-G69 WeakPolarHBondContact O-CA 3.4Å; S53-D70 PolarHBondContact N-O 3.28Å; S53-D70 PolarHBondContact O-N 3Å; S53-F322 CarbonylContact C-O 3.54Å; S53-F322 WeakPolarHBondContact CA-O 3.33Å; S53-T338 WeakPolarHBondContact CB-OG1 3.5Å; S53-T338 PolarHBondContact OG-OG1 3.47Å; S53-T338 VanDerWaalsContact OG-OG1 3.09Å
54	K	97.1	Very high	95.9	Very high	41 Å²	41	44.7 Å²	44.7	18%	0.178	21%	0.211	C	C	.	.	S	Bend	trans	57.6	21.5	-179.9	-50.4	170.2	-169.4	149.6	0	114.5	D70 Y103 H104 F322	K54-D70 WeakPolarHBondContact CD-OD2 3.42Å; K54-D70 WeakPolarHBondContact CE-OD2 3.5Å; K54-D70 IonicContact NZ-OD2 2.86Å; K54-D70 PolarHBondContact NZ-OD2 2.65Å; K54-Y103 HydrophobicContact CB-CD2 4.16Å; K54-Y103 HydrophobicContact CB-CG 4.38Å; K54-Y103 HydrophobicContact CD-CD2 3.45Å; K54-Y103 VanDerWaalsContact CD-CD2 3.45Å; K54-Y103 HydrophobicContact CD-CE2 3.9Å; K54-Y103 HydrophobicContact CD-CG 4.03Å; K54-Y103 HydrophobicContact CG-CD2 4.47Å; K54-H104 WeakPolarHBondContact CD-NE2 3.43Å; K54-H104 PolarHBondContact O-N 3Å; K54-F322 HydrophobicContact CB-CB 4.43Å; K54-F322 HydrophobicContact CG-CB 3.69Å; K54-F322 HydrophobicContact CG-CD1 4.26Å; K54-F322 HydrophobicContact CG-CD2 3.95Å; K54-F322 HydrophobicContact CG-CG 3.73Å; K54-F322 PolarHBondContact N-O 2.85Å
55	H	98.4	Very high	96.1	Very high	10 Å²	10	45.3 Å²	45.3	5%	0.046	21%	0.212	C	C	.	.			trans	-86.5	175.3	174.1	62	-85.3	0	0	0	109.6	R52 S53 V66 F67 G68 F335	R52-H55 HydrophobicContact CG-CB 4.35Å; S53-H55 PolarHBondContact O-N 2.97Å; H55-V66 HydrophobicContact CB-CG1 4.46Å; H55-V66 WeakPolarHBondContact CD2-CG1 3.47Å; H55-F67 WeakPolarHBondContact CB-O 3.2Å; H55-G68 VanDerWaalsContact CB-O 3.28Å; H55-G68 WeakPolarHBondContact CB-O 3.01Å; H55-F335 AromaticContact CE1-CD1 3.97Å; H55-F335 PolarHBondContact CE1-O 3.06Å; H55-F335 VanDerWaalsContact CE1-O 3.26Å; H55-F335 AromaticContact NE2-CD1 3.47Å; H55-F335 WeakPolarHBondContact NE2-CD1 3.09Å; H55-F335 PolarHBondContact NE2-O 2.83Å
56	T	98.6	Very high	96.4	Very high	16 Å²	16	41.2 Å²	41.2	10%	0.098	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	151.2	171.2	56.5	0	0	0	0	110.9	V66 F67 H105 A107	T56-V66 WeakPolarHBondContact O-CA 3.35Å; T56-F67 PolarHBondContact N-O 3.25Å; T56-F67 VanDerWaalsContact N-O 3.08Å; T56-F67 PolarHBondContact O-N 2.81Å; T56-H105 VanDerWaalsContact CG2-CD2 3.45Å; T56-H105 WeakPolarHBondContact CG2-CD2 3.09Å; T56-H105 WeakPolarHBondContact CG2-NE2 3.43Å; T56-H105 WeakPolarHBondContact CG2-O 3.4Å; T56-H105 PolarHBondContact OG1-NE2 3.15Å; T56-A107 HydrophobicContact CG2-CB 3.99Å; T56-A107 VanDerWaalsContact OG1-CB 3.31Å; T56-A107 WeakPolarHBondContact OG1-CB 3.42Å
57	V	98.4	Very high	96.8	Very high	15 Å²	15	35.1 Å²	35.1	9%	0.091	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	132.8	174	173.6	0	0	0	0	107.9	I64 Y65 V66 A324 A326 F335	V57-I64 HydrophobicContact CG1-CG2 3.37Å; V57-Y65 CarbonylContact C-O 3.52Å; V57-Y65 VanDerWaalsContact CA-O 3.27Å; V57-Y65 WeakPolarHBondContact CA-O 3.36Å; V57-V66 HydrophobicContact CG2-CG1 4.13Å; V57-V66 HydrophobicContact CG2-CG2 4.12Å; V57-A324 HydrophobicContact CB-CB 3.69Å; V57-A324 HydrophobicContact CG2-CB 3.46Å; V57-A324 VanDerWaalsContact CG2-CB 3.46Å; V57-A326 HydrophobicContact CG1-CB 3.79Å; V57-F335 HydrophobicContact CG2-CB 4.28Å
58	V	98.5	Very high	97.2	Very high	9 Å²	9	27.7 Å²	27.7	6%	0.055	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	149.6	172.1	-59.4	0	0	0	0	111	Y65 A107 V109 M114 F141	V58-Y65 PolarHBondContact N-O 3.14Å; V58-Y65 PolarHBondContact O-N 3.37Å; V58-A107 HydrophobicContact CG1-CB 3.83Å; V58-V109 HydrophobicContact CB-CG2 3.68Å; V58-V109 HydrophobicContact CG1-CG2 4.22Å; V58-V109 HydrophobicContact CG2-CG2 3.79Å; V58-M114 HydrophobicContact CG1-SD 4.48Å; V58-M114 HydrophobicContact CG2-CG 4.04Å; V58-M114 HydrophobicContact CG2-SD 3.53Å; V58-M114 VanDerWaalsContact CG2-SD 3.53Å; V58-F141 HydrophobicContact CG2-CZ 4.21Å
59	A	97.9	Very high	97.3	Very high	27 Å²	27	27 Å²	27	22%	0.223	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.2	173.3	0	0	0	0	0	110.2	I64 A326 V327 I328	A59-I64 HydrophobicContact CB-CD1 4.2Å; A59-A326 HydrophobicContact CB-CB 4.01Å; A59-V327 WeakPolarHBondContact CB-O 3.39Å; A59-I328 HydrophobicContact CB-CD1 4.21Å; A59-I328 HydrophobicContact CB-CG1 3.54Å
60	Y	97.6	Very high	97.4	Very high	32 Å²	32	27 Å²	27	13%	0.125	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	115.9	168.8	180	-104.9	0	0	0	109.8	D62 A63 V109 F141	Y60-D62 PolarHBondContact O-N 3.02Å; Y60-A63 PolarHBondContact N-O 2.96Å; Y60-A63 PolarHBondContact O-N 3.23Å; Y60-V109 HydrophobicContact CD2-CG1 4.17Å; Y60-F141 HydrophobicContact CD1-CB 3.63Å; Y60-F141 AromaticContact CD1-CD1 3.84Å; Y60-F141 HydrophobicContact CD1-CD1 3.84Å; Y60-F141 AromaticContact CD1-CD2 3.61Å; Y60-F141 HydrophobicContact CD1-CD2 3.61Å; Y60-F141 HydrophobicContact CD1-CE1 4.38Å; Y60-F141 HydrophobicContact CD1-CE2 4.18Å; Y60-F141 AromaticContact CD1-CG 3.42Å; Y60-F141 HydrophobicContact CD1-CG 3.42Å; Y60-F141 VanDerWaalsContact CD1-CG 3.42Å; Y60-F141 AromaticContact CD2-CD2 3.49Å; Y60-F141 HydrophobicContact CD2-CD2 3.49Å; Y60-F141 VanDerWaalsContact CD2-CD2 3.49Å; Y60-F141 AromaticContact CD2-CE2 3.6Å; Y60-F141 HydrophobicContact CD2-CE2 3.6Å; Y60-F141 HydrophobicContact CD2-CG 4.21Å; Y60-F141 HydrophobicContact CD2-CZ 4.37Å; Y60-F141 HydrophobicContact CE1-CB 3.44Å; Y60-F141 VanDerWaalsContact CE1-CB 3.44Å; Y60-F141 AromaticContact CE1-CD2 3.9Å; Y60-F141 HydrophobicContact CE1-CD2 3.9Å; Y60-F141 AromaticContact CE1-CG 3.74Å; Y60-F141 HydrophobicContact CE1-CG 3.74Å; Y60-F141 AromaticContact CE2-CD2 3.8Å; Y60-F141 HydrophobicContact CE2-CD2 3.8Å; Y60-F141 HydrophobicContact CE2-CE2 4.3Å; Y60-F141 HydrophobicContact CE2-CG 4.48Å; Y60-F141 HydrophobicContact CG-CB 4.33Å; Y60-F141 HydrophobicContact CG-CD1 4.05Å; Y60-F141 AromaticContact CG-CD2 3.39Å; Y60-F141 HydrophobicContact CG-CD2 3.39Å; Y60-F141 HydrophobicContact CG-CE1 4.16Å; Y60-F141 AromaticContact CG-CE2 3.53Å; Y60-F141 HydrophobicContact CG-CE2 3.53Å; Y60-F141 AromaticContact CG-CG 3.68Å; Y60-F141 HydrophobicContact CG-CG 3.68Å; Y60-F141 AromaticContact CG-CZ 3.9Å; Y60-F141 HydrophobicContact CG-CZ 3.9Å; Y60-F141 AromaticContact CZ-CD2 3.98Å
61	R	94.1	Very high	97.3	Very high	190 Å²	190	28 Å²	28	72%	0.717	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	-132.1	-170.6	-55.9	178.1	177.4	177.8	-2.1	110.2	A63	R61-A63 VanDerWaalsContact C-N 3.26Å; R61-A63 PolarHBondContact O-N 2.84Å
62	D	94.1	Very high	97	Very high	51 Å²	51	23.4 Å²	23.4	27%	0.273	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	29.8	-177.6	-55.3	-38.4	0	0	0	112.6	Y60 V84 K85	Y60-D62 PolarHBondContact O-N 3.02Å; D62-V84 VanDerWaalsContact O-CB 3.32Å; D62-V84 WeakPolarHBondContact O-CB 3.28Å; D62-V84 WeakPolarHBondContact O-CG2 3.38Å; D62-V84 PolarHBondContact O-N 2.98Å; D62-K85 WeakPolarHBondContact OD2-CE 3.42Å; D62-K85 IonicContact OD2-NZ 2.61Å; D62-K85 PolarHBondContact OD2-NZ 2.71Å
63	A	97.4	Very high	96.6	Very high	4 Å²	4	30.1 Å²	30.1	3%	0.033	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.3	-177.3	0	0	0	0	0	113.1	Y60 R61 Y65 R81 F82	Y60-A63 PolarHBondContact N-O 2.96Å; Y60-A63 PolarHBondContact O-N 3.23Å; R61-A63 VanDerWaalsContact C-N 3.26Å; R61-A63 PolarHBondContact O-N 2.84Å; A63-Y65 HydrophobicContact CB-CD2 4.49Å; A63-Y65 HydrophobicContact CB-CE2 3.87Å; A63-R81 HydrophobicContact CB-CG 4.13Å; A63-F82 VanDerWaalsContact CA-O 3.29Å; A63-F82 WeakPolarHBondContact CA-O 3.32Å; A63-F82 WeakPolarHBondContact CB-O 3.47Å
64	I	98.4	Very high	96.4	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.3	175.2	-62.9	-68.8	0	0	0	108.6	V57 A59 V66 R81 F82 V84 A326 I328 Y333 M348	V57-I64 HydrophobicContact CG1-CG2 3.37Å; A59-I64 HydrophobicContact CB-CD1 4.2Å; I64-V66 HydrophobicContact CG2-CG2 4.5Å; I64-R81 CarbonylContact O-C 3.56Å; I64-R81 WeakPolarHBondContact O-CA 3.38Å; I64-F82 HydrophobicContact CB-CB 4.27Å; I64-F82 PolarHBondContact N-O 3.31Å; I64-F82 PolarHBondContact O-N 2.75Å; I64-V84 HydrophobicContact CG1-CG2 4.5Å; I64-A326 HydrophobicContact CD1-CB 4.04Å; I64-I328 HydrophobicContact CD1-CD1 3.4Å; I64-I328 HydrophobicContact CD1-CG1 3.92Å; I64-I328 HydrophobicContact CG1-CD1 3.72Å; I64-Y333 HydrophobicContact CD1-CD2 4.08Å; I64-Y333 HydrophobicContact CD1-CG 4.05Å; I64-Y333 HydrophobicContact CG1-CD1 4.47Å; I64-Y333 HydrophobicContact CG1-CD2 4.48Å; I64-Y333 HydrophobicContact CG1-CG 4.11Å; I64-M348 HydrophobicContact CB-CE 4.22Å; I64-M348 HydrophobicContact CG1-CE 3.92Å; I64-M348 HydrophobicContact CG2-CE 4.42Å
65	Y	98.6	Very high	96.3	Very high	22 Å²	22	33.6 Å²	33.6	9%	0.086	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	134.4	177.7	-70.2	-100.6	0	0	0	110.4	V57 V58 A63 L79 L80 R81 A92 Y139 F141	V57-Y65 CarbonylContact C-O 3.52Å; V57-Y65 VanDerWaalsContact CA-O 3.27Å; V57-Y65 WeakPolarHBondContact CA-O 3.36Å; V58-Y65 PolarHBondContact N-O 3.14Å; V58-Y65 PolarHBondContact O-N 3.37Å; A63-Y65 HydrophobicContact CB-CD2 4.49Å; A63-Y65 HydrophobicContact CB-CE2 3.87Å; Y65-L79 HydrophobicContact CD1-CD1 4.32Å; Y65-L79 HydrophobicContact CD1-CD2 4.25Å; Y65-L79 HydrophobicContact CD1-CG 4.25Å; Y65-L80 CarbonylContact C-O 3.56Å; Y65-L80 VanDerWaalsContact CA-O 3.3Å; Y65-L80 WeakPolarHBondContact CA-O 3.38Å; Y65-R81 HydrophobicContact CD1-CB 4.23Å; Y65-R81 HydrophobicContact CD1-CG 4.48Å; Y65-R81 HydrophobicContact CE1-CB 4.11Å; Y65-R81 HydrophobicContact CE1-CG 4.09Å; Y65-R81 HydrophobicContact CE2-CG 4.46Å; Y65-A92 HydrophobicContact CD1-CB 4.32Å; Y65-A92 HydrophobicContact CE1-CB 4.15Å; Y65-Y139 HydrophobicContact CE1-CE1 4.47Å; Y65-F141 HydrophobicContact CD1-CD1 4.32Å; Y65-F141 AromaticContact CD1-CE1 3.97Å; Y65-F141 HydrophobicContact CD1-CE1 3.97Å; Y65-F141 HydrophobicContact CD2-CD1 4.21Å; Y65-F141 AromaticContact CD2-CE1 3.59Å; Y65-F141 HydrophobicContact CD2-CE1 3.59Å; Y65-F141 HydrophobicContact CD2-CZ 4.43Å; Y65-F141 AromaticContact CE1-CD1 3.89Å; Y65-F141 HydrophobicContact CE1-CD1 3.89Å; Y65-F141 HydrophobicContact CE1-CE1 4Å; Y65-F141 AromaticContact CE2-CD1 3.79Å; Y65-F141 HydrophobicContact CE2-CD1 3.79Å; Y65-F141 AromaticContact CE2-CE1 3.65Å; Y65-F141 HydrophobicContact CE2-CE1 3.65Å; Y65-F141 HydrophobicContact CG-CD1 4.46Å; Y65-F141 AromaticContact CG-CE1 3.76Å; Y65-F141 HydrophobicContact CG-CE1 3.76Å; Y65-F141 AromaticContact CZ-CD1 3.6Å; Y65-F141 AromaticContact CZ-CE1 3.84Å
66	V	98.7	Very high	96.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124.5	-177.8	-166.5	0	0	0	0	109.6	H55 T56 V57 I64 L79 L80 W89 F335	H55-V66 HydrophobicContact CB-CG1 4.46Å; H55-V66 WeakPolarHBondContact CD2-CG1 3.47Å; T56-V66 WeakPolarHBondContact O-CA 3.35Å; V57-V66 HydrophobicContact CG2-CG1 4.13Å; V57-V66 HydrophobicContact CG2-CG2 4.12Å; I64-V66 HydrophobicContact CG2-CG2 4.5Å; V66-L79 WeakPolarHBondContact O-CA 3.31Å; V66-L80 HydrophobicContact CB-CB 4.07Å; V66-L80 HydrophobicContact CB-CD1 4.49Å; V66-L80 HydrophobicContact CG2-CB 4.39Å; V66-L80 PolarHBondContact N-O 3.33Å; V66-L80 PolarHBondContact O-N 2.92Å; V66-W89 HydrophobicContact CG2-CH2 3.84Å; V66-W89 HydrophobicContact CG2-CZ3 3.75Å; V66-F335 HydrophobicContact CB-CD1 4.46Å; V66-F335 HydrophobicContact CG1-CD1 3.72Å; V66-F335 HydrophobicContact CG1-CE1 3.78Å; V66-F335 HydrophobicContact CG2-CD1 3.92Å; V66-F335 HydrophobicContact CG2-CE1 4.23Å; V66-F335 HydrophobicContact CG2-CG 4.46Å
67	F	98.6	Very high	96.1	Very high	1 Å²	1	36.4 Å²	36.4	0%	0.004	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.3	-178.3	-175.1	-108.2	0	0	0	112.9	H55 T56 N77 D78 L79 P99 R102 H105 V116 W146	H55-F67 WeakPolarHBondContact CB-O 3.2Å; T56-F67 PolarHBondContact N-O 3.25Å; T56-F67 VanDerWaalsContact N-O 3.08Å; T56-F67 PolarHBondContact O-N 2.81Å; F67-N77 HydrophobicContact CE2-CB 4.37Å; F67-N77 VanDerWaalsContact CE2-O 3.26Å; F67-N77 WeakPolarHBondContact CE2-O 3.31Å; F67-N77 HydrophobicContact CZ-CB 4.29Å; F67-D78 WeakPolarHBondContact CD2-O 3.41Å; F67-L79 HydrophobicContact CB-CD1 3.9Å; F67-L79 HydrophobicContact CD2-CB 4.34Å; F67-L79 HydrophobicContact CD2-CD1 4.16Å; F67-L79 HydrophobicContact CG-CD1 4.45Å; F67-P99 HydrophobicContact CE1-CB 4.27Å; F67-P99 HydrophobicContact CE1-CG 3.92Å; F67-P99 HydrophobicContact CZ-CB 3.97Å; F67-P99 HydrophobicContact CZ-CG 3.6Å; F67-R102 HydrophobicContact CE1-CG 4.43Å; F67-H105 AromaticContact CD1-CE1 3.91Å; F67-H105 AromaticContact CD1-NE2 3.38Å; F67-H105 WeakPolarHBondContact CD1-NE2 3.29Å; F67-H105 PolarHBondContact O-CE1 3.37Å; F67-H105 VanDerWaalsContact O-CE1 3.24Å; F67-H105 PolarHBondContact O-NE2 3.32Å; F67-V116 HydrophobicContact CD1-CG1 4.27Å; F67-V116 HydrophobicContact CD1-CG2 3.94Å; F67-V116 HydrophobicContact CE1-CG1 4.01Å; F67-V116 HydrophobicContact CE1-CG2 4.23Å; F67-W146 HydrophobicContact CD2-CH2 4.12Å; F67-W146 AromaticContact CD2-CZ2 3.88Å; F67-W146 HydrophobicContact CD2-CZ2 3.88Å; F67-W146 HydrophobicContact CE1-CH2 4.42Å; F67-W146 AromaticContact CE2-CH2 3.98Å; F67-W146 HydrophobicContact CE2-CH2 3.98Å; F67-W146 AromaticContact CE2-CZ2 3.73Å; F67-W146 HydrophobicContact CE2-CZ2 3.73Å; F67-W146 HydrophobicContact CG-CH2 4.39Å; F67-W146 HydrophobicContact CZ-CH2 4.17Å; F67-W146 HydrophobicContact CZ-CZ2 4.33Å
68	G	97.9	Very high	96.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.186	C	C	.	.			trans	64.5	-146.6	171.5	0	0	0	0	0	115.3	R52 H55 L76 D78	R52-G68 WeakPolarHBondContact CD-O 3.43Å; R52-G68 PolarHBondContact NH1-O 3.05Å; H55-G68 VanDerWaalsContact CB-O 3.28Å; H55-G68 WeakPolarHBondContact CB-O 3.01Å; G68-L76 VanDerWaalsContact CA-O 3.25Å; G68-L76 WeakPolarHBondContact CA-O 3.17Å; G68-D78 PolarHBondContact N-O 3.25Å
69	G	97.3	Very high	96.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.185	C	C	.	.			trans	93.2	-166.6	-174.7	0	0	0	0	0	113.8	S53 M75 L76 R102	S53-G69 CarbonylContact O-C 3.5Å; S53-G69 WeakPolarHBondContact O-CA 3.4Å; G69-M75 CarbonylContact O-C 3.54Å; G69-M75 WeakPolarHBondContact O-CA 3.38Å; G69-L76 PolarHBondContact O-N 3.23Å; G69-R102 PolarHBondContact N-O 3.33Å
70	D	95.2	Very high	96.1	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-127.8	146	173.4	81.1	77.3	0	0	0	112.9	R52 S53 K54 G72 N74 Y103 I124 R344	R52-D70 CarbonylContact C-O 3.59Å; R52-D70 WeakPolarHBondContact CA-O 3.39Å; S53-D70 PolarHBondContact N-O 3.28Å; S53-D70 PolarHBondContact O-N 3Å; K54-D70 WeakPolarHBondContact CD-OD2 3.42Å; K54-D70 WeakPolarHBondContact CE-OD2 3.5Å; K54-D70 IonicContact NZ-OD2 2.86Å; K54-D70 PolarHBondContact NZ-OD2 2.65Å; D70-G72 WeakPolarHBondContact OD1-CA 3.39Å; D70-G72 PolarHBondContact OD1-N 2.85Å; D70-N74 WeakPolarHBondContact CA-O 3.44Å; D70-Y103 HydrophobicContact CB-CD1 4.48Å; D70-I124 HydrophobicContact CB-CD1 3.53Å; D70-R344 IonicContact OD1-CZ 3.36Å; D70-R344 IonicContact OD1-NE 3.02Å; D70-R344 PolarHBondContact OD1-NE 3.4Å; D70-R344 IonicContact OD1-NH2 2.81Å; D70-R344 PolarHBondContact OD1-NH2 3.13Å; D70-R344 IonicContact OD2-NH2 3.78Å
71	N	94.6	Very high	96.1	Very high	48 Å²	48	38.6 Å²	38.6	26%	0.257	18%	0.183	S	C	.	.			trans	-99.1	15	173	68.9	5.4	0	0	0	113.1	A50 R51 K73 N74 L76	A50-N71 HydrophobicContact CB-CB 4.03Å; R51-N71 WeakPolarHBondContact O-CA 3.28Å; R51-N71 WeakPolarHBondContact O-CB 3.41Å; N71-K73 VanDerWaalsContact C-N 3.26Å; N71-K73 PolarHBondContact O-N 2.89Å; N71-K73 WeakPolarHBondContact OD1-CA 3.07Å; N71-K73 PolarHBondContact OD1-N 3.25Å; N71-N74 PolarHBondContact N-O 2.88Å; N71-N74 PolarHBondContact OD1-N 3.18Å; N71-N74 PolarHBondContact OD1-O 2.78Å; N71-L76 HydrophobicContact CB-CD1 4.39Å
72	G	90.3	Very high	96.3	Very high	24 Å²	24	29.6 Å²	29.6	25%	0.247	15%	0.149	C	C	.	.	S	Bend	trans	82	-9.2	-173.5	0	0	0	0	0	115.3	D70 Y125	D70-G72 WeakPolarHBondContact OD1-CA 3.39Å; D70-G72 PolarHBondContact OD1-N 2.85Å; G72-Y125 PolarHBondContact O-OH 2.76Å
73	K	90.1	Very high	96.5	Very high	140 Å²	140	28.1 Å²	28.1	61%	0.609	14%	0.142	S	C	*	.	S	Bend	trans	-118.7	-49.9	175.4	-61.3	-179.5	-178.2	177.5	0	112.1	N71 Y125	N71-K73 VanDerWaalsContact C-N 3.26Å; N71-K73 PolarHBondContact O-N 2.89Å; N71-K73 WeakPolarHBondContact OD1-CA 3.07Å; N71-K73 PolarHBondContact OD1-N 3.25Å; K73-Y125 WeakPolarHBondContact O-CE2 3.33Å
74	N	92.8	Very high	96.3	Very high	100 Å²	100	29.4 Å²	29.4	54%	0.535	15%	0.149	S	C	.	.	S	Bend	trans	-127.3	149.7	-176.6	-61	-48.6	0	0	0	110.7	D70 N71	D70-N74 WeakPolarHBondContact CA-O 3.44Å; N71-N74 PolarHBondContact N-O 2.88Å; N71-N74 PolarHBondContact OD1-N 3.18Å; N71-N74 PolarHBondContact OD1-O 2.78Å
75	M	95.1	Very high	96	Very high	15 Å²	15	36.7 Å²	36.7	7%	0.074	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-72.8	152.1	161.7	-51.8	-166.3	-168	0	0	109.1	G69 P101 Y103 Y120 G122 I124 L130	G69-M75 CarbonylContact O-C 3.54Å; G69-M75 WeakPolarHBondContact O-CA 3.38Å; M75-P101 HydrophobicContact CB-CB 3.82Å; M75-Y103 HydrophobicContact CE-CD1 3.86Å; M75-Y103 HydrophobicContact CE-CE1 3.35Å; M75-Y103 HydrophobicContact CG-CD1 3.88Å; M75-Y103 HydrophobicContact CG-CE1 4.24Å; M75-Y103 HydrophobicContact SD-CD1 3.64Å; M75-Y103 HydrophobicContact SD-CE1 3.82Å; M75-Y120 VanDerWaalsContact SD-O 3.41Å; M75-G122 WeakPolarHBondContact CE-O 3.49Å; M75-I124 HydrophobicContact CE-CG1 4.08Å; M75-I124 HydrophobicContact CG-CD1 3.98Å; M75-I124 HydrophobicContact CG-CG1 3.71Å; M75-L130 HydrophobicContact CE-CD2 3.35Å
76	L	96.7	Very high	95.7	Very high	23 Å²	23	41.3 Å²	41.3	12%	0.12	21%	0.207	C	C	.	.			trans	-118.6	154.7	-174.4	-53.2	174.9	0	0	0	111	A50 R52 G68 G69 N71 P101 R102	A50-L76 HydrophobicContact CB-CD1 4.32Å; R52-L76 HydrophobicContact CB-CD1 4.05Å; G68-L76 VanDerWaalsContact CA-O 3.25Å; G68-L76 WeakPolarHBondContact CA-O 3.17Å; G69-L76 PolarHBondContact O-N 3.23Å; N71-L76 HydrophobicContact CB-CD1 4.39Å; L76-P101 WeakPolarHBondContact O-CA 3.25Å; L76-R102 PolarHBondContact O-N 2.95Å
77	N	96.8	Very high	95.5	Very high	61 Å²	61	43.9 Å²	43.9	33%	0.326	22%	0.224	S	C	.	.			trans	-139.8	17.4	169.6	67.6	-21.4	0	0	0	112.6	F67 P99 P101	F67-N77 HydrophobicContact CE2-CB 4.37Å; F67-N77 VanDerWaalsContact CE2-O 3.26Å; F67-N77 WeakPolarHBondContact CE2-O 3.31Å; F67-N77 HydrophobicContact CZ-CB 4.29Å; N77-P99 VanDerWaalsContact CB-O 3.29Å; N77-P99 WeakPolarHBondContact CB-O 3.28Å; N77-P99 PolarHBondContact ND2-O 2.96Å; N77-P101 HydrophobicContact CB-CB 4.44Å; N77-P101 HydrophobicContact CB-CG 4.14Å
78	D	97.1	Very high	95.4	Very high	41 Å²	41	46.3 Å²	46.3	22%	0.219	24%	0.241	C	C	.	.			trans	-73.8	152	171.9	60.4	-25.9	0	0	0	110.5	R52 F67 G68	R52-D78 IonicContact CZ-OD1 2.73Å; R52-D78 IonicContact CZ-OD2 3.65Å; R52-D78 IonicContact NH1-OD1 2.71Å; R52-D78 PolarHBondContact NH1-OD1 3.04Å; R52-D78 IonicContact NH1-OD2 3.69Å; R52-D78 VanDerWaalsContact NH2-CG 3.33Å; R52-D78 IonicContact NH2-OD1 3.23Å; R52-D78 PolarHBondContact NH2-OD1 3.37Å; R52-D78 VanDerWaalsContact NH2-OD1 3.15Å; R52-D78 IonicContact NH2-OD2 3.69Å; R52-D78 PolarHBondContact NH2-OD2 3.48Å; F67-D78 WeakPolarHBondContact CD2-O 3.41Å; G68-D78 PolarHBondContact N-O 3.25Å
79	L	98.3	Very high	95.4	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	111.9	174.9	-174.3	64.6	0	0	0	108.5	Y65 V66 F67 A92 T94 M114 Y139 W146	Y65-L79 HydrophobicContact CD1-CD1 4.32Å; Y65-L79 HydrophobicContact CD1-CD2 4.25Å; Y65-L79 HydrophobicContact CD1-CG 4.25Å; V66-L79 WeakPolarHBondContact O-CA 3.31Å; F67-L79 HydrophobicContact CB-CD1 3.9Å; F67-L79 HydrophobicContact CD2-CB 4.34Å; F67-L79 HydrophobicContact CD2-CD1 4.16Å; F67-L79 HydrophobicContact CG-CD1 4.45Å; L79-A92 HydrophobicContact CB-CB 4.07Å; L79-A92 HydrophobicContact CD2-CB 3.66Å; L79-A92 HydrophobicContact CG-CB 3.63Å; L79-A92 WeakPolarHBondContact O-CB 3.39Å; L79-A92 PolarHBondContact O-N 2.93Å; L79-T94 HydrophobicContact CB-CG2 4.12Å; L79-T94 HydrophobicContact CD2-CG2 4.27Å; L79-M114 HydrophobicContact CD1-CE 3.83Å; L79-M114 HydrophobicContact CD2-CE 4.34Å; L79-Y139 HydrophobicContact CD2-CD1 3.95Å; L79-Y139 HydrophobicContact CD2-CD2 4.04Å; L79-Y139 HydrophobicContact CD2-CE1 3.53Å; L79-Y139 HydrophobicContact CD2-CE2 3.61Å; L79-Y139 HydrophobicContact CD2-CG 4.17Å; L79-W146 HydrophobicContact CD2-CZ2 4.25Å
80	L	98.3	Very high	95.4	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	151.2	174.9	-48.7	178.6	0	0	0	109.8	Y65 V66 W89 R91	Y65-L80 CarbonylContact C-O 3.56Å; Y65-L80 VanDerWaalsContact CA-O 3.3Å; Y65-L80 WeakPolarHBondContact CA-O 3.38Å; V66-L80 HydrophobicContact CB-CB 4.07Å; V66-L80 HydrophobicContact CB-CD1 4.49Å; V66-L80 HydrophobicContact CG2-CB 4.39Å; V66-L80 PolarHBondContact N-O 3.33Å; V66-L80 PolarHBondContact O-N 2.92Å; L80-W89 HydrophobicContact CB-CE3 4.25Å; L80-W89 HydrophobicContact CB-CZ3 4.03Å; L80-W89 HydrophobicContact CD1-CZ3 4.42Å; L80-R91 HydrophobicContact CD2-CG 4.27Å
81	R	97.9	Very high	95.5	Very high	82 Å²	82	57.6 Å²	57.6	31%	0.309	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	130.5	173.6	176.7	-175.7	166.4	-144.6	-5.7	109.3	A63 I64 Y65 D83 C90 A92	A63-R81 HydrophobicContact CB-CG 4.13Å; I64-R81 CarbonylContact O-C 3.56Å; I64-R81 WeakPolarHBondContact O-CA 3.38Å; Y65-R81 HydrophobicContact CD1-CB 4.23Å; Y65-R81 HydrophobicContact CD1-CG 4.48Å; Y65-R81 HydrophobicContact CE1-CB 4.11Å; Y65-R81 HydrophobicContact CE1-CG 4.09Å; Y65-R81 HydrophobicContact CE2-CG 4.46Å; R81-D83 IonicContact CZ-OD2 2.76Å; R81-D83 IonicContact NH2-OD2 3.68Å; R81-D83 PolarHBondContact NH2-OD2 3.46Å; R81-C90 PolarHBondContact N-O 3.26Å; R81-C90 PolarHBondContact O-N 3.47Å; R81-C90 VanDerWaalsContact O-O 3.11Å; R81-A92 HydrophobicContact CB-CB 4.28Å
82	F	98.3	Very high	95.5	Very high	1 Å²	1	55.9 Å²	55.9	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.5	166.2	-179.6	-97.2	0	0	0	109.2	L41 A63 I64 V84 C87 S88 W89 M348	L41-F82 HydrophobicContact CB-CZ 4.26Å; L41-F82 HydrophobicContact CD1-CE1 3.9Å; L41-F82 HydrophobicContact CD1-CZ 3.92Å; A63-F82 VanDerWaalsContact CA-O 3.29Å; A63-F82 WeakPolarHBondContact CA-O 3.32Å; A63-F82 WeakPolarHBondContact CB-O 3.47Å; I64-F82 HydrophobicContact CB-CB 4.27Å; I64-F82 PolarHBondContact N-O 3.31Å; I64-F82 PolarHBondContact O-N 2.75Å; F82-V84 HydrophobicContact CD1-CG2 4.35Å; F82-V84 HydrophobicContact CE1-CG2 4.48Å; F82-C87 VanDerWaalsContact CE2-C 3.46Å; F82-C87 HydrophobicContact CZ-CB 4.28Å; F82-S88 WeakPolarHBondContact CA-O 3.38Å; F82-S88 WeakPolarHBondContact CD2-O 3.3Å; F82-W89 HydrophobicContact CB-CD2 3.95Å; F82-W89 HydrophobicContact CB-CE3 3.86Å; F82-W89 HydrophobicContact CB-CH2 3.95Å; F82-W89 HydrophobicContact CB-CZ2 4.04Å; F82-W89 HydrophobicContact CB-CZ3 3.86Å; F82-W89 AromaticContact CD2-CD1 3.59Å; F82-W89 AromaticContact CD2-CD2 3.71Å; F82-W89 HydrophobicContact CD2-CD2 3.71Å; F82-W89 AromaticContact CD2-CE2 3.45Å; F82-W89 VanDerWaalsContact CD2-CE2 3.45Å; F82-W89 HydrophobicContact CD2-CE3 4.48Å; F82-W89 AromaticContact CD2-CG 3.81Å; F82-W89 HydrophobicContact CD2-CG 3.81Å; F82-W89 HydrophobicContact CD2-CZ2 4.05Å; F82-W89 AromaticContact CD2-NE1 3.34Å; F82-W89 VanDerWaalsContact CD2-NE1 3.34Å; F82-W89 AromaticContact CE2-CD1 3.95Å; F82-W89 AromaticContact CE2-NE1 3.7Å; F82-W89 HydrophobicContact CG-CD2 4.31Å; F82-W89 HydrophobicContact CG-CZ2 4.27Å; F82-M348 HydrophobicContact CB-CE 4.14Å; F82-M348 HydrophobicContact CB-SD 4.08Å; F82-M348 HydrophobicContact CD1-CE 3.18Å; F82-M348 HydrophobicContact CD1-SD 3.56Å; F82-M348 VanDerWaalsContact CD1-SD 3.56Å; F82-M348 HydrophobicContact CD2-CE 4.43Å; F82-M348 HydrophobicContact CD2-SD 3.7Å; F82-M348 HydrophobicContact CE1-CE 3.54Å; F82-M348 HydrophobicContact CE1-SD 3.77Å; F82-M348 HydrophobicContact CE2-SD 3.9Å; F82-M348 HydrophobicContact CG-CE 3.67Å; F82-M348 HydrophobicContact CG-SD 3.49Å; F82-M348 WeakPolarHBondContact CG-SD 3.5Å; F82-M348 HydrophobicContact CZ-CE 4.29Å; F82-M348 HydrophobicContact CZ-SD 3.92Å
83	D	97.1	Very high	95.8	Very high	20 Å²	20	61.6 Å²	61.6	11%	0.107	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	122.8	173.4	-164	-70.8	0	0	0	109.9	R81 K85 D86 C87 S88	R81-D83 IonicContact CZ-OD2 2.76Å; R81-D83 IonicContact NH2-OD2 3.68Å; R81-D83 PolarHBondContact NH2-OD2 3.46Å; D83-K85 PolarHBondContact OD1-N 2.89Å; D83-D86 HydrophobicContact CB-CB 4.22Å; D83-D86 PolarHBondContact OD1-N 2.81Å; D83-D86 VanDerWaalsContact OD1-N 3.13Å; D83-C87 VanDerWaalsContact O-CA 3.31Å; D83-C87 WeakPolarHBondContact O-CA 3.41Å; D83-C87 PolarHBondContact O-N 2.91Å; D83-S88 PolarHBondContact N-O 3.04Å; D83-S88 PolarHBondContact O-N 3.11Å
84	V	94.3	Very high	96	Very high	32 Å²	32	58 Å²	58	19%	0.194	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-33.7	-175.1	174.3	0	0	0	0	111.9	D62 I64 F82 I328 Y333	D62-V84 VanDerWaalsContact O-CB 3.32Å; D62-V84 WeakPolarHBondContact O-CB 3.28Å; D62-V84 WeakPolarHBondContact O-CG2 3.38Å; D62-V84 PolarHBondContact O-N 2.98Å; I64-V84 HydrophobicContact CG1-CG2 4.5Å; F82-V84 HydrophobicContact CD1-CG2 4.35Å; F82-V84 HydrophobicContact CE1-CG2 4.48Å; V84-I328 HydrophobicContact CG2-CD1 3.67Å; V84-Y333 HydrophobicContact CG1-CE1 4.44Å; V84-Y333 WeakPolarHBondContact CG1-OH 3.27Å; V84-Y333 HydrophobicContact CG2-CE1 4.18Å
85	K	91.3	Very high	96.2	Very high	154 Å²	154	56 Å²	56	67%	0.67	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-44.8	-178.5	-69.7	179.6	-179.1	162.2	0	110.6	D62 D83 C87	D62-K85 WeakPolarHBondContact OD2-CE 3.42Å; D62-K85 IonicContact OD2-NZ 2.61Å; D62-K85 PolarHBondContact OD2-NZ 2.71Å; D83-K85 PolarHBondContact OD1-N 2.89Å; K85-C87 VanDerWaalsContact C-N 3.29Å; K85-C87 PolarHBondContact O-N 3.38Å
86	D	93.5	Very high	96.2	Very high	118 Å²	118	57.9 Å²	57.9	63%	0.631	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-7.7	-178.4	-60.8	-27.5	0	0	0	112.8	D83 S88	D83-D86 HydrophobicContact CB-CB 4.22Å; D83-D86 PolarHBondContact OD1-N 2.81Å; D83-D86 VanDerWaalsContact OD1-N 3.13Å; D86-S88 PolarHBondContact O-N 3.41Å
87	C	94.8	Very high	96.1	Very high	54 Å²	54	62 Å²	62	37%	0.365	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	40.8	-173.3	-69.5	0	0	0	0	113.1	P42 F82 D83 K85	P42-C87 HydrophobicContact CG-CB 4.42Å; P42-C87 WeakPolarHBondContact CG-O 3.35Å; F82-C87 VanDerWaalsContact CE2-C 3.46Å; F82-C87 HydrophobicContact CZ-CB 4.28Å; D83-C87 VanDerWaalsContact O-CA 3.31Å; D83-C87 WeakPolarHBondContact O-CA 3.41Å; D83-C87 PolarHBondContact O-N 2.91Å; K85-C87 VanDerWaalsContact C-N 3.29Å; K85-C87 PolarHBondContact O-N 3.38Å
88	S	95.9	Very high	96.1	Very high	52 Å²	52	61.1 Å²	61.1	36%	0.364	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	149.8	-170.3	70.2	0	0	0	0	113.6	F82 D83 D86	F82-S88 WeakPolarHBondContact CA-O 3.38Å; F82-S88 WeakPolarHBondContact CD2-O 3.3Å; D83-S88 PolarHBondContact N-O 3.04Å; D83-S88 PolarHBondContact O-N 3.11Å; D86-S88 PolarHBondContact O-N 3.41Å
89	W	98.1	Very high	96.1	Very high	29 Å²	29	59.1 Å²	59.1	11%	0.11	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	139.5	178.5	-74.3	96.7	0	0	0	111.7	P42 C44 V48 V66 L80 F82 F335 M348	P42-W89 PolarHBondContact O-NE1 3.27Å; C44-W89 HydrophobicContact CB-CD2 3.72Å; C44-W89 HydrophobicContact CB-CE3 4.14Å; C44-W89 HydrophobicContact CB-CG 4.04Å; C44-W89 HydrophobicContact CB-CH2 4.5Å; C44-W89 HydrophobicContact CB-CZ2 4.1Å; V48-W89 HydrophobicContact CG1-CB 4.07Å; V66-W89 HydrophobicContact CG2-CH2 3.84Å; V66-W89 HydrophobicContact CG2-CZ3 3.75Å; L80-W89 HydrophobicContact CB-CE3 4.25Å; L80-W89 HydrophobicContact CB-CZ3 4.03Å; L80-W89 HydrophobicContact CD1-CZ3 4.42Å; F82-W89 HydrophobicContact CB-CD2 3.95Å; F82-W89 HydrophobicContact CB-CE3 3.86Å; F82-W89 HydrophobicContact CB-CH2 3.95Å; F82-W89 HydrophobicContact CB-CZ2 4.04Å; F82-W89 HydrophobicContact CB-CZ3 3.86Å; F82-W89 AromaticContact CD2-CD1 3.59Å; F82-W89 AromaticContact CD2-CD2 3.71Å; F82-W89 HydrophobicContact CD2-CD2 3.71Å; F82-W89 AromaticContact CD2-CE2 3.45Å; F82-W89 VanDerWaalsContact CD2-CE2 3.45Å; F82-W89 HydrophobicContact CD2-CE3 4.48Å; F82-W89 AromaticContact CD2-CG 3.81Å; F82-W89 HydrophobicContact CD2-CG 3.81Å; F82-W89 HydrophobicContact CD2-CZ2 4.05Å; F82-W89 AromaticContact CD2-NE1 3.34Å; F82-W89 VanDerWaalsContact CD2-NE1 3.34Å; F82-W89 AromaticContact CE2-CD1 3.95Å; F82-W89 AromaticContact CE2-NE1 3.7Å; F82-W89 HydrophobicContact CG-CD2 4.31Å; F82-W89 HydrophobicContact CG-CZ2 4.27Å; W89-F335 HydrophobicContact CH2-CD1 4.38Å; W89-F335 AromaticContact CH2-CD2 3.53Å; W89-F335 HydrophobicContact CH2-CD2 3.53Å; W89-F335 HydrophobicContact CH2-CE1 4.39Å; W89-F335 AromaticContact CH2-CE2 3.51Å; W89-F335 HydrophobicContact CH2-CE2 3.51Å; W89-F335 AromaticContact CH2-CG 3.98Å; W89-F335 HydrophobicContact CH2-CG 3.98Å; W89-F335 AromaticContact CH2-CZ 3.97Å; W89-F335 HydrophobicContact CH2-CZ 3.97Å; W89-F335 AromaticContact CZ2-CD2 3.49Å; W89-F335 HydrophobicContact CZ2-CD2 3.49Å; W89-F335 VanDerWaalsContact CZ2-CD2 3.49Å; W89-F335 AromaticContact CZ2-CE2 3.46Å; W89-F335 HydrophobicContact CZ2-CE2 3.46Å; W89-F335 VanDerWaalsContact CZ2-CE2 3.46Å; W89-F335 HydrophobicContact CZ2-CG 4.35Å; W89-F335 HydrophobicContact CZ2-CZ 4.31Å; W89-F335 HydrophobicContact CZ3-CE2 4.43Å; W89-M348 HydrophobicContact CH2-SD 4.08Å; W89-M348 HydrophobicContact CZ2-CB 4.11Å; W89-M348 HydrophobicContact CZ2-CG 4.29Å; W89-M348 HydrophobicContact CZ2-SD 3.35Å; W89-M348 WeakPolarHBondContact CZ2-SD 3.24Å
90	C	96.9	Very high	96	Very high	49 Å²	49	61.1 Å²	61.1	33%	0.331	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	166.5	168.8	64.1	0	0	0	0	111.2	R81	R81-C90 PolarHBondContact N-O 3.26Å; R81-C90 PolarHBondContact O-N 3.47Å; R81-C90 VanDerWaalsContact O-O 3.11Å
91	R	96.9	Very high	95.9	Very high	161 Å²	161	63.6 Å²	63.6	61%	0.608	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	131.5	165.3	-67.7	-175	-177.1	166	6.2	108.6	F47 V48 L80	F47-R91 PolarHBondContact O-NH2 3.35Å; V48-R91 HydrophobicContact CG1-CG 4.47Å; V48-R91 WeakPolarHBondContact O-CG 3.39Å; V48-R91 PolarHBondContact O-NE 3.08Å; V48-R91 PolarHBondContact O-NH2 3.5Å; L80-R91 HydrophobicContact CD2-CG 4.27Å
92	A	96.1	Very high	95.9	Very high	12 Å²	12	59.8 Å²	59.8	10%	0.099	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-66.5	146.1	175.1	0	0	0	0	0	110.1	Y65 L79 R81 T94	Y65-A92 HydrophobicContact CD1-CB 4.32Å; Y65-A92 HydrophobicContact CE1-CB 4.15Å; L79-A92 HydrophobicContact CB-CB 4.07Å; L79-A92 HydrophobicContact CD2-CB 3.66Å; L79-A92 HydrophobicContact CG-CB 3.63Å; L79-A92 WeakPolarHBondContact O-CB 3.39Å; L79-A92 PolarHBondContact O-N 2.93Å; R81-A92 HydrophobicContact CB-CB 4.28Å; A92-T94 PolarHBondContact O-N 3.39Å
93	F	95	Very high	95.8	Very high	143 Å²	143	61.1 Å²	61.1	63%	0.627	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-67.2	129.8	172.7	-179.6	-106.4	0	0	0	109.8	T95 Y139 T143 G144	F93-T95 HydrophobicContact CD1-CG2 4.44Å; F93-T95 HydrophobicContact CE1-CG2 3.49Å; F93-T95 VanDerWaalsContact CE1-CG2 3.49Å; F93-T95 HydrophobicContact CE2-CG2 4.35Å; F93-T95 HydrophobicContact CZ-CG2 3.43Å; F93-T95 VanDerWaalsContact CZ-CG2 3.43Å; F93-Y139 PolarHBondContact O-OH 3.37Å; F93-T143 WeakPolarHBondContact CE1-O 3.17Å; F93-G144 WeakPolarHBondContact O-CA 3.42Å
94	T	95.8	Very high	95.8	Very high	66 Å²	66	61.6 Å²	61.6	41%	0.405	35%	0.345	S	S	.	.			trans	-132.1	136	-179	58.8	0	0	0	0	111.3	L79 A92 Y139 G144	L79-T94 HydrophobicContact CB-CG2 4.12Å; L79-T94 HydrophobicContact CD2-CG2 4.27Å; A92-T94 PolarHBondContact O-N 3.39Å; T94-Y139 HydrophobicContact CG2-CE2 4.13Å; T94-G144 CarbonylContact C-O 3.58Å; T94-G144 VanDerWaalsContact CA-O 3.3Å; T94-G144 WeakPolarHBondContact CA-O 3.29Å
95	T	96.6	Very high	95.9	Very high	56 Å²	56	60.6 Å²	60.6	34%	0.344	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	168.9	171	60.6	0	0	0	0	109.6	F93 G144 Q145 W146	F93-T95 HydrophobicContact CD1-CG2 4.44Å; F93-T95 HydrophobicContact CE1-CG2 3.49Å; F93-T95 VanDerWaalsContact CE1-CG2 3.49Å; F93-T95 HydrophobicContact CE2-CG2 4.35Å; F93-T95 HydrophobicContact CZ-CG2 3.43Å; F93-T95 VanDerWaalsContact CZ-CG2 3.43Å; T95-G144 PolarHBondContact N-O 3.01Å; T95-Q145 WeakPolarHBondContact OG1-CA 3.3Å; T95-W146 PolarHBondContact O-N 3.32Å
96	G	94.7	Very high	96.3	Very high	55 Å²	55	53.9 Å²	53.9	57%	0.567	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	73.6	-160	-172.5	0	0	0	0	0	112.2	P98	G96-P98 WeakPolarHBondContact O-CD 3.27Å
97	T	94.8	Very high	96.5	Very high	110 Å²	110	49.2 Å²	49.2	68%	0.675	29%	0.288	S	S	*	.			trans	-106.6	107	-176.6	-52.7	0	0	0	0	109.5	W146	T97-W146 WeakPolarHBondContact O-CB 3.29Å
98	P	95.7	Very high	96.7	Very high	42 Å²	42	47.3 Å²	47.3	27%	0.273	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-69	161.5	176.5	29.8	-35	0	0	0	111.3	G96 W146	G96-P98 WeakPolarHBondContact O-CD 3.27Å; P98-W146 HydrophobicContact CB-CD2 4.32Å; P98-W146 HydrophobicContact CB-CG 4.05Å
99	P	97	Very high	96.8	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-55.8	148.7	170.9	-14.2	21.8	0	0	0	111.4	F67 N77 R102 V116 F137 W146	F67-P99 HydrophobicContact CE1-CB 4.27Å; F67-P99 HydrophobicContact CE1-CG 3.92Å; F67-P99 HydrophobicContact CZ-CB 3.97Å; F67-P99 HydrophobicContact CZ-CG 3.6Å; N77-P99 VanDerWaalsContact CB-O 3.29Å; N77-P99 WeakPolarHBondContact CB-O 3.28Å; N77-P99 PolarHBondContact ND2-O 2.96Å; P99-R102 VanDerWaalsContact CB-CZ 3.47Å; P99-V116 HydrophobicContact CG-CG1 4.47Å; P99-F137 HydrophobicContact CB-CD1 4.4Å; P99-F137 HydrophobicContact CB-CD2 4.03Å; P99-F137 HydrophobicContact CB-CE1 4.48Å; P99-F137 HydrophobicContact CB-CE2 4.14Å; P99-F137 HydrophobicContact CB-CG 4.18Å; P99-F137 HydrophobicContact CB-CZ 4.37Å; P99-F137 HydrophobicContact CG-CB 3.81Å; P99-F137 HydrophobicContact CG-CD1 3.82Å; P99-F137 HydrophobicContact CG-CD2 3.91Å; P99-F137 HydrophobicContact CG-CE1 4.34Å; P99-F137 HydrophobicContact CG-CE2 4.43Å; P99-F137 HydrophobicContact CG-CG 3.58Å; P99-W146 HydrophobicContact CG-CE3 4.12Å; P99-W146 HydrophobicContact CG-CH2 4.25Å; P99-W146 HydrophobicContact CG-CZ3 3.81Å
100	A	96.6	Very high	96.8	Very high	47 Å²	47	48.3 Å²	48.3	39%	0.388	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-57.1	151.3	171.9	0	0	0	0	0	111.8	R102 T121	A100-R102 WeakPolarHBondContact O-CG 3.28Å; A100-R102 PolarHBondContact O-N 3.34Å; A100-R102 PolarHBondContact O-NE 2.95Å; A100-T121 HydrophobicContact CB-CG2 4.11Å
101	P	97.1	Very high	96.8	Very high	53 Å²	53	48.9 Å²	48.9	34%	0.344	29%	0.29	S	S	.	.	S	Bend	trans	-48.6	125.6	176.5	-28.6	35.4	0	0	0	113.1	M75 L76 N77	M75-P101 HydrophobicContact CB-CB 3.82Å; L76-P101 WeakPolarHBondContact O-CA 3.25Å; N77-P101 HydrophobicContact CB-CB 4.44Å; N77-P101 HydrophobicContact CB-CG 4.14Å
102	R	97.1	Very high	96.7	Very high	1 Å²	1	44.1 Å²	44.1	0%	0.004	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	154.5	-169.1	62.5	-176.9	68.6	-161.2	1.6	114.9	F67 G69 L76 P99 A100 H105 G118 Y120 T121 D135	F67-R102 HydrophobicContact CE1-CG 4.43Å; G69-R102 PolarHBondContact N-O 3.33Å; L76-R102 PolarHBondContact O-N 2.95Å; P99-R102 VanDerWaalsContact CB-CZ 3.47Å; A100-R102 WeakPolarHBondContact O-CG 3.28Å; A100-R102 PolarHBondContact O-N 3.34Å; A100-R102 PolarHBondContact O-NE 2.95Å; R102-H105 HydrophobicContact CG-CB 4.36Å; R102-G118 PolarHBondContact NH1-O 2.73Å; R102-Y120 WeakPolarHBondContact CA-O 3.43Å; R102-Y120 WeakPolarHBondContact CB-O 3.42Å; R102-T121 HydrophobicContact CB-CG2 3.93Å; R102-D135 IonicContact CZ-OD1 3.16Å; R102-D135 IonicContact CZ-OD2 3.72Å; R102-D135 IonicContact NH1-OD1 2.88Å; R102-D135 PolarHBondContact NH1-OD1 3.24Å; R102-D135 IonicContact NH1-OD2 3.45Å; R102-D135 PolarHBondContact NH1-OD2 2.72Å; R102-D135 IonicContact NH2-OD1 2.94Å; R102-D135 IonicContact NH2-OD2 2.75Å; R102-D135 PolarHBondContact NH2-OD2 2.75Å
103	Y	96.1	Very high	96.8	Very high	30 Å²	30	43.9 Å²	43.9	12%	0.118	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	166	169.1	69.7	-102	0	0	0	111.6	K54 D70 M75 H105 Y120	K54-Y103 HydrophobicContact CB-CD2 4.16Å; K54-Y103 HydrophobicContact CB-CG 4.38Å; K54-Y103 HydrophobicContact CD-CD2 3.45Å; K54-Y103 VanDerWaalsContact CD-CD2 3.45Å; K54-Y103 HydrophobicContact CD-CE2 3.9Å; K54-Y103 HydrophobicContact CD-CG 4.03Å; K54-Y103 HydrophobicContact CG-CD2 4.47Å; D70-Y103 HydrophobicContact CB-CD1 4.48Å; M75-Y103 HydrophobicContact CE-CD1 3.86Å; M75-Y103 HydrophobicContact CE-CE1 3.35Å; M75-Y103 HydrophobicContact CG-CD1 3.88Å; M75-Y103 HydrophobicContact CG-CE1 4.24Å; M75-Y103 HydrophobicContact SD-CD1 3.64Å; M75-Y103 HydrophobicContact SD-CE1 3.82Å; Y103-H105 PolarHBondContact O-N 3.14Å; Y103-H105 VanDerWaalsContact O-N 3.14Å; Y103-Y120 HydrophobicContact CE2-CD2 4.43Å; Y103-Y120 PolarHBondContact N-O 3.05Å; Y103-Y120 PolarHBondContact O-N 3.24Å
104	H	96.7	Very high	97	Very high	30 Å²	30	37.1 Å²	37.1	14%	0.139	25%	0.25	C	S	.	.	S	Bend	trans	55.7	25.1	-175.1	-67.7	-46.9	0	0	0	114.4	K54 S160 A161 N214 F322	K54-H104 WeakPolarHBondContact CD-NE2 3.43Å; K54-H104 PolarHBondContact O-N 3Å; H104-S160 WeakPolarHBondContact O-CA 3.48Å; H104-A161 HydrophobicContact CB-CB 4.07Å; H104-A161 PolarHBondContact O-N 3.24Å; H104-N214 PolarHBondContact CE1-OD1 3.01Å; H104-F322 AromaticContact CE1-CD1 3.84Å; H104-F322 AromaticContact CE1-CE1 3.61Å; H104-F322 AromaticContact CE1-CZ 3.99Å
105	H	98.3	Very high	97.2	Very high	11 Å²	11	34.2 Å²	34.2	5%	0.051	23%	0.232	C	C	.	.			trans	-78.6	166.8	164.9	62.2	-82	0	0	0	109.3	T56 F67 R102 Y103 V116 G118	T56-H105 VanDerWaalsContact CG2-CD2 3.45Å; T56-H105 WeakPolarHBondContact CG2-CD2 3.09Å; T56-H105 WeakPolarHBondContact CG2-NE2 3.43Å; T56-H105 WeakPolarHBondContact CG2-O 3.4Å; T56-H105 PolarHBondContact OG1-NE2 3.15Å; F67-H105 AromaticContact CD1-CE1 3.91Å; F67-H105 AromaticContact CD1-NE2 3.38Å; F67-H105 WeakPolarHBondContact CD1-NE2 3.29Å; F67-H105 PolarHBondContact O-CE1 3.37Å; F67-H105 VanDerWaalsContact O-CE1 3.24Å; F67-H105 PolarHBondContact O-NE2 3.32Å; R102-H105 HydrophobicContact CG-CB 4.36Å; Y103-H105 PolarHBondContact O-N 3.14Å; Y103-H105 VanDerWaalsContact O-N 3.14Å; H105-V116 HydrophobicContact CB-CG1 4.31Å; H105-G118 VanDerWaalsContact CB-O 3.28Å; H105-G118 WeakPolarHBondContact CB-O 3.42Å
106	S	98.3	Very high	97.3	Very high	13 Å²	13	31.5 Å²	31.5	9%	0.091	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	153.9	168.1	64.9	0	0	0	0	110.5	V116 F117 H162 A164	S106-V116 WeakPolarHBondContact O-CA 3.36Å; S106-F117 PolarHBondContact N-O 2.68Å; S106-F117 VanDerWaalsContact N-O 3.12Å; S106-F117 PolarHBondContact O-N 3.13Å; S106-H162 VanDerWaalsContact CB-NE2 3.32Å; S106-H162 WeakPolarHBondContact CB-NE2 3.44Å; S106-H162 PolarHBondContact OG-NE2 2.86Å; S106-A164 VanDerWaalsContact CB-CB 3.43Å; S106-A164 VanDerWaalsContact OG-CB 3.28Å; S106-A164 WeakPolarHBondContact OG-CB 3.45Å
107	A	98.4	Very high	97.4	Very high	19 Å²	19	29 Å²	29	16%	0.157	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.7	171.4	0	0	0	0	0	110	T56 V58 M114 F115 V116	T56-A107 HydrophobicContact CG2-CB 3.99Å; T56-A107 VanDerWaalsContact OG1-CB 3.31Å; T56-A107 WeakPolarHBondContact OG1-CB 3.42Å; V58-A107 HydrophobicContact CG1-CB 3.83Å; A107-M114 HydrophobicContact CB-CG 4.4Å; A107-M114 HydrophobicContact CB-SD 4.38Å; A107-F115 CarbonylContact C-O 3.53Å; A107-F115 WeakPolarHBondContact CA-O 3.32Å; A107-V116 HydrophobicContact CB-CG2 4.08Å
108	V	98.5	Very high	97.6	Very high	15 Å²	15	23.7 Å²	23.7	9%	0.091	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	160.6	178.6	-61.1	0	0	0	0	110.3	M114 F115 A164 V166 L171	V108-M114 CarbonylContact O-C 3.6Å; V108-M114 WeakPolarHBondContact O-CA 3.38Å; V108-F115 HydrophobicContact CG2-CB 3.93Å; V108-F115 PolarHBondContact N-O 2.99Å; V108-F115 PolarHBondContact O-N 3.3Å; V108-A164 HydrophobicContact CG1-CB 4.16Å; V108-V166 HydrophobicContact CB-CG2 3.75Å; V108-V166 HydrophobicContact CG1-CG2 4.4Å; V108-V166 HydrophobicContact CG2-CG2 3.5Å; V108-L171 HydrophobicContact CG1-CD1 4.41Å; V108-L171 HydrophobicContact CG2-CD1 3.96Å
109	V	98.4	Very high	97.6	Very high	46 Å²	46	21.7 Å²	21.7	28%	0.279	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	132.9	175.5	171.9	0	0	0	0	109.5	V58 Y60 S113 F141	V58-V109 HydrophobicContact CB-CG2 3.68Å; V58-V109 HydrophobicContact CG1-CG2 4.22Å; V58-V109 HydrophobicContact CG2-CG2 3.79Å; Y60-V109 HydrophobicContact CD2-CG1 4.17Å; V109-S113 WeakPolarHBondContact CA-O 3.35Å; V109-F141 HydrophobicContact CG1-CE2 4.13Å; V109-F141 HydrophobicContact CG2-CE2 3.97Å; V109-F141 HydrophobicContact CG2-CZ 3.91Å
110	Y	97.9	Very high	97.5	Very high	56 Å²	56	23 Å²	23	22%	0.22	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	124.9	171.6	175.3	-108.4	0	0	0	109.4	S112 S113 F115 V166 D169 L191	Y110-S112 PolarHBondContact O-N 3.25Å; Y110-S113 PolarHBondContact N-O 3.21Å; Y110-S113 PolarHBondContact O-N 2.89Å; Y110-F115 HydrophobicContact CD1-CE2 4.24Å; Y110-V166 HydrophobicContact CD2-CG1 3.87Å; Y110-D169 HydrophobicContact CE2-CB 4.08Å; Y110-D169 WeakPolarHBondContact CE2-OD1 3.36Å; Y110-D169 VanDerWaalsContact CZ-OD1 3.31Å; Y110-D169 WeakPolarHBondContact OH-CB 3.2Å; Y110-D169 VanDerWaalsContact OH-CG 3.24Å; Y110-D169 PolarHBondContact OH-OD1 3.05Å; Y110-L191 HydrophobicContact CD1-CB 3.44Å; Y110-L191 VanDerWaalsContact CD1-CB 3.44Å; Y110-L191 HydrophobicContact CD1-CD1 4.02Å; Y110-L191 HydrophobicContact CD1-CG 4.41Å; Y110-L191 HydrophobicContact CD2-CD1 4.45Å; Y110-L191 HydrophobicContact CE1-CB 3.69Å; Y110-L191 WeakPolarHBondContact CE1-O 3.31Å; Y110-L191 HydrophobicContact CG-CB 4Å; Y110-L191 HydrophobicContact CG-CD1 3.75Å
111	G	96.1	Very high	97.3	Very high	60 Å²	60	21.5 Å²	21.5	62%	0.619	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	-118.7	-174.7	0	0	0	0	0	112.3
112	S	96.4	Very high	96.9	Very high	61 Å²	61	20.7 Å²	20.7	43%	0.427	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	23.3	178.4	63.2	0	0	0	0	113.9	Y110 F141	Y110-S112 PolarHBondContact O-N 3.25Å; S112-F141 WeakPolarHBondContact O-CD2 3.38Å; S112-F141 PolarHBondContact O-N 3.25Å; S112-F141 VanDerWaalsContact O-N 3.14Å
113	S	98.3	Very high	96.1	Very high	8 Å²	8	24.2 Å²	24.2	6%	0.056	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	147.5	-176.5	-62.9	0	0	0	0	112	V109 Y110 E138 Y139	V109-S113 WeakPolarHBondContact CA-O 3.35Å; Y110-S113 PolarHBondContact N-O 3.21Å; Y110-S113 PolarHBondContact O-N 2.89Å; S113-E138 WeakPolarHBondContact CB-OE1 3.47Å; S113-E138 PolarHBondContact OG-OE1 3.42Å; S113-Y139 CarbonylContact C-O 3.6Å; S113-Y139 VanDerWaalsContact CA-O 3.27Å; S113-Y139 WeakPolarHBondContact CA-O 3.41Å
114	M	98.6	Very high	95.3	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	136.2	165.7	174.6	-179.7	63.3	0	0	108.9	V58 L79 A107 V108 V116 E138 Y139 F141 W146	V58-M114 HydrophobicContact CG1-SD 4.48Å; V58-M114 HydrophobicContact CG2-CG 4.04Å; V58-M114 HydrophobicContact CG2-SD 3.53Å; V58-M114 VanDerWaalsContact CG2-SD 3.53Å; L79-M114 HydrophobicContact CD1-CE 3.83Å; L79-M114 HydrophobicContact CD2-CE 4.34Å; A107-M114 HydrophobicContact CB-CG 4.4Å; A107-M114 HydrophobicContact CB-SD 4.38Å; V108-M114 CarbonylContact O-C 3.6Å; V108-M114 WeakPolarHBondContact O-CA 3.38Å; M114-V116 HydrophobicContact CE-CG2 4.38Å; M114-V116 HydrophobicContact CG-CG2 4.44Å; M114-E138 CarbonylContact O-C 3.56Å; M114-E138 WeakPolarHBondContact O-CA 3.3Å; M114-Y139 HydrophobicContact CE-CD1 4.04Å; M114-Y139 HydrophobicContact CE-CG 4.09Å; M114-Y139 PolarHBondContact N-O 3.42Å; M114-Y139 PolarHBondContact O-N 3.49Å; M114-F141 HydrophobicContact CB-CE1 4.27Å; M114-F141 HydrophobicContact CB-CE2 3.95Å; M114-F141 HydrophobicContact CB-CZ 3.59Å; M114-W146 HydrophobicContact CE-CH2 3.4Å; M114-W146 VanDerWaalsContact CE-CH2 3.4Å; M114-W146 HydrophobicContact CE-CZ2 3.76Å; M114-W146 HydrophobicContact CE-CZ3 4.32Å
115	F	98.6	Very high	94.4	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.018	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.3	175.9	-68.1	-93.5	0	0	0	109.9	A107 V108 Y110 L136 F137 E138 W149 L191	A107-F115 CarbonylContact C-O 3.53Å; A107-F115 WeakPolarHBondContact CA-O 3.32Å; V108-F115 HydrophobicContact CG2-CB 3.93Å; V108-F115 PolarHBondContact N-O 2.99Å; V108-F115 PolarHBondContact O-N 3.3Å; Y110-F115 HydrophobicContact CD1-CE2 4.24Å; F115-L136 HydrophobicContact CB-CD1 4.26Å; F115-L136 HydrophobicContact CD1-CD1 4.27Å; F115-F137 CarbonylContact C-O 3.55Å; F115-F137 VanDerWaalsContact CA-O 3.23Å; F115-F137 WeakPolarHBondContact CA-O 3.42Å; F115-E138 HydrophobicContact CD1-CB 4.19Å; F115-E138 HydrophobicContact CD1-CG 4.38Å; F115-E138 HydrophobicContact CE1-CB 3.91Å; F115-E138 HydrophobicContact CE1-CG 3.82Å; F115-E138 HydrophobicContact CE2-CG 4.49Å; F115-E138 HydrophobicContact CZ-CB 4.49Å; F115-E138 HydrophobicContact CZ-CG 3.89Å; F115-W149 HydrophobicContact CE1-CD2 4.41Å; F115-W149 AromaticContact CE1-CE2 3.78Å; F115-W149 HydrophobicContact CE1-CH2 4Å; F115-W149 AromaticContact CE1-CZ2 3.57Å; F115-W149 HydrophobicContact CE1-CZ2 3.57Å; F115-W149 HydrophobicContact CZ-CH2 4.39Å; F115-W149 HydrophobicContact CZ-CZ2 4Å; F115-L191 HydrophobicContact CD1-CD2 3.99Å; F115-L191 HydrophobicContact CD2-CD1 4.19Å; F115-L191 HydrophobicContact CE1-CD2 3.92Å; F115-L191 HydrophobicContact CE2-CD1 4.25Å; F115-L191 HydrophobicContact CG-CD2 4.32Å; F115-L191 HydrophobicContact CZ-CB 4.5Å; F115-L191 HydrophobicContact CZ-CD2 4.21Å
116	V	98.8	Very high	93.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.6	178.1	173	0	0	0	0	109.3	F67 P99 H105 S106 A107 M114 L136 F137 W146	F67-V116 HydrophobicContact CD1-CG1 4.27Å; F67-V116 HydrophobicContact CD1-CG2 3.94Å; F67-V116 HydrophobicContact CE1-CG1 4.01Å; F67-V116 HydrophobicContact CE1-CG2 4.23Å; P99-V116 HydrophobicContact CG-CG1 4.47Å; H105-V116 HydrophobicContact CB-CG1 4.31Å; S106-V116 WeakPolarHBondContact O-CA 3.36Å; A107-V116 HydrophobicContact CB-CG2 4.08Å; M114-V116 HydrophobicContact CE-CG2 4.38Å; M114-V116 HydrophobicContact CG-CG2 4.44Å; V116-L136 WeakPolarHBondContact O-CA 3.42Å; V116-F137 HydrophobicContact CB-CB 4.43Å; V116-F137 PolarHBondContact N-O 3.33Å; V116-F137 PolarHBondContact O-N 3.08Å; V116-W146 HydrophobicContact CB-CZ3 4.48Å; V116-W146 HydrophobicContact CG2-CH2 3.91Å; V116-W146 HydrophobicContact CG2-CZ3 4.04Å
117	F	98.6	Very high	92	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.8	179.7	179.7	-96.1	0	0	0	112.8	S106 N134 D135 L136 P156 R159 H162 I173 W199	S106-F117 PolarHBondContact N-O 2.68Å; S106-F117 VanDerWaalsContact N-O 3.12Å; S106-F117 PolarHBondContact O-N 3.13Å; F117-N134 HydrophobicContact CE2-CB 4.19Å; F117-N134 VanDerWaalsContact CE2-O 3.25Å; F117-N134 WeakPolarHBondContact CE2-O 3.23Å; F117-N134 HydrophobicContact CZ-CB 4.01Å; F117-D135 WeakPolarHBondContact CA-O 3.38Å; F117-D135 WeakPolarHBondContact CD2-O 3.47Å; F117-L136 HydrophobicContact CB-CD1 4.13Å; F117-L136 HydrophobicContact CD2-CB 4.27Å; F117-L136 HydrophobicContact CD2-CD1 4.44Å; F117-P156 HydrophobicContact CE2-CG 4.04Å; F117-P156 HydrophobicContact CZ-CB 4.26Å; F117-P156 HydrophobicContact CZ-CG 3.59Å; F117-R159 HydrophobicContact CE1-CG 3.97Å; F117-H162 AromaticContact CD1-CE1 3.65Å; F117-H162 AromaticContact CD1-NE2 3.44Å; F117-H162 WeakPolarHBondContact CD1-NE2 3.47Å; F117-H162 PolarHBondContact O-CE1 3.34Å; F117-I173 HydrophobicContact CD1-CD1 4.15Å; F117-I173 HydrophobicContact CD1-CG2 4.09Å; F117-I173 HydrophobicContact CE1-CD1 3.44Å; F117-I173 VanDerWaalsContact CE1-CD1 3.44Å; F117-I173 HydrophobicContact CE1-CG2 4.42Å; F117-I173 HydrophobicContact CZ-CD1 3.69Å; F117-W199 HydrophobicContact CD2-CH2 4.17Å; F117-W199 AromaticContact CD2-CZ2 3.7Å; F117-W199 HydrophobicContact CD2-CZ2 3.7Å; F117-W199 HydrophobicContact CE2-CH2 4.1Å; F117-W199 AromaticContact CE2-CZ2 3.54Å; F117-W199 HydrophobicContact CE2-CZ2 3.54Å; F117-W199 HydrophobicContact CZ-CH2 4.49Å; F117-W199 HydrophobicContact CZ-CZ2 4.29Å
118	G	97.9	Very high	90.8	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	62.3	-145.9	170.1	0	0	0	0	0	115.4	R102 H105 K133 D135	R102-G118 PolarHBondContact NH1-O 2.73Å; H105-G118 VanDerWaalsContact CB-O 3.28Å; H105-G118 WeakPolarHBondContact CB-O 3.42Å; G118-K133 WeakPolarHBondContact CA-O 3.42Å; G118-D135 PolarHBondContact N-O 3.24Å; G118-D135 VanDerWaalsContact N-O 3.17Å
119	G	96.9	Very high	89.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	96.7	175	-176	0	0	0	0	0	114.1	N132 K133 R159	G119-N132 CarbonylContact O-C 3.26Å; G119-N132 WeakPolarHBondContact O-CA 3.33Å; G119-K133 PolarHBondContact O-N 3.02Å; G119-R159 PolarHBondContact N-O 3.44Å
120	Y	92.9	Very high	89.1	Confident	28 Å²	28	45.8 Å²	45.8	11%	0.11	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133.8	177.4	-93.2	-72.9	0	0	0	111.4	M75 R102 Y103 L130 N132 S160 Y177 G179	M75-Y120 VanDerWaalsContact SD-O 3.41Å; R102-Y120 WeakPolarHBondContact CA-O 3.43Å; R102-Y120 WeakPolarHBondContact CB-O 3.42Å; Y103-Y120 HydrophobicContact CE2-CD2 4.43Å; Y103-Y120 PolarHBondContact N-O 3.05Å; Y103-Y120 PolarHBondContact O-N 3.24Å; Y120-L130 HydrophobicContact CD1-CB 4.24Å; Y120-L130 HydrophobicContact CE1-CB 4.38Å; Y120-N132 WeakPolarHBondContact CD2-OD1 3.39Å; Y120-N132 WeakPolarHBondContact CE1-OD1 3.04Å; Y120-N132 WeakPolarHBondContact CE2-OD1 3.45Å; Y120-N132 VanDerWaalsContact CZ-CG 3.46Å; Y120-N132 PolarHBondContact OH-ND2 3.02Å; Y120-S160 VanDerWaalsContact CD2-CB 3.43Å; Y120-S160 WeakPolarHBondContact CD2-OG 3.48Å; Y120-S160 WeakPolarHBondContact CE2-OG 3.34Å; Y120-Y177 AromaticContact CE2-CD1 3.98Å; Y120-Y177 HydrophobicContact CE2-CD1 3.98Å; Y120-Y177 HydrophobicContact CE2-CE1 4.46Å; Y120-Y177 WeakPolarHBondContact OH-CD1 3.44Å; Y120-Y177 WeakPolarHBondContact OH-CE1 3.41Å; Y120-G179 WeakPolarHBondContact OH-CA 3.42Å
121	T	93.4	Very high	88.8	Confident	14 Å²	14	49.4 Å²	49.4	9%	0.086	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	149.6	172.8	59	0	0	0	0	109.9	A100 R102 L130 K131 K133	A100-T121 HydrophobicContact CB-CG2 4.11Å; R102-T121 HydrophobicContact CB-CG2 3.93Å; T121-L130 WeakPolarHBondContact O-CA 3.32Å; T121-K131 PolarHBondContact N-O 2.86Å; T121-K131 PolarHBondContact O-N 2.58Å; T121-K131 PolarHBondContact OG1-O 3.34Å; T121-K131 VanDerWaalsContact OG1-O 3.1Å; T121-K133 HydrophobicContact CG2-CG 3.81Å; T121-K133 WeakPolarHBondContact OG1-CE 3.4Å
122	G	87.7	Confident	88.8	Confident	37 Å²	37	47.5 Å²	47.5	38%	0.381	26%	0.259	S	S	.	.	S	Bend	trans	141.3	-160.6	176.2	0	0	0	0	0	113.7	M75	M75-G122 WeakPolarHBondContact CE-O 3.49Å
123	D	82.2	Confident	88.8	Confident	75 Å²	75	48 Å²	48	40%	0.401	25%	0.253	S	S	.	.			trans	-96	130	172.5	-179.8	-5.7	0	0	0	109.8	Y125 S126	D123-Y125 PolarHBondContact O-N 2.86Å; D123-Y125 PolarHBondContact OD1-N 3Å; D123-S126 PolarHBondContact O-N 3.36Å
124	I	78.1	Confident	88.7	Confident	43 Å²	43	50.4 Å²	50.4	22%	0.221	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-29.7	-177.4	-66.1	179.7	0	0	0	111.9	D70 M75	D70-I124 HydrophobicContact CB-CD1 3.53Å; M75-I124 HydrophobicContact CE-CG1 4.08Å; M75-I124 HydrophobicContact CG-CD1 3.98Å; M75-I124 HydrophobicContact CG-CG1 3.71Å
125	Y	78.3	Confident	88.7	Confident	166 Å²	166	51.5 Å²	51.5	65%	0.651	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-5.5	-178.9	-59.4	-71.1	0	0	0	113.3	G72 K73 D123	G72-Y125 PolarHBondContact O-OH 2.76Å; K73-Y125 WeakPolarHBondContact O-CE2 3.33Å; D123-Y125 PolarHBondContact O-N 2.86Å; D123-Y125 PolarHBondContact OD1-N 3Å
126	S	76.3	Confident	88.6	Confident	32 Å²	32	51.4 Å²	51.4	22%	0.224	27%	0.271	C	S	.	.			trans	-124.9	99.9	-173.8	-168	0	0	0	0	111.9	D123 S128 N129	D123-S126 PolarHBondContact O-N 3.36Å; S126-S128 PolarHBondContact O-N 2.81Å; S126-S128 VanDerWaalsContact O-N 3.15Å; S126-S128 PolarHBondContact OG-OG 2.74Å; S126-N129 PolarHBondContact O-N 3.1Å
127	N	70.6	Confident	88.6	Confident	138 Å²	138	52 Å²	52	74%	0.738	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-61.7	-21.9	177.5	-71.3	-21.9	0	0	0	113.4	N129	N127-N129 VanDerWaalsContact C-N 3.29Å; N127-N129 PolarHBondContact O-N 2.8Å
128	S	71.8	Confident	88.6	Confident	98 Å²	98	52.9 Å²	52.9	69%	0.685	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-72.9	-18.6	-178.2	54.1	0	0	0	0	114	S126	S126-S128 PolarHBondContact O-N 2.81Å; S126-S128 VanDerWaalsContact O-N 3.15Å; S126-S128 PolarHBondContact OG-OG 2.74Å
129	N	78.6	Confident	88.7	Confident	96 Å²	96	53.1 Å²	53.1	51%	0.513	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-111.2	2.4	-177.9	-71.9	-31.2	0	0	0	113.8	S126 N127 K131	S126-N129 PolarHBondContact O-N 3.1Å; N127-N129 VanDerWaalsContact C-N 3.29Å; N127-N129 PolarHBondContact O-N 2.8Å; N129-K131 PolarHBondContact O-N 3.04Å
130	L	84	Confident	88.7	Confident	43 Å²	43	57 Å²	57	23%	0.225	30%	0.295	C	S	.	.			trans	-72.5	120.9	176.7	-68.5	177.1	0	0	0	110.4	M75 Y120 T121	M75-L130 HydrophobicContact CE-CD2 3.35Å; Y120-L130 HydrophobicContact CD1-CB 4.24Å; Y120-L130 HydrophobicContact CE1-CB 4.38Å; T121-L130 WeakPolarHBondContact O-CA 3.32Å
131	K	91.3	Very high	88.9	Confident	133 Å²	133	56.5 Å²	56.5	58%	0.578	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.4	179.1	-65.5	-175.9	-178.6	-178.4	0	110.9	T121 N129	T121-K131 PolarHBondContact N-O 2.86Å; T121-K131 PolarHBondContact O-N 2.58Å; T121-K131 PolarHBondContact OG1-O 3.34Å; T121-K131 VanDerWaalsContact OG1-O 3.1Å; N129-K131 PolarHBondContact O-N 3.04Å
132	N	95.2	Very high	89.1	Confident	20 Å²	20	60 Å²	60	11%	0.107	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	154.5	165.4	-78.4	-49.6	0	0	0	110.6	G119 Y120 A158 S160 Y177 D178 G179	G119-N132 CarbonylContact O-C 3.26Å; G119-N132 WeakPolarHBondContact O-CA 3.33Å; Y120-N132 WeakPolarHBondContact CD2-OD1 3.39Å; Y120-N132 WeakPolarHBondContact CE1-OD1 3.04Å; Y120-N132 WeakPolarHBondContact CE2-OD1 3.45Å; Y120-N132 VanDerWaalsContact CZ-CG 3.46Å; Y120-N132 PolarHBondContact OH-ND2 3.02Å; N132-A158 HydrophobicContact CB-CB 3.88Å; N132-S160 WeakPolarHBondContact OD1-CB 3.24Å; N132-S160 PolarHBondContact OD1-N 3.33Å; N132-S160 PolarHBondContact OD1-OG 3.48Å; N132-Y177 PolarHBondContact ND2-O 3.26Å; N132-D178 PolarHBondContact ND2-O 2.79Å; N132-G179 PolarHBondContact ND2-N 3.47Å; N132-G179 VanDerWaalsContact ND2-N 3.16Å
133	K	96.9	Very high	89.5	Confident	71 Å²	71	61.7 Å²	61.7	31%	0.309	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	157.7	174.2	-60.3	-66.6	-176.7	169.9	0	111.2	G118 G119 T121 D135 A158 R159	G118-K133 WeakPolarHBondContact CA-O 3.42Å; G119-K133 PolarHBondContact O-N 3.02Å; T121-K133 HydrophobicContact CG2-CG 3.81Å; T121-K133 WeakPolarHBondContact OG1-CE 3.4Å; K133-D135 WeakPolarHBondContact CB-OD1 3.23Å; K133-A158 CarbonylContact O-C 3.59Å; K133-A158 WeakPolarHBondContact O-CA 3.41Å; K133-R159 PolarHBondContact O-N 2.83Å
134	N	96.9	Very high	90.2	Very high	59 Å²	59	58.2 Å²	58.2	32%	0.316	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	24.1	167.3	58.2	-12.2	0	0	0	110.6	F117 P156 A158	F117-N134 HydrophobicContact CE2-CB 4.19Å; F117-N134 VanDerWaalsContact CE2-O 3.25Å; F117-N134 WeakPolarHBondContact CE2-O 3.23Å; F117-N134 HydrophobicContact CZ-CB 4.01Å; N134-P156 WeakPolarHBondContact CB-O 3.34Å; N134-P156 PolarHBondContact ND2-O 3.18Å; N134-A158 HydrophobicContact CB-CB 4.31Å
135	D	97.3	Very high	91.1	Very high	23 Å²	23	60.2 Å²	60.2	12%	0.123	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	146.2	176.2	52.3	4.1	0	0	0	110.4	R102 F117 G118 K133 F137	R102-D135 IonicContact CZ-OD1 3.16Å; R102-D135 IonicContact CZ-OD2 3.72Å; R102-D135 IonicContact NH1-OD1 2.88Å; R102-D135 PolarHBondContact NH1-OD1 3.24Å; R102-D135 IonicContact NH1-OD2 3.45Å; R102-D135 PolarHBondContact NH1-OD2 2.72Å; R102-D135 IonicContact NH2-OD1 2.94Å; R102-D135 IonicContact NH2-OD2 2.75Å; R102-D135 PolarHBondContact NH2-OD2 2.75Å; F117-D135 WeakPolarHBondContact CA-O 3.38Å; F117-D135 WeakPolarHBondContact CD2-O 3.47Å; G118-D135 PolarHBondContact N-O 3.24Å; G118-D135 VanDerWaalsContact N-O 3.17Å; K133-D135 WeakPolarHBondContact CB-OD1 3.23Å; D135-F137 HydrophobicContact CB-CD2 4.17Å; D135-F137 HydrophobicContact CB-CE2 3.75Å; D135-F137 WeakPolarHBondContact OD2-CE2 3.38Å
136	L	98.1	Very high	92.1	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.016	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.1	175.7	179.8	63.2	0	0	0	108.7	F115 V116 F117 W149 L171 I189 W199	F115-L136 HydrophobicContact CB-CD1 4.26Å; F115-L136 HydrophobicContact CD1-CD1 4.27Å; V116-L136 WeakPolarHBondContact O-CA 3.42Å; F117-L136 HydrophobicContact CB-CD1 4.13Å; F117-L136 HydrophobicContact CD2-CB 4.27Å; F117-L136 HydrophobicContact CD2-CD1 4.44Å; L136-W149 HydrophobicContact CB-CB 4.22Å; L136-W149 HydrophobicContact CD2-CB 4.13Å; L136-W149 HydrophobicContact CD2-CD2 4.24Å; L136-W149 HydrophobicContact CD2-CE3 3.88Å; L136-W149 HydrophobicContact CD2-CG 4.39Å; L136-W149 HydrophobicContact CG-CB 4.18Å; L136-W149 PolarHBondContact O-N 3.21Å; L136-L171 HydrophobicContact CD1-CD2 3.91Å; L136-I189 HydrophobicContact CD2-CD1 4.38Å; L136-W199 HydrophobicContact CD2-CZ2 4.47Å
137	F	98.4	Very high	93.1	Very high	13 Å²	13	52.3 Å²	52.3	6%	0.057	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.2	178.6	-79.5	-102	0	0	0	110.9	P99 F115 V116 D135 W146 E148	P99-F137 HydrophobicContact CB-CD1 4.4Å; P99-F137 HydrophobicContact CB-CD2 4.03Å; P99-F137 HydrophobicContact CB-CE1 4.48Å; P99-F137 HydrophobicContact CB-CE2 4.14Å; P99-F137 HydrophobicContact CB-CG 4.18Å; P99-F137 HydrophobicContact CB-CZ 4.37Å; P99-F137 HydrophobicContact CG-CB 3.81Å; P99-F137 HydrophobicContact CG-CD1 3.82Å; P99-F137 HydrophobicContact CG-CD2 3.91Å; P99-F137 HydrophobicContact CG-CE1 4.34Å; P99-F137 HydrophobicContact CG-CE2 4.43Å; P99-F137 HydrophobicContact CG-CG 3.58Å; F115-F137 CarbonylContact C-O 3.55Å; F115-F137 VanDerWaalsContact CA-O 3.23Å; F115-F137 WeakPolarHBondContact CA-O 3.42Å; V116-F137 HydrophobicContact CB-CB 4.43Å; V116-F137 PolarHBondContact N-O 3.33Å; V116-F137 PolarHBondContact O-N 3.08Å; D135-F137 HydrophobicContact CB-CD2 4.17Å; D135-F137 HydrophobicContact CB-CE2 3.75Å; D135-F137 WeakPolarHBondContact OD2-CE2 3.38Å; F137-W146 HydrophobicContact CB-CE3 4.06Å; F137-W146 HydrophobicContact CB-CZ3 4Å; F137-W146 HydrophobicContact CD1-CE3 4.47Å; F137-E148 HydrophobicContact CD1-CB 4.05Å; F137-E148 HydrophobicContact CD2-CG 4.47Å; F137-E148 HydrophobicContact CE1-CB 3.69Å; F137-E148 HydrophobicContact CE1-CG 4.19Å; F137-E148 HydrophobicContact CE2-CB 4.41Å; F137-E148 HydrophobicContact CE2-CG 4.01Å; F137-E148 HydrophobicContact CZ-CB 3.88Å; F137-E148 HydrophobicContact CZ-CG 3.85Å
138	E	98.4	Very high	94.4	Very high	18 Å²	18	49.7 Å²	49.7	8%	0.084	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.1	172.2	-174.8	-169.1	178.5	0	0	109.6	S113 M114 F115 K140 W146 T147 W149	S113-E138 WeakPolarHBondContact CB-OE1 3.47Å; S113-E138 PolarHBondContact OG-OE1 3.42Å; M114-E138 CarbonylContact O-C 3.56Å; M114-E138 WeakPolarHBondContact O-CA 3.3Å; F115-E138 HydrophobicContact CD1-CB 4.19Å; F115-E138 HydrophobicContact CD1-CG 4.38Å; F115-E138 HydrophobicContact CE1-CB 3.91Å; F115-E138 HydrophobicContact CE1-CG 3.82Å; F115-E138 HydrophobicContact CE2-CG 4.49Å; F115-E138 HydrophobicContact CZ-CB 4.49Å; F115-E138 HydrophobicContact CZ-CG 3.89Å; E138-K140 HydrophobicContact CG-CG 4.47Å; E138-K140 WeakPolarHBondContact OE1-CE 3.38Å; E138-W146 CarbonylContact O-C 3.38Å; E138-W146 WeakPolarHBondContact O-CA 3.42Å; E138-T147 PolarHBondContact N-O 3.3Å; E138-T147 PolarHBondContact O-N 2.78Å; E138-W149 PolarHBondContact OE2-NE1 3.12Å
139	Y	98.6	Very high	95.5	Very high	5 Å²	5	45.7 Å²	45.7	2%	0.02	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.6	167	174.8	-100.4	0	0	0	109.7	Y65 L79 F93 T94 S113 M114 F141 G144 Q145 W146	Y65-Y139 HydrophobicContact CE1-CE1 4.47Å; L79-Y139 HydrophobicContact CD2-CD1 3.95Å; L79-Y139 HydrophobicContact CD2-CD2 4.04Å; L79-Y139 HydrophobicContact CD2-CE1 3.53Å; L79-Y139 HydrophobicContact CD2-CE2 3.61Å; L79-Y139 HydrophobicContact CD2-CG 4.17Å; F93-Y139 PolarHBondContact O-OH 3.37Å; T94-Y139 HydrophobicContact CG2-CE2 4.13Å; S113-Y139 CarbonylContact C-O 3.6Å; S113-Y139 VanDerWaalsContact CA-O 3.27Å; S113-Y139 WeakPolarHBondContact CA-O 3.41Å; M114-Y139 HydrophobicContact CE-CD1 4.04Å; M114-Y139 HydrophobicContact CE-CG 4.09Å; M114-Y139 PolarHBondContact N-O 3.42Å; M114-Y139 PolarHBondContact O-N 3.49Å; Y139-F141 AromaticContact CD1-CD1 3.97Å; Y139-F141 HydrophobicContact CD1-CD1 3.97Å; Y139-F141 HydrophobicContact CD1-CE1 4.18Å; Y139-F141 HydrophobicContact CD1-CG 4.48Å; Y139-F141 AromaticContact CE1-CD1 3.72Å; Y139-F141 HydrophobicContact CE1-CD1 3.72Å; Y139-F141 HydrophobicContact CE1-CE1 4.2Å; Y139-F141 HydrophobicContact CE1-CG 4.39Å; Y139-F141 PolarHBondContact O-N 3.05Å; Y139-G144 VanDerWaalsContact CE2-CA 3.44Å; Y139-G144 VanDerWaalsContact CE2-O 3.26Å; Y139-G144 WeakPolarHBondContact CE2-O 3.31Å; Y139-Q145 WeakPolarHBondContact CA-O 3.44Å; Y139-W146 AromaticContact CD2-CD1 3.7Å; Y139-W146 AromaticContact CD2-CD2 3.81Å; Y139-W146 HydrophobicContact CD2-CD2 3.81Å; Y139-W146 AromaticContact CD2-CE2 3.46Å; Y139-W146 VanDerWaalsContact CD2-CE2 3.46Å; Y139-W146 AromaticContact CD2-CG 3.98Å; Y139-W146 HydrophobicContact CD2-CG 3.98Å; Y139-W146 AromaticContact CD2-CZ2 3.98Å; Y139-W146 HydrophobicContact CD2-CZ2 3.98Å; Y139-W146 AromaticContact CD2-NE1 3.36Å; Y139-W146 AromaticContact CE2-NE1 3.8Å; Y139-W146 HydrophobicContact CG-CD2 4.28Å; Y139-W146 AromaticContact CG-CE2 3.97Å; Y139-W146 HydrophobicContact CG-CH2 4.47Å; Y139-W146 HydrophobicContact CG-CZ2 4.08Å
140	K	98	Very high	96.2	Very high	81 Å²	81	49.2 Å²	49.2	35%	0.352	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	112.9	177.6	-68.8	-176.6	177.9	-176.3	0	110.2	E138 A142 T143 G144 Q145	E138-K140 HydrophobicContact CG-CG 4.47Å; E138-K140 WeakPolarHBondContact OE1-CE 3.38Å; K140-A142 PolarHBondContact O-N 3.19Å; K140-T143 WeakPolarHBondContact CB-OG1 3.37Å; K140-T143 PolarHBondContact O-N 3.33Å; K140-G144 WeakPolarHBondContact O-CA 3.41Å; K140-G144 PolarHBondContact O-N 3.39Å; K140-Q145 PolarHBondContact N-O 2.87Å
141	F	97.8	Very high	96.7	Very high	19 Å²	19	48.3 Å²	48.3	8%	0.083	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.5	-177.1	-69.4	-70.2	0	0	0	113.3	V58 Y60 Y65 V109 S112 M114 Y139	V58-F141 HydrophobicContact CG2-CZ 4.21Å; Y60-F141 HydrophobicContact CD1-CB 3.63Å; Y60-F141 AromaticContact CD1-CD1 3.84Å; Y60-F141 HydrophobicContact CD1-CD1 3.84Å; Y60-F141 AromaticContact CD1-CD2 3.61Å; Y60-F141 HydrophobicContact CD1-CD2 3.61Å; Y60-F141 HydrophobicContact CD1-CE1 4.38Å; Y60-F141 HydrophobicContact CD1-CE2 4.18Å; Y60-F141 AromaticContact CD1-CG 3.42Å; Y60-F141 HydrophobicContact CD1-CG 3.42Å; Y60-F141 VanDerWaalsContact CD1-CG 3.42Å; Y60-F141 AromaticContact CD2-CD2 3.49Å; Y60-F141 HydrophobicContact CD2-CD2 3.49Å; Y60-F141 VanDerWaalsContact CD2-CD2 3.49Å; Y60-F141 AromaticContact CD2-CE2 3.6Å; Y60-F141 HydrophobicContact CD2-CE2 3.6Å; Y60-F141 HydrophobicContact CD2-CG 4.21Å; Y60-F141 HydrophobicContact CD2-CZ 4.37Å; Y60-F141 HydrophobicContact CE1-CB 3.44Å; Y60-F141 VanDerWaalsContact CE1-CB 3.44Å; Y60-F141 AromaticContact CE1-CD2 3.9Å; Y60-F141 HydrophobicContact CE1-CD2 3.9Å; Y60-F141 AromaticContact CE1-CG 3.74Å; Y60-F141 HydrophobicContact CE1-CG 3.74Å; Y60-F141 AromaticContact CE2-CD2 3.8Å; Y60-F141 HydrophobicContact CE2-CD2 3.8Å; Y60-F141 HydrophobicContact CE2-CE2 4.3Å; Y60-F141 HydrophobicContact CE2-CG 4.48Å; Y60-F141 HydrophobicContact CG-CB 4.33Å; Y60-F141 HydrophobicContact CG-CD1 4.05Å; Y60-F141 AromaticContact CG-CD2 3.39Å; Y60-F141 HydrophobicContact CG-CD2 3.39Å; Y60-F141 HydrophobicContact CG-CE1 4.16Å; Y60-F141 AromaticContact CG-CE2 3.53Å; Y60-F141 HydrophobicContact CG-CE2 3.53Å; Y60-F141 AromaticContact CG-CG 3.68Å; Y60-F141 HydrophobicContact CG-CG 3.68Å; Y60-F141 AromaticContact CG-CZ 3.9Å; Y60-F141 HydrophobicContact CG-CZ 3.9Å; Y60-F141 AromaticContact CZ-CD2 3.98Å; Y65-F141 HydrophobicContact CD1-CD1 4.32Å; Y65-F141 AromaticContact CD1-CE1 3.97Å; Y65-F141 HydrophobicContact CD1-CE1 3.97Å; Y65-F141 HydrophobicContact CD2-CD1 4.21Å; Y65-F141 AromaticContact CD2-CE1 3.59Å; Y65-F141 HydrophobicContact CD2-CE1 3.59Å; Y65-F141 HydrophobicContact CD2-CZ 4.43Å; Y65-F141 AromaticContact CE1-CD1 3.89Å; Y65-F141 HydrophobicContact CE1-CD1 3.89Å; Y65-F141 HydrophobicContact CE1-CE1 4Å; Y65-F141 AromaticContact CE2-CD1 3.79Å; Y65-F141 HydrophobicContact CE2-CD1 3.79Å; Y65-F141 AromaticContact CE2-CE1 3.65Å; Y65-F141 HydrophobicContact CE2-CE1 3.65Å; Y65-F141 HydrophobicContact CG-CD1 4.46Å; Y65-F141 AromaticContact CG-CE1 3.76Å; Y65-F141 HydrophobicContact CG-CE1 3.76Å; Y65-F141 AromaticContact CZ-CD1 3.6Å; Y65-F141 AromaticContact CZ-CE1 3.84Å; V109-F141 HydrophobicContact CG1-CE2 4.13Å; V109-F141 HydrophobicContact CG2-CE2 3.97Å; V109-F141 HydrophobicContact CG2-CZ 3.91Å; S112-F141 WeakPolarHBondContact O-CD2 3.38Å; S112-F141 PolarHBondContact O-N 3.25Å; S112-F141 VanDerWaalsContact O-N 3.14Å; M114-F141 HydrophobicContact CB-CE1 4.27Å; M114-F141 HydrophobicContact CB-CE2 3.95Å; M114-F141 HydrophobicContact CB-CZ 3.59Å; Y139-F141 AromaticContact CD1-CD1 3.97Å; Y139-F141 HydrophobicContact CD1-CD1 3.97Å; Y139-F141 HydrophobicContact CD1-CE1 4.18Å; Y139-F141 HydrophobicContact CD1-CG 4.48Å; Y139-F141 AromaticContact CE1-CD1 3.72Å; Y139-F141 HydrophobicContact CE1-CD1 3.72Å; Y139-F141 HydrophobicContact CE1-CE1 4.2Å; Y139-F141 HydrophobicContact CE1-CG 4.39Å; Y139-F141 PolarHBondContact O-N 3.05Å
142	A	96.1	Very high	96.5	Very high	88 Å²	88	50.5 Å²	50.5	73%	0.727	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-34.2	-177.6	0	0	0	0	0	113.8	K140	K140-A142 PolarHBondContact O-N 3.19Å
143	T	96.8	Very high	96.1	Very high	72 Å²	72	52.8 Å²	52.8	44%	0.442	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-14.2	-174.6	61.1	0	0	0	0	113.2	F93 K140 Q145	F93-T143 WeakPolarHBondContact CE1-O 3.17Å; K140-T143 WeakPolarHBondContact CB-OG1 3.37Å; K140-T143 PolarHBondContact O-N 3.33Å; T143-Q145 PolarHBondContact O-N 2.93Å; T143-Q145 WeakPolarHBondContact OG1-CB 3.48Å; T143-Q145 PolarHBondContact OG1-N 3.27Å
144	G	96.9	Very high	95.9	Very high	2 Å²	2	53.1 Å²	53.1	2%	0.021	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	13.3	-171.7	0	0	0	0	0	114.1	F93 T94 T95 Y139 K140	F93-G144 WeakPolarHBondContact O-CA 3.42Å; T94-G144 CarbonylContact C-O 3.58Å; T94-G144 VanDerWaalsContact CA-O 3.3Å; T94-G144 WeakPolarHBondContact CA-O 3.29Å; T95-G144 PolarHBondContact N-O 3.01Å; Y139-G144 VanDerWaalsContact CE2-CA 3.44Å; Y139-G144 VanDerWaalsContact CE2-O 3.26Å; Y139-G144 WeakPolarHBondContact CE2-O 3.31Å; K140-G144 WeakPolarHBondContact O-CA 3.41Å; K140-G144 PolarHBondContact O-N 3.39Å
145	Q	97.9	Very high	95.9	Very high	84 Å²	84	53.7 Å²	53.7	39%	0.393	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.4	-174	-171.5	179.4	16.1	0	0	111.8	T95 Y139 K140 T143	T95-Q145 WeakPolarHBondContact OG1-CA 3.3Å; Y139-Q145 WeakPolarHBondContact CA-O 3.44Å; K140-Q145 PolarHBondContact N-O 2.87Å; T143-Q145 PolarHBondContact O-N 2.93Å; T143-Q145 WeakPolarHBondContact OG1-CB 3.48Å; T143-Q145 PolarHBondContact OG1-N 3.27Å
146	W	98.5	Very high	95.9	Very high	6 Å²	6	52.6 Å²	52.6	2%	0.023	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	138	166	-75.2	99.9	0	0	0	111.5	F67 L79 T95 T97 P98 P99 M114 V116 F137 E138 Y139	F67-W146 HydrophobicContact CD2-CH2 4.12Å; F67-W146 AromaticContact CD2-CZ2 3.88Å; F67-W146 HydrophobicContact CD2-CZ2 3.88Å; F67-W146 HydrophobicContact CE1-CH2 4.42Å; F67-W146 AromaticContact CE2-CH2 3.98Å; F67-W146 HydrophobicContact CE2-CH2 3.98Å; F67-W146 AromaticContact CE2-CZ2 3.73Å; F67-W146 HydrophobicContact CE2-CZ2 3.73Å; F67-W146 HydrophobicContact CG-CH2 4.39Å; F67-W146 HydrophobicContact CZ-CH2 4.17Å; F67-W146 HydrophobicContact CZ-CZ2 4.33Å; L79-W146 HydrophobicContact CD2-CZ2 4.25Å; T95-W146 PolarHBondContact O-N 3.32Å; T97-W146 WeakPolarHBondContact O-CB 3.29Å; P98-W146 HydrophobicContact CB-CD2 4.32Å; P98-W146 HydrophobicContact CB-CG 4.05Å; P99-W146 HydrophobicContact CG-CE3 4.12Å; P99-W146 HydrophobicContact CG-CH2 4.25Å; P99-W146 HydrophobicContact CG-CZ3 3.81Å; M114-W146 HydrophobicContact CE-CH2 3.4Å; M114-W146 VanDerWaalsContact CE-CH2 3.4Å; M114-W146 HydrophobicContact CE-CZ2 3.76Å; M114-W146 HydrophobicContact CE-CZ3 4.32Å; V116-W146 HydrophobicContact CB-CZ3 4.48Å; V116-W146 HydrophobicContact CG2-CH2 3.91Å; V116-W146 HydrophobicContact CG2-CZ3 4.04Å; F137-W146 HydrophobicContact CB-CE3 4.06Å; F137-W146 HydrophobicContact CB-CZ3 4Å; F137-W146 HydrophobicContact CD1-CE3 4.47Å; E138-W146 CarbonylContact O-C 3.38Å; E138-W146 WeakPolarHBondContact O-CA 3.42Å; Y139-W146 AromaticContact CD2-CD1 3.7Å; Y139-W146 AromaticContact CD2-CD2 3.81Å; Y139-W146 HydrophobicContact CD2-CD2 3.81Å; Y139-W146 AromaticContact CD2-CE2 3.46Å; Y139-W146 VanDerWaalsContact CD2-CE2 3.46Å; Y139-W146 AromaticContact CD2-CG 3.98Å; Y139-W146 HydrophobicContact CD2-CG 3.98Å; Y139-W146 AromaticContact CD2-CZ2 3.98Å; Y139-W146 HydrophobicContact CD2-CZ2 3.98Å; Y139-W146 AromaticContact CD2-NE1 3.36Å; Y139-W146 AromaticContact CE2-NE1 3.8Å; Y139-W146 HydrophobicContact CG-CD2 4.28Å; Y139-W146 AromaticContact CG-CE2 3.97Å; Y139-W146 HydrophobicContact CG-CH2 4.47Å; Y139-W146 HydrophobicContact CG-CZ2 4.08Å
147	T	97.2	Very high	95.8	Very high	27 Å²	27	55.7 Å²	55.7	17%	0.166	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	127.7	177.5	-63.2	0	0	0	0	110.7	E138 R194	E138-T147 PolarHBondContact N-O 3.3Å; E138-T147 PolarHBondContact O-N 2.78Å; T147-R194 VanDerWaalsContact CG2-NH1 3.32Å
148	E	97.1	Very high	95.8	Very high	83 Å²	83	56.4 Å²	56.4	39%	0.388	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	128	173.2	-173.1	-178.3	-171.4	0	0	110.6	F137 K150 R194	F137-E148 HydrophobicContact CD1-CB 4.05Å; F137-E148 HydrophobicContact CD2-CG 4.47Å; F137-E148 HydrophobicContact CE1-CB 3.69Å; F137-E148 HydrophobicContact CE1-CG 4.19Å; F137-E148 HydrophobicContact CE2-CB 4.41Å; F137-E148 HydrophobicContact CE2-CG 4.01Å; F137-E148 HydrophobicContact CZ-CB 3.88Å; F137-E148 HydrophobicContact CZ-CG 3.85Å; E148-K150 PolarHBondContact O-N 2.65Å; E148-R194 PolarHBondContact O-NH2 3.43Å
149	W	96.2	Very high	95.7	Very high	13 Å²	13	55.6 Å²	55.6	5%	0.049	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	109.4	170.4	-78.5	37.4	0	0	0	109.2	F115 L136 E138 V151 L191 R194 A197	F115-W149 HydrophobicContact CE1-CD2 4.41Å; F115-W149 AromaticContact CE1-CE2 3.78Å; F115-W149 HydrophobicContact CE1-CH2 4Å; F115-W149 AromaticContact CE1-CZ2 3.57Å; F115-W149 HydrophobicContact CE1-CZ2 3.57Å; F115-W149 HydrophobicContact CZ-CH2 4.39Å; F115-W149 HydrophobicContact CZ-CZ2 4Å; L136-W149 HydrophobicContact CB-CB 4.22Å; L136-W149 HydrophobicContact CD2-CB 4.13Å; L136-W149 HydrophobicContact CD2-CD2 4.24Å; L136-W149 HydrophobicContact CD2-CE3 3.88Å; L136-W149 HydrophobicContact CD2-CG 4.39Å; L136-W149 HydrophobicContact CG-CB 4.18Å; L136-W149 PolarHBondContact O-N 3.21Å; E138-W149 PolarHBondContact OE2-NE1 3.12Å; W149-V151 HydrophobicContact CB-CG2 4.44Å; W149-V151 PolarHBondContact O-N 3.42Å; W149-L191 HydrophobicContact CZ3-CD2 4.4Å; W149-R194 HydrophobicContact CD2-CB 4.22Å; W149-R194 HydrophobicContact CD2-CG 3.69Å; W149-R194 HydrophobicContact CE3-CB 4.39Å; W149-R194 HydrophobicContact CE3-CG 4.12Å; W149-R194 HydrophobicContact CG-CG 4.02Å; W149-R194 HydrophobicContact CH2-CB 3.92Å; W149-R194 HydrophobicContact CH2-CG 4.46Å; W149-R194 HydrophobicContact CZ2-CB 3.7Å; W149-R194 HydrophobicContact CZ2-CG 4.05Å; W149-R194 HydrophobicContact CZ3-CB 4.26Å; W149-R194 HydrophobicContact CZ3-CG 4.49Å; W149-A197 HydrophobicContact CE3-CB 3.89Å; W149-A197 HydrophobicContact CZ3-CB 3.63Å
150	K	93.4	Very high	95.6	Very high	171 Å²	171	55.4 Å²	55.4	74%	0.743	32%	0.316	S	S	*	.			trans	-88.4	100.7	174.1	-65.5	-172.9	178.1	-175.7	0	108.3	E148	E148-K150 PolarHBondContact O-N 2.65Å
151	V	92.9	Very high	95.6	Very high	23 Å²	23	52 Å²	52	14%	0.139	30%	0.303	C	S	.	.			trans	-101	133	-179.7	178.6	0	0	0	0	108.7	W149 L155 I189 A197	W149-V151 HydrophobicContact CB-CG2 4.44Å; W149-V151 PolarHBondContact O-N 3.42Å; V151-L155 HydrophobicContact CB-CD2 4.33Å; V151-L155 HydrophobicContact CG1-CD2 4.2Å; V151-I189 HydrophobicContact CG1-CD1 4.17Å; V151-I189 HydrophobicContact CG2-CD1 3.79Å; V151-A197 WeakPolarHBondContact CG1-O 3.45Å
152	E	87.6	Confident	95.6	Very high	179 Å²	179	51.7 Å²	51.7	84%	0.836	30%	0.302	S	S	*	.			trans	-99.1	163.7	176.7	-62.1	-172.9	174.3	0	0	111.1
153	G	88	Confident	95.6	Very high	69 Å²	69	47.6 Å²	47.6	71%	0.711	27%	0.269	S	S	*	.	S	Bend	trans	98.7	-148.7	177	0	0	0	0	0	114
154	S	92.3	Very high	95.7	Very high	77 Å²	77	45 Å²	45	54%	0.538	26%	0.255	S	S	.	.	S	Bend	trans	-69.9	129.4	177.2	-165.6	0	0	0	0	109.2	W187 W199	S154-W187 WeakPolarHBondContact OG-CH2 3.49Å; S154-W199 WeakPolarHBondContact O-CB 3.23Å
155	L	95.7	Very high	95.7	Very high	72 Å²	72	45.8 Å²	45.8	38%	0.377	26%	0.259	S	S	.	.			trans	-121.5	142.4	-178	-62.2	177	0	0	0	110	V151 V157	V151-L155 HydrophobicContact CB-CD2 4.33Å; V151-L155 HydrophobicContact CG1-CD2 4.2Å; L155-V157 PolarHBondContact O-N 3.47Å
156	P	97.1	Very high	95.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-57.5	142.8	166.6	25.1	-34.2	0	0	0	109.8	F117 N134 I173 W187 W199	F117-P156 HydrophobicContact CE2-CG 4.04Å; F117-P156 HydrophobicContact CZ-CB 4.26Å; F117-P156 HydrophobicContact CZ-CG 3.59Å; N134-P156 WeakPolarHBondContact CB-O 3.34Å; N134-P156 PolarHBondContact ND2-O 3.18Å; P156-I173 HydrophobicContact CB-CD1 3.75Å; P156-I173 HydrophobicContact CG-CD1 3.84Å; P156-W187 HydrophobicContact CB-CB 4.46Å; P156-W187 HydrophobicContact CB-CD2 3.84Å; P156-W187 HydrophobicContact CB-CE3 4.33Å; P156-W187 HydrophobicContact CB-CG 3.89Å; P156-W199 VanDerWaalsContact CD-CG 3.49Å; P156-W199 HydrophobicContact CG-CD2 3.89Å; P156-W199 HydrophobicContact CG-CE3 4.17Å; P156-W199 HydrophobicContact CG-CG 4.25Å; P156-W199 HydrophobicContact CG-CZ2 4.35Å
157	V	96.9	Very high	95.7	Very high	67 Å²	67	46 Å²	46	41%	0.406	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-56.3	145.1	172.5	-64.5	0	0	0	0	110.8	L155 R159 D178 L183	L155-V157 PolarHBondContact O-N 3.47Å; V157-R159 PolarHBondContact O-N 2.8Å; V157-R159 PolarHBondContact O-NE 2.79Å; V157-D178 HydrophobicContact CG2-CB 4.11Å; V157-L183 HydrophobicContact CG2-CD1 3.59Å; V157-L183 HydrophobicContact CG2-CD2 4.46Å
158	A	97.4	Very high	95.6	Very high	29 Å²	29	50.9 Å²	50.9	24%	0.24	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-55.8	123	173.9	0	0	0	0	0	110	N132 K133 N134 D178	N132-A158 HydrophobicContact CB-CB 3.88Å; K133-A158 CarbonylContact O-C 3.59Å; K133-A158 WeakPolarHBondContact O-CA 3.41Å; N134-A158 HydrophobicContact CB-CB 4.31Å; A158-D178 WeakPolarHBondContact O-CA 3.22Å
159	R	97.6	Very high	95.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.282	C	S	.	.			trans	-146.9	160.6	-168.5	67.2	-176.5	71.6	-158	2.8	113.1	F117 G119 K133 V157 H162 A175 Y177 L183 D185	F117-R159 HydrophobicContact CE1-CG 3.97Å; G119-R159 PolarHBondContact N-O 3.44Å; K133-R159 PolarHBondContact O-N 2.83Å; V157-R159 PolarHBondContact O-N 2.8Å; V157-R159 PolarHBondContact O-NE 2.79Å; R159-H162 HydrophobicContact CG-CB 4.42Å; R159-A175 PolarHBondContact NH1-O 3.48Å; R159-Y177 CarbonylContact C-O 3.57Å; R159-Y177 VanDerWaalsContact CA-O 3.3Å; R159-Y177 WeakPolarHBondContact CA-O 3.43Å; R159-L183 HydrophobicContact CB-CD1 4.29Å; R159-D185 IonicContact CZ-OD1 2.71Å; R159-D185 IonicContact CZ-OD2 3.96Å; R159-D185 VanDerWaalsContact NH1-CG 3.34Å; R159-D185 IonicContact NH1-OD1 2.76Å; R159-D185 PolarHBondContact NH1-OD1 3.42Å; R159-D185 IonicContact NH1-OD2 2.6Å; R159-D185 PolarHBondContact NH1-OD2 3.01Å; R159-D185 IonicContact NH2-OD1 3.51Å; R159-D185 IonicContact NH2-OD2 3.82Å; R159-D185 PolarHBondContact NH2-OD2 3.22Å
160	S	96.9	Very high	95.6	Very high	1 Å²	1	52 Å²	52	1%	0.007	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-137.7	168.4	172.3	58.8	0	0	0	0	110.8	H104 Y120 N132 H162 G176 Y177	H104-S160 WeakPolarHBondContact O-CA 3.48Å; Y120-S160 VanDerWaalsContact CD2-CB 3.43Å; Y120-S160 WeakPolarHBondContact CD2-OG 3.48Å; Y120-S160 WeakPolarHBondContact CE2-OG 3.34Å; N132-S160 WeakPolarHBondContact OD1-CB 3.24Å; N132-S160 PolarHBondContact OD1-N 3.33Å; N132-S160 PolarHBondContact OD1-OG 3.48Å; S160-H162 PolarHBondContact O-N 2.92Å; S160-G176 CarbonylContact O-C 3.54Å; S160-G176 WeakPolarHBondContact O-CA 3.33Å; S160-Y177 PolarHBondContact N-O 3.09Å; S160-Y177 PolarHBondContact O-N 2.71Å; S160-Y177 PolarHBondContact OG-O 3.44Å
161	A	96.4	Very high	95.9	Very high	10 Å²	10	44 Å²	44	8%	0.083	26%	0.257	C	S	.	.	S	Bend	trans	53.8	31.4	175.8	0	0	0	0	0	113.2	H104 C213 N214	H104-A161 HydrophobicContact CB-CB 4.07Å; H104-A161 PolarHBondContact O-N 3.24Å; A161-C213 HydrophobicContact CB-CB 3.96Å; A161-C213 CarbonylContact O-C 3.59Å; A161-C213 VanDerWaalsContact O-CA 3.26Å; A161-C213 WeakPolarHBondContact O-CA 3.42Å; A161-C213 WeakPolarHBondContact O-CB 3.33Å; A161-N214 VanDerWaalsContact CB-OD1 3.31Å; A161-N214 WeakPolarHBondContact CB-OD1 3.33Å; A161-N214 PolarHBondContact O-N 3.16Å
162	H	97.8	Very high	96.2	Very high	12 Å²	12	43.6 Å²	43.6	6%	0.056	25%	0.254	C	S	.	.			trans	-90.3	161.5	175.6	62.3	-83.7	0	0	0	110.1	S106 F117 R159 S160 A175	S106-H162 VanDerWaalsContact CB-NE2 3.32Å; S106-H162 WeakPolarHBondContact CB-NE2 3.44Å; S106-H162 PolarHBondContact OG-NE2 2.86Å; F117-H162 AromaticContact CD1-CE1 3.65Å; F117-H162 AromaticContact CD1-NE2 3.44Å; F117-H162 WeakPolarHBondContact CD1-NE2 3.47Å; F117-H162 PolarHBondContact O-CE1 3.34Å; R159-H162 HydrophobicContact CG-CB 4.42Å; S160-H162 PolarHBondContact O-N 2.92Å; H162-A175 VanDerWaalsContact CB-O 3.24Å; H162-A175 WeakPolarHBondContact CB-O 3.49Å
163	G	97.4	Very high	96.7	Very high	3 Å²	3	35.1 Å²	35.1	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	140.5	169.4	0	0	0	0	0	110.9	I173 F174	G163-I173 CarbonylContact O-C 3.53Å; G163-I173 VanDerWaalsContact O-CA 3.3Å; G163-I173 WeakPolarHBondContact O-CA 3.29Å; G163-F174 PolarHBondContact N-O 3.28Å; G163-F174 PolarHBondContact O-N 3.08Å
164	A	98.1	Very high	97.1	Very high	17 Å²	17	31.8 Å²	31.8	14%	0.14	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	142.6	170.5	0	0	0	0	0	112	S106 V108 L171 W172 I173 V217	S106-A164 VanDerWaalsContact CB-CB 3.43Å; S106-A164 VanDerWaalsContact OG-CB 3.28Å; S106-A164 WeakPolarHBondContact OG-CB 3.45Å; V108-A164 HydrophobicContact CG1-CB 4.16Å; A164-L171 HydrophobicContact CB-CD1 4.08Å; A164-W172 CarbonylContact C-O 3.55Å; A164-W172 WeakPolarHBondContact CA-O 3.25Å; A164-I173 HydrophobicContact CB-CG2 4.03Å; A164-V217 WeakPolarHBondContact O-CG2 3.36Å
165	T	97.9	Very high	97.3	Very high	19 Å²	19	28.1 Å²	28.1	12%	0.117	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	163.7	176.5	-165.1	0	0	0	0	111.3	W172 V219 M224 F244	T165-W172 HydrophobicContact CG2-CB 4.14Å; T165-W172 PolarHBondContact N-O 2.8Å; T165-W172 PolarHBondContact O-N 2.9Å; T165-V219 HydrophobicContact CG2-CG2 3.56Å; T165-V219 WeakPolarHBondContact OG1-CG2 3.43Å; T165-M224 HydrophobicContact CG2-SD 3.82Å; T165-F244 HydrophobicContact CG2-CZ 4.24Å
166	V	97.9	Very high	97.3	Very high	35 Å²	35	24.7 Å²	24.7	21%	0.212	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.3	173.2	175.6	0	0	0	0	108.5	V108 Y110 K170 L191	V108-V166 HydrophobicContact CB-CG2 3.75Å; V108-V166 HydrophobicContact CG1-CG2 4.4Å; V108-V166 HydrophobicContact CG2-CG2 3.5Å; Y110-V166 HydrophobicContact CD2-CG1 3.87Å; V166-K170 WeakPolarHBondContact CA-O 3.27Å; V166-L191 HydrophobicContact CG1-CD1 4.5Å; V166-L191 HydrophobicContact CG2-CD1 3.98Å
167	Y	97.6	Very high	97.2	Very high	59 Å²	59	28.2 Å²	28.2	23%	0.231	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	131.4	174.1	-179.8	-98	0	0	0	109.9	D169 K170 W172 V219 D222 F244	Y167-D169 PolarHBondContact O-N 3.49Å; Y167-K170 PolarHBondContact N-O 2.81Å; Y167-K170 PolarHBondContact O-N 3.24Å; Y167-K170 VanDerWaalsContact O-N 3.15Å; Y167-W172 PolarHBondContact O-NE1 3.44Å; Y167-V219 HydrophobicContact CD2-CG1 4.13Å; Y167-D222 HydrophobicContact CE2-CB 4.06Å; Y167-D222 WeakPolarHBondContact OH-CB 3.09Å; Y167-F244 HydrophobicContact CD1-CB 3.68Å; Y167-F244 AromaticContact CD1-CD1 3.72Å; Y167-F244 HydrophobicContact CD1-CD1 3.72Å; Y167-F244 AromaticContact CD1-CD2 3.32Å; Y167-F244 HydrophobicContact CD1-CD2 3.32Å; Y167-F244 HydrophobicContact CD1-CE1 4.11Å; Y167-F244 AromaticContact CD1-CE2 3.76Å; Y167-F244 HydrophobicContact CD1-CE2 3.76Å; Y167-F244 AromaticContact CD1-CG 3.3Å; Y167-F244 HydrophobicContact CD1-CG 3.3Å; Y167-F244 HydrophobicContact CD1-CZ 4.11Å; Y167-F244 AromaticContact CD2-CD2 3.92Å; Y167-F244 HydrophobicContact CD2-CD2 3.92Å; Y167-F244 AromaticContact CD2-CE2 3.75Å; Y167-F244 HydrophobicContact CD2-CE2 3.75Å; Y167-F244 HydrophobicContact CD2-CZ 4.39Å; Y167-F244 HydrophobicContact CE1-CB 3.47Å; Y167-F244 VanDerWaalsContact CE1-CB 3.47Å; Y167-F244 HydrophobicContact CE1-CD1 4.39Å; Y167-F244 AromaticContact CE1-CD2 3.48Å; Y167-F244 HydrophobicContact CE1-CD2 3.48Å; Y167-F244 VanDerWaalsContact CE1-CD2 3.48Å; Y167-F244 HydrophobicContact CE1-CE2 4.26Å; Y167-F244 AromaticContact CE1-CG 3.55Å; Y167-F244 HydrophobicContact CE1-CG 3.55Å; Y167-F244 HydrophobicContact CE2-CD2 4.06Å; Y167-F244 HydrophobicContact CE2-CE2 4.27Å; Y167-F244 HydrophobicContact CG-CD1 4.22Å; Y167-F244 AromaticContact CG-CD2 3.55Å; Y167-F244 HydrophobicContact CG-CD2 3.55Å; Y167-F244 HydrophobicContact CG-CE1 4.14Å; Y167-F244 AromaticContact CG-CE2 3.46Å; Y167-F244 HydrophobicContact CG-CE2 3.46Å; Y167-F244 VanDerWaalsContact CG-CE2 3.46Å; Y167-F244 AromaticContact CG-CG 3.93Å; Y167-F244 HydrophobicContact CG-CG 3.93Å; Y167-F244 AromaticContact CG-CZ 3.76Å; Y167-F244 HydrophobicContact CG-CZ 3.76Å; Y167-F244 AromaticContact CZ-CD2 3.84Å
168	N	95.6	Very high	97.1	Very high	129 Å²	129	27.5 Å²	27.5	69%	0.69	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	55.4	-179.6	-164.4	37.8	0	0	0	112.9	K170	N168-K170 PolarHBondContact O-N 2.93Å
169	D	96.4	Very high	96.7	Very high	57 Å²	57	27.9 Å²	27.9	31%	0.305	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	8.5	-179.3	-55.4	-49.2	0	0	0	116.7	Y110 Y167 L191 Q192	Y110-D169 HydrophobicContact CE2-CB 4.08Å; Y110-D169 WeakPolarHBondContact CE2-OD1 3.36Å; Y110-D169 VanDerWaalsContact CZ-OD1 3.31Å; Y110-D169 WeakPolarHBondContact OH-CB 3.2Å; Y110-D169 VanDerWaalsContact OH-CG 3.24Å; Y110-D169 PolarHBondContact OH-OD1 3.05Å; Y167-D169 PolarHBondContact O-N 3.49Å; D169-L191 PolarHBondContact O-N 2.95Å; D169-Q192 HydrophobicContact CB-CG 3.71Å; D169-Q192 PolarHBondContact OD2-NE2 3.34Å
170	K	97.7	Very high	96.3	Very high	63 Å²	63	34.8 Å²	34.8	27%	0.274	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	143.1	176.6	-60.7	-167.4	173.9	-167.3	0	111.6	V166 Y167 N168 T188 I189 E200	V166-K170 WeakPolarHBondContact CA-O 3.27Å; Y167-K170 PolarHBondContact N-O 2.81Å; Y167-K170 PolarHBondContact O-N 3.24Å; Y167-K170 VanDerWaalsContact O-N 3.15Å; N168-K170 PolarHBondContact O-N 2.93Å; K170-T188 VanDerWaalsContact CB-OG1 3.32Å; K170-T188 WeakPolarHBondContact CB-OG1 3.17Å; K170-T188 HydrophobicContact CD-CG2 4.09Å; K170-T188 WeakPolarHBondContact CD-OG1 3.38Å; K170-I189 CarbonylContact C-O 3.58Å; K170-I189 VanDerWaalsContact CA-O 3.22Å; K170-I189 WeakPolarHBondContact CA-O 3.19Å; K170-I189 WeakPolarHBondContact CB-O 3.26Å; K170-E200 IonicContact NZ-OE2 3.27Å; K170-E200 PolarHBondContact NZ-OE2 2.94Å
171	L	98.5	Very high	96.1	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	131.5	162.1	166.4	63	0	0	0	108	V108 L136 A164 I173 T188 I189 L191 W199	V108-L171 HydrophobicContact CG1-CD1 4.41Å; V108-L171 HydrophobicContact CG2-CD1 3.96Å; L136-L171 HydrophobicContact CD1-CD2 3.91Å; A164-L171 HydrophobicContact CB-CD1 4.08Å; L171-I173 HydrophobicContact CD1-CG2 4.13Å; L171-I173 HydrophobicContact CG-CG2 4.22Å; L171-T188 CarbonylContact O-C 3.56Å; L171-T188 WeakPolarHBondContact O-CA 3.35Å; L171-T188 PolarHBondContact O-OG1 2.67Å; L171-I189 HydrophobicContact CB-CG2 3.79Å; L171-I189 HydrophobicContact CD2-CG2 4.01Å; L171-I189 HydrophobicContact CG-CG2 4.19Å; L171-I189 PolarHBondContact N-O 2.85Å; L171-I189 PolarHBondContact O-N 3.29Å; L171-L191 HydrophobicContact CB-CD1 4.04Å; L171-L191 HydrophobicContact CB-CD2 3.98Å; L171-L191 HydrophobicContact CB-CG 4.09Å; L171-W199 HydrophobicContact CD2-CH2 3.7Å; L171-W199 HydrophobicContact CD2-CZ2 4.31Å; L171-W199 HydrophobicContact CG-CH2 4.18Å
172	W	98.6	Very high	95.9	Very high	16 Å²	16	39.8 Å²	39.8	6%	0.061	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132	172.8	-64.9	78.3	0	0	0	108.8	A164 T165 Y167 M186 W187 T188 I202 F242 F244 H247	A164-W172 CarbonylContact C-O 3.55Å; A164-W172 WeakPolarHBondContact CA-O 3.25Å; T165-W172 HydrophobicContact CG2-CB 4.14Å; T165-W172 PolarHBondContact N-O 2.8Å; T165-W172 PolarHBondContact O-N 2.9Å; Y167-W172 PolarHBondContact O-NE1 3.44Å; W172-M186 HydrophobicContact CE3-CG 4.05Å; W172-M186 HydrophobicContact CE3-SD 3.94Å; W172-M186 HydrophobicContact CZ3-CG 4.25Å; W172-W187 WeakPolarHBondContact CA-O 3.29Å; W172-T188 HydrophobicContact CH2-CG2 4.43Å; W172-T188 HydrophobicContact CZ3-CG2 4.49Å; W172-I202 HydrophobicContact CH2-CG1 4.49Å; W172-I202 HydrophobicContact CZ3-CD1 4.45Å; W172-I202 HydrophobicContact CZ3-CG1 3.88Å; W172-I202 HydrophobicContact CZ3-CG2 4.48Å; W172-F242 HydrophobicContact CE3-CE1 4.35Å; W172-F242 AromaticContact CZ3-CE1 3.99Å; W172-F242 HydrophobicContact CZ3-CE1 3.99Å; W172-F242 HydrophobicContact CZ3-CZ 4.34Å; W172-F244 HydrophobicContact CB-CE1 4.44Å; W172-F244 AromaticContact CD1-CE1 3.89Å; W172-F244 AromaticContact CD2-CD1 3.8Å; W172-F244 HydrophobicContact CD2-CD1 3.8Å; W172-F244 AromaticContact CD2-CE1 3.68Å; W172-F244 HydrophobicContact CD2-CE1 3.68Å; W172-F244 AromaticContact CE2-CD1 3.58Å; W172-F244 AromaticContact CE2-CE1 3.81Å; W172-F244 HydrophobicContact CE3-CD1 4.11Å; W172-F244 HydrophobicContact CE3-CE1 4.19Å; W172-F244 HydrophobicContact CG-CD1 4.35Å; W172-F244 AromaticContact CG-CE1 3.77Å; W172-F244 HydrophobicContact CG-CE1 3.77Å; W172-F244 HydrophobicContact CH2-CD1 4.05Å; W172-F244 AromaticContact CZ2-CD1 3.74Å; W172-F244 HydrophobicContact CZ2-CD1 3.74Å; W172-F244 HydrophobicContact CZ2-CE1 4.42Å; W172-F244 HydrophobicContact CZ3-CD1 4.21Å; W172-F244 AromaticContact NE1-CD1 3.98Å; W172-F244 AromaticContact NE1-CE1 3.91Å; W172-H247 AromaticContact CH2-NE2 3.88Å
173	I	98.4	Very high	95.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.8	172.6	64.1	175.2	0	0	0	109.9	F117 P156 G163 A164 L171 M186 W187 W199	F117-I173 HydrophobicContact CD1-CD1 4.15Å; F117-I173 HydrophobicContact CD1-CG2 4.09Å; F117-I173 HydrophobicContact CE1-CD1 3.44Å; F117-I173 VanDerWaalsContact CE1-CD1 3.44Å; F117-I173 HydrophobicContact CE1-CG2 4.42Å; F117-I173 HydrophobicContact CZ-CD1 3.69Å; P156-I173 HydrophobicContact CB-CD1 3.75Å; P156-I173 HydrophobicContact CG-CD1 3.84Å; G163-I173 CarbonylContact O-C 3.53Å; G163-I173 VanDerWaalsContact O-CA 3.3Å; G163-I173 WeakPolarHBondContact O-CA 3.29Å; A164-I173 HydrophobicContact CB-CG2 4.03Å; L171-I173 HydrophobicContact CD1-CG2 4.13Å; L171-I173 HydrophobicContact CG-CG2 4.22Å; I173-M186 WeakPolarHBondContact O-CA 3.5Å; I173-W187 HydrophobicContact CD1-CB 3.95Å; I173-W187 HydrophobicContact CD1-CG 4.47Å; I173-W187 HydrophobicContact CG1-CB 3.61Å; I173-W187 HydrophobicContact CG1-CG 4.45Å; I173-W187 PolarHBondContact N-O 3.41Å; I173-W187 PolarHBondContact O-N 3.04Å; I173-W199 HydrophobicContact CD1-CH2 3.88Å; I173-W199 HydrophobicContact CD1-CZ3 3.78Å; I173-W199 HydrophobicContact CG1-CH2 4.31Å; I173-W199 HydrophobicContact CG1-CZ3 3.92Å; I173-W199 HydrophobicContact CG2-CH2 4.19Å; I173-W199 HydrophobicContact CG2-CZ3 4.45Å
174	F	98	Very high	95.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.8	-178.2	179.5	-113.7	0	0	0	111.1	G163 N184 D185 M186 P209 F215 M224 V226 W249	G163-F174 PolarHBondContact N-O 3.28Å; G163-F174 PolarHBondContact O-N 3.08Å; F174-N184 WeakPolarHBondContact CE2-O 3.5Å; F174-N184 HydrophobicContact CZ-CB 4.47Å; F174-D185 WeakPolarHBondContact CA-O 3.39Å; F174-D185 VanDerWaalsContact CD2-O 3.3Å; F174-D185 WeakPolarHBondContact CD2-O 3.26Å; F174-M186 HydrophobicContact CB-CE 3.95Å; F174-M186 HydrophobicContact CB-SD 3.98Å; F174-M186 HydrophobicContact CD2-CB 4.46Å; F174-M186 HydrophobicContact CD2-CE 3.49Å; F174-M186 VanDerWaalsContact CD2-CE 3.49Å; F174-M186 HydrophobicContact CD2-SD 4.21Å; F174-M186 HydrophobicContact CE2-CE 4.3Å; F174-M186 HydrophobicContact CG-CE 3.93Å; F174-P209 HydrophobicContact CE1-CB 4.22Å; F174-P209 HydrophobicContact CE1-CG 4.11Å; F174-P209 HydrophobicContact CZ-CB 3.97Å; F174-P209 HydrophobicContact CZ-CG 3.82Å; F174-F215 AromaticContact CD1-CE2 3.95Å; F174-F215 HydrophobicContact CD1-CE2 3.95Å; F174-F215 AromaticContact CD1-CZ 3.73Å; F174-F215 HydrophobicContact CD1-CZ 3.73Å; F174-F215 HydrophobicContact CE1-CZ 4.23Å; F174-M224 HydrophobicContact CB-CE 4.38Å; F174-V226 HydrophobicContact CD1-CG2 4Å; F174-V226 HydrophobicContact CE1-CG1 4.46Å; F174-V226 HydrophobicContact CE1-CG2 4.13Å; F174-W249 HydrophobicContact CD1-CH2 4.29Å; F174-W249 HydrophobicContact CD1-CZ2 4.23Å; F174-W249 AromaticContact CD2-CZ2 3.87Å; F174-W249 HydrophobicContact CD2-CZ2 3.87Å; F174-W249 HydrophobicContact CE1-CH2 4.13Å; F174-W249 HydrophobicContact CE1-CZ2 4.02Å; F174-W249 AromaticContact CE2-CZ2 3.63Å; F174-W249 HydrophobicContact CE2-CZ2 3.63Å; F174-W249 HydrophobicContact CG-CZ2 4.17Å; F174-W249 HydrophobicContact CZ-CH2 4.26Å; F174-W249 AromaticContact CZ-CZ2 3.72Å; F174-W249 HydrophobicContact CZ-CZ2 3.72Å
175	A	96.4	Very high	95.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	57	-146.4	171.8	0	0	0	0	0	113.8	R159 H162 L183 D185 C212 F215	R159-A175 PolarHBondContact NH1-O 3.48Å; H162-A175 VanDerWaalsContact CB-O 3.24Å; H162-A175 WeakPolarHBondContact CB-O 3.49Å; A175-L183 WeakPolarHBondContact CB-O 3.45Å; A175-D185 PolarHBondContact N-O 3.26Å; A175-C212 WeakPolarHBondContact CB-O 3.29Å; A175-F215 HydrophobicContact CB-CE1 3.93Å; A175-F215 HydrophobicContact CB-CZ 3.82Å
176	G	95.8	Very high	95.6	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	110.9	-163.3	-178.1	0	0	0	0	0	113.6	S160 R182 L183 C212	S160-G176 CarbonylContact O-C 3.54Å; S160-G176 WeakPolarHBondContact O-CA 3.33Å; G176-R182 CarbonylContact O-C 3.49Å; G176-R182 WeakPolarHBondContact O-CA 3.39Å; G176-L183 PolarHBondContact O-N 2.85Å; G176-C212 PolarHBondContact N-O 3.35Å
177	Y	94.5	Very high	95.6	Very high	73 Å²	73	42 Å²	42	29%	0.286	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	123.6	179.5	-178.7	-123.2	0	0	0	110.3	Y120 N132 R159 S160 G179 A181 R182	Y120-Y177 AromaticContact CE2-CD1 3.98Å; Y120-Y177 HydrophobicContact CE2-CD1 3.98Å; Y120-Y177 HydrophobicContact CE2-CE1 4.46Å; Y120-Y177 WeakPolarHBondContact OH-CD1 3.44Å; Y120-Y177 WeakPolarHBondContact OH-CE1 3.41Å; N132-Y177 PolarHBondContact ND2-O 3.26Å; R159-Y177 CarbonylContact C-O 3.57Å; R159-Y177 VanDerWaalsContact CA-O 3.3Å; R159-Y177 WeakPolarHBondContact CA-O 3.43Å; S160-Y177 PolarHBondContact N-O 3.09Å; S160-Y177 PolarHBondContact O-N 2.71Å; S160-Y177 PolarHBondContact OG-O 3.44Å; Y177-G179 VanDerWaalsContact CZ-C 3.4Å; Y177-G179 VanDerWaalsContact OH-C 3.25Å; Y177-G179 PolarHBondContact OH-O 3.08Å; Y177-A181 WeakPolarHBondContact CD2-O 3.43Å; Y177-R182 HydrophobicContact CD2-CG 4.3Å
178	D	94.3	Very high	95.7	Very high	53 Å²	53	39.2 Å²	39.2	28%	0.283	21%	0.209	S	C	.	.			trans	-88.5	-5.9	-177.8	70.1	-1.5	0	0	0	113.6	N132 V157 A158 N180 A181 L183	N132-D178 PolarHBondContact ND2-O 2.79Å; V157-D178 HydrophobicContact CG2-CB 4.11Å; A158-D178 WeakPolarHBondContact O-CA 3.22Å; D178-N180 WeakPolarHBondContact OD1-CA 3.5Å; D178-N180 PolarHBondContact OD1-N 3.42Å; D178-A181 PolarHBondContact N-O 3.3Å; D178-A181 PolarHBondContact OD1-N 2.95Å; D178-L183 HydrophobicContact CB-CD1 4.28Å; D178-L183 HydrophobicContact CB-CD2 4.34Å
179	G	89.6	Confident	95.8	Very high	37 Å²	37	33 Å²	33	38%	0.381	18%	0.176	S	C	.	.	S	Bend	trans	105.1	-10.4	-175.4	0	0	0	0	0	113.8	Y120 N132 Y177	Y120-G179 WeakPolarHBondContact OH-CA 3.42Å; N132-G179 PolarHBondContact ND2-N 3.47Å; N132-G179 VanDerWaalsContact ND2-N 3.16Å; Y177-G179 VanDerWaalsContact CZ-C 3.4Å; Y177-G179 VanDerWaalsContact OH-C 3.25Å; Y177-G179 PolarHBondContact OH-O 3.08Å
180	N	89.4	Confident	95.8	Very high	145 Å²	145	32.1 Å²	32.1	78%	0.775	17%	0.174	S	C	*	.	S	Bend	trans	-123.3	-53.4	174.6	-174	38.8	0	0	0	110.9	D178	D178-N180 WeakPolarHBondContact OD1-CA 3.5Å; D178-N180 PolarHBondContact OD1-N 3.42Å
181	A	91.7	Very high	95.7	Very high	43 Å²	43	29.4 Å²	29.4	36%	0.355	16%	0.162	S	C	.	.	S	Bend	trans	-125.8	153.6	-176.4	0	0	0	0	0	112.5	Y177 D178	Y177-A181 WeakPolarHBondContact CD2-O 3.43Å; D178-A181 PolarHBondContact N-O 3.3Å; D178-A181 PolarHBondContact OD1-N 2.95Å
182	R	92.7	Very high	95.5	Very high	73 Å²	73	35.5 Å²	35.5	28%	0.275	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	144.1	164.6	-66.5	173.6	-179.8	82	2.1	108.3	G176 Y177 S211 Q230	G176-R182 CarbonylContact O-C 3.49Å; G176-R182 WeakPolarHBondContact O-CA 3.39Å; Y177-R182 HydrophobicContact CD2-CG 4.3Å; R182-S211 VanDerWaalsContact O-CB 3.28Å; R182-S211 WeakPolarHBondContact O-CB 3.41Å; R182-Q230 VanDerWaalsContact CD-O 3.28Å; R182-Q230 WeakPolarHBondContact CD-O 3.37Å; R182-Q230 PolarHBondContact NE-O 3.05Å
183	L	94.8	Very high	95	Very high	24 Å²	24	37.9 Å²	37.9	13%	0.126	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	166.1	-175.4	-50.7	174.3	0	0	0	110.9	V157 R159 A175 G176 D178 D185 S211 C212	V157-L183 HydrophobicContact CG2-CD1 3.59Å; V157-L183 HydrophobicContact CG2-CD2 4.46Å; R159-L183 HydrophobicContact CB-CD1 4.29Å; A175-L183 WeakPolarHBondContact CB-O 3.45Å; G176-L183 PolarHBondContact O-N 2.85Å; D178-L183 HydrophobicContact CB-CD1 4.28Å; D178-L183 HydrophobicContact CB-CD2 4.34Å; L183-D185 WeakPolarHBondContact CB-OD1 3.26Å; L183-S211 CarbonylContact O-C 3.54Å; L183-S211 WeakPolarHBondContact O-CA 3.48Å; L183-S211 WeakPolarHBondContact O-CB 3.47Å; L183-C212 PolarHBondContact O-N 3.05Å
184	N	94.9	Very high	94.6	Very high	70 Å²	70	43.4 Å²	43.4	37%	0.374	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	23.3	167.5	63.8	-23.2	0	0	0	111.3	F174 Q204	F174-N184 WeakPolarHBondContact CE2-O 3.5Å; F174-N184 HydrophobicContact CZ-CB 4.47Å; N184-Q204 PolarHBondContact O-NE2 3.16Å
185	D	97.1	Very high	94.2	Very high	25 Å²	25	51.7 Å²	51.7	13%	0.134	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	160.3	175.5	62.6	-23.8	0	0	0	111.1	R159 F174 A175 L183 W187	R159-D185 IonicContact CZ-OD1 2.71Å; R159-D185 IonicContact CZ-OD2 3.96Å; R159-D185 VanDerWaalsContact NH1-CG 3.34Å; R159-D185 IonicContact NH1-OD1 2.76Å; R159-D185 PolarHBondContact NH1-OD1 3.42Å; R159-D185 IonicContact NH1-OD2 2.6Å; R159-D185 PolarHBondContact NH1-OD2 3.01Å; R159-D185 IonicContact NH2-OD1 3.51Å; R159-D185 IonicContact NH2-OD2 3.82Å; R159-D185 PolarHBondContact NH2-OD2 3.22Å; F174-D185 WeakPolarHBondContact CA-O 3.39Å; F174-D185 VanDerWaalsContact CD2-O 3.3Å; F174-D185 WeakPolarHBondContact CD2-O 3.26Å; A175-D185 PolarHBondContact N-O 3.26Å; L183-D185 WeakPolarHBondContact CB-OD1 3.26Å; D185-W187 PolarHBondContact OD2-NE1 3.06Å
186	M	98.1	Very high	93.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129.2	-179.6	-177.3	69.6	73.4	0	0	109.2	W172 I173 F174 I202 Q204 M224 F242 W249	W172-M186 HydrophobicContact CE3-CG 4.05Å; W172-M186 HydrophobicContact CE3-SD 3.94Å; W172-M186 HydrophobicContact CZ3-CG 4.25Å; I173-M186 WeakPolarHBondContact O-CA 3.5Å; F174-M186 HydrophobicContact CB-CE 3.95Å; F174-M186 HydrophobicContact CB-SD 3.98Å; F174-M186 HydrophobicContact CD2-CB 4.46Å; F174-M186 HydrophobicContact CD2-CE 3.49Å; F174-M186 VanDerWaalsContact CD2-CE 3.49Å; F174-M186 HydrophobicContact CD2-SD 4.21Å; F174-M186 HydrophobicContact CE2-CE 4.3Å; F174-M186 HydrophobicContact CG-CE 3.93Å; M186-I202 HydrophobicContact CB-CB 4.04Å; M186-I202 HydrophobicContact CG-CB 3.85Å; M186-I202 HydrophobicContact CG-CG1 4.19Å; M186-I202 HydrophobicContact CG-CG2 4.31Å; M186-I202 PolarHBondContact O-N 3.42Å; M186-Q204 HydrophobicContact CB-CG 3.93Å; M186-M224 HydrophobicContact CE-CE 3.31Å; M186-M224 HydrophobicContact SD-CE 4.08Å; M186-F242 HydrophobicContact CE-CD1 4.27Å; M186-F242 HydrophobicContact CE-CD2 4.37Å; M186-F242 HydrophobicContact CE-CE1 4.17Å; M186-F242 HydrophobicContact CE-CE2 4.27Å; M186-F242 HydrophobicContact CE-CG 4.35Å; M186-F242 HydrophobicContact CE-CZ 4.15Å; M186-W249 HydrophobicContact CE-CZ2 3.61Å
187	W	98.4	Very high	93.7	Very high	13 Å²	13	59 Å²	59	5%	0.049	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150.8	176.3	-65.9	75.3	0	0	0	111.3	S154 P156 W172 I173 D185 W199 E200 E201	S154-W187 WeakPolarHBondContact OG-CH2 3.49Å; P156-W187 HydrophobicContact CB-CB 4.46Å; P156-W187 HydrophobicContact CB-CD2 3.84Å; P156-W187 HydrophobicContact CB-CE3 4.33Å; P156-W187 HydrophobicContact CB-CG 3.89Å; W172-W187 WeakPolarHBondContact CA-O 3.29Å; I173-W187 HydrophobicContact CD1-CB 3.95Å; I173-W187 HydrophobicContact CD1-CG 4.47Å; I173-W187 HydrophobicContact CG1-CB 3.61Å; I173-W187 HydrophobicContact CG1-CG 4.45Å; I173-W187 PolarHBondContact N-O 3.41Å; I173-W187 PolarHBondContact O-N 3.04Å; D185-W187 PolarHBondContact OD2-NE1 3.06Å; W187-W199 HydrophobicContact CB-CE3 3.95Å; W187-W199 HydrophobicContact CB-CZ3 4.15Å; W187-W199 HydrophobicContact CE3-CB 4.03Å; W187-W199 HydrophobicContact CZ3-CB 4.27Å; W187-E200 CarbonylContact C-O 3.57Å; W187-E200 VanDerWaalsContact CA-O 3.25Å; W187-E200 WeakPolarHBondContact CA-O 3.47Å; W187-E201 HydrophobicContact CD2-CB 3.94Å; W187-E201 HydrophobicContact CD2-CG 4.25Å; W187-E201 HydrophobicContact CE3-CB 3.93Å; W187-E201 HydrophobicContact CH2-CB 3.81Å; W187-E201 HydrophobicContact CH2-CG 4.44Å; W187-E201 HydrophobicContact CZ2-CB 3.79Å; W187-E201 HydrophobicContact CZ2-CG 3.91Å; W187-E201 HydrophobicContact CZ3-CB 3.88Å
188	T	98.1	Very high	93.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	153.9	175.7	-165.8	0	0	0	0	113.1	K170 L171 W172 W199 E200 I202	K170-T188 VanDerWaalsContact CB-OG1 3.32Å; K170-T188 WeakPolarHBondContact CB-OG1 3.17Å; K170-T188 HydrophobicContact CD-CG2 4.09Å; K170-T188 WeakPolarHBondContact CD-OG1 3.38Å; L171-T188 CarbonylContact O-C 3.56Å; L171-T188 WeakPolarHBondContact O-CA 3.35Å; L171-T188 PolarHBondContact O-OG1 2.67Å; W172-T188 HydrophobicContact CH2-CG2 4.43Å; W172-T188 HydrophobicContact CZ3-CG2 4.49Å; T188-W199 CarbonylContact O-C 3.54Å; T188-W199 WeakPolarHBondContact O-CA 3.47Å; T188-E200 HydrophobicContact CG2-CB 3.98Å; T188-E200 PolarHBondContact N-O 3.16Å; T188-E200 PolarHBondContact O-N 3.22Å; T188-I202 HydrophobicContact CG2-CD1 3.81Å; T188-I202 HydrophobicContact CG2-CG1 4.03Å
189	I	98	Very high	93.9	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	139.6	175.6	-176.9	161.5	0	0	0	110.2	L136 V151 K170 L171 A197 C198 W199	L136-I189 HydrophobicContact CD2-CD1 4.38Å; V151-I189 HydrophobicContact CG1-CD1 4.17Å; V151-I189 HydrophobicContact CG2-CD1 3.79Å; K170-I189 CarbonylContact C-O 3.58Å; K170-I189 VanDerWaalsContact CA-O 3.22Å; K170-I189 WeakPolarHBondContact CA-O 3.19Å; K170-I189 WeakPolarHBondContact CB-O 3.26Å; L171-I189 HydrophobicContact CB-CG2 3.79Å; L171-I189 HydrophobicContact CD2-CG2 4.01Å; L171-I189 HydrophobicContact CG-CG2 4.19Å; L171-I189 PolarHBondContact N-O 2.85Å; L171-I189 PolarHBondContact O-N 3.29Å; I189-A197 HydrophobicContact CD1-CB 3.89Å; I189-A197 HydrophobicContact CG1-CB 4.02Å; I189-C198 WeakPolarHBondContact CG1-O 3.49Å; I189-W199 HydrophobicContact CB-CD2 3.82Å; I189-W199 HydrophobicContact CB-CE3 3.74Å; I189-W199 HydrophobicContact CB-CG 4.36Å; I189-W199 HydrophobicContact CB-CH2 4.37Å; I189-W199 HydrophobicContact CB-CZ2 4.42Å; I189-W199 HydrophobicContact CB-CZ3 4.03Å; I189-W199 HydrophobicContact CD1-CD2 4.07Å; I189-W199 HydrophobicContact CD1-CG 4.06Å; I189-W199 HydrophobicContact CD1-CZ2 4.5Å; I189-W199 HydrophobicContact CG2-CD2 4.03Å; I189-W199 HydrophobicContact CG2-CE3 3.82Å; I189-W199 HydrophobicContact CG2-CH2 3.53Å; I189-W199 HydrophobicContact CG2-CZ2 3.72Å; I189-W199 HydrophobicContact CG2-CZ3 3.57Å
190	S	96.6	Very high	94.2	Very high	37 Å²	37	58.6 Å²	58.6	26%	0.259	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	134.6	174.1	-176.9	0	0	0	0	111.5	Q192	S190-Q192 PolarHBondContact OG-N 2.97Å
191	L	96.3	Very high	94.6	Very high	7 Å²	7	57.5 Å²	57.5	4%	0.037	28%	0.284	C	S	.	.	S	Bend	trans	-100.9	-0.8	177.1	-59.9	-180	0	0	0	113.4	Y110 F115 W149 V166 D169 L171	Y110-L191 HydrophobicContact CD1-CB 3.44Å; Y110-L191 VanDerWaalsContact CD1-CB 3.44Å; Y110-L191 HydrophobicContact CD1-CD1 4.02Å; Y110-L191 HydrophobicContact CD1-CG 4.41Å; Y110-L191 HydrophobicContact CD2-CD1 4.45Å; Y110-L191 HydrophobicContact CE1-CB 3.69Å; Y110-L191 WeakPolarHBondContact CE1-O 3.31Å; Y110-L191 HydrophobicContact CG-CB 4Å; Y110-L191 HydrophobicContact CG-CD1 3.75Å; F115-L191 HydrophobicContact CD1-CD2 3.99Å; F115-L191 HydrophobicContact CD2-CD1 4.19Å; F115-L191 HydrophobicContact CE1-CD2 3.92Å; F115-L191 HydrophobicContact CE2-CD1 4.25Å; F115-L191 HydrophobicContact CG-CD2 4.32Å; F115-L191 HydrophobicContact CZ-CB 4.5Å; F115-L191 HydrophobicContact CZ-CD2 4.21Å; W149-L191 HydrophobicContact CZ3-CD2 4.4Å; V166-L191 HydrophobicContact CG1-CD1 4.5Å; V166-L191 HydrophobicContact CG2-CD1 3.98Å; D169-L191 PolarHBondContact O-N 2.95Å; L171-L191 HydrophobicContact CB-CD1 4.04Å; L171-L191 HydrophobicContact CB-CD2 3.98Å; L171-L191 HydrophobicContact CB-CG 4.09Å
192	Q	93	Very high	94.9	Very high	130 Å²	130	56.4 Å²	56.4	61%	0.607	27%	0.272	S	S	*	.	S	Bend	trans	-72.6	-41.9	-177.2	-66	-175.3	-19.3	0	0	112.8	D169 S190	D169-Q192 HydrophobicContact CB-CG 3.71Å; D169-Q192 PolarHBondContact OD2-NE2 3.34Å; S190-Q192 PolarHBondContact OG-N 2.97Å
193	D	88.9	Confident	95.1	Very high	66 Å²	66	60 Å²	60	35%	0.353	30%	0.297	S	S	.	.			trans	-135.2	115.2	-175.8	-172.8	-6.9	0	0	0	110.5	E195 H196 A197	D193-E195 VanDerWaalsContact C-N 3.31Å; D193-E195 PolarHBondContact O-N 3.41Å; D193-E195 PolarHBondContact OD1-N 3.22Å; D193-H196 PolarHBondContact O-N 3.06Å; D193-H196 IonicContact OD2-CE1 3.67Å; D193-H196 IonicContact OD2-CG 2.72Å; D193-H196 IonicContact OD2-ND1 3.24Å; D193-H196 PolarHBondContact OD2-ND1 3.04Å; D193-A197 WeakPolarHBondContact O-CB 3.13Å; D193-A197 PolarHBondContact O-N 2.95Å; D193-A197 VanDerWaalsContact O-N 3.09Å
194	R	90.4	Very high	95.2	Very high	116 Å²	116	60.9 Å²	60.9	44%	0.438	30%	0.301	S	S	.	.	S	Bend	trans	-64.1	-34.4	178.8	-178.9	177	178.7	-150.3	-1.3	112.7	T147 E148 W149 H196	T147-R194 VanDerWaalsContact CG2-NH1 3.32Å; E148-R194 PolarHBondContact O-NH2 3.43Å; W149-R194 HydrophobicContact CD2-CB 4.22Å; W149-R194 HydrophobicContact CD2-CG 3.69Å; W149-R194 HydrophobicContact CE3-CB 4.39Å; W149-R194 HydrophobicContact CE3-CG 4.12Å; W149-R194 HydrophobicContact CG-CG 4.02Å; W149-R194 HydrophobicContact CH2-CB 3.92Å; W149-R194 HydrophobicContact CH2-CG 4.46Å; W149-R194 HydrophobicContact CZ2-CB 3.7Å; W149-R194 HydrophobicContact CZ2-CG 4.05Å; W149-R194 HydrophobicContact CZ3-CB 4.26Å; W149-R194 HydrophobicContact CZ3-CG 4.49Å; R194-H196 VanDerWaalsContact C-N 3.32Å
195	E	88.8	Confident	95.1	Very high	174 Å²	174	59.8 Å²	59.8	81%	0.813	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-29.6	-175.5	-64.6	-171.4	170.7	0	0	111.9	D193	D193-E195 VanDerWaalsContact C-N 3.31Å; D193-E195 PolarHBondContact O-N 3.41Å; D193-E195 PolarHBondContact OD1-N 3.22Å
196	H	88.7	Confident	94.7	Very high	143 Å²	143	61.3 Å²	61.3	66%	0.662	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	9.3	179.4	-60.9	95.5	0	0	0	113.2	D193 R194 C198	D193-H196 PolarHBondContact O-N 3.06Å; D193-H196 IonicContact OD2-CE1 3.67Å; D193-H196 IonicContact OD2-CG 2.72Å; D193-H196 IonicContact OD2-ND1 3.24Å; D193-H196 PolarHBondContact OD2-ND1 3.04Å; R194-H196 VanDerWaalsContact C-N 3.32Å; H196-C198 PolarHBondContact O-N 3.02Å
197	A	93.3	Very high	94.1	Very high	10 Å²	10	65.4 Å²	65.4	8%	0.083	34%	0.339	C	S	.	.			trans	-69	121.8	-179.2	0	0	0	0	0	110.2	W149 V151 I189 D193	W149-A197 HydrophobicContact CE3-CB 3.89Å; W149-A197 HydrophobicContact CZ3-CB 3.63Å; V151-A197 WeakPolarHBondContact CG1-O 3.45Å; I189-A197 HydrophobicContact CD1-CB 3.89Å; I189-A197 HydrophobicContact CG1-CB 4.02Å; D193-A197 WeakPolarHBondContact O-CB 3.13Å; D193-A197 PolarHBondContact O-N 2.95Å; D193-A197 VanDerWaalsContact O-N 3.09Å
198	C	95.3	Very high	93.7	Very high	60 Å²	60	67.9 Å²	67.9	41%	0.405	35%	0.352	S	S	.	.			trans	-133	144.5	174.4	60	0	0	0	0	110.6	I189 H196	I189-C198 WeakPolarHBondContact CG1-O 3.49Å; H196-C198 PolarHBondContact O-N 3.02Å
199	W	97.8	Very high	93.4	Very high	15 Å²	15	68 Å²	68	6%	0.057	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	135.7	174	-76.5	104.5	0	0	0	110.5	F117 L136 S154 P156 L171 I173 W187 T188 I189	F117-W199 HydrophobicContact CD2-CH2 4.17Å; F117-W199 AromaticContact CD2-CZ2 3.7Å; F117-W199 HydrophobicContact CD2-CZ2 3.7Å; F117-W199 HydrophobicContact CE2-CH2 4.1Å; F117-W199 AromaticContact CE2-CZ2 3.54Å; F117-W199 HydrophobicContact CE2-CZ2 3.54Å; F117-W199 HydrophobicContact CZ-CH2 4.49Å; F117-W199 HydrophobicContact CZ-CZ2 4.29Å; L136-W199 HydrophobicContact CD2-CZ2 4.47Å; S154-W199 WeakPolarHBondContact O-CB 3.23Å; P156-W199 VanDerWaalsContact CD-CG 3.49Å; P156-W199 HydrophobicContact CG-CD2 3.89Å; P156-W199 HydrophobicContact CG-CE3 4.17Å; P156-W199 HydrophobicContact CG-CG 4.25Å; P156-W199 HydrophobicContact CG-CZ2 4.35Å; L171-W199 HydrophobicContact CD2-CH2 3.7Å; L171-W199 HydrophobicContact CD2-CZ2 4.31Å; L171-W199 HydrophobicContact CG-CH2 4.18Å; I173-W199 HydrophobicContact CD1-CH2 3.88Å; I173-W199 HydrophobicContact CD1-CZ3 3.78Å; I173-W199 HydrophobicContact CG1-CH2 4.31Å; I173-W199 HydrophobicContact CG1-CZ3 3.92Å; I173-W199 HydrophobicContact CG2-CH2 4.19Å; I173-W199 HydrophobicContact CG2-CZ3 4.45Å; W187-W199 HydrophobicContact CB-CE3 3.95Å; W187-W199 HydrophobicContact CB-CZ3 4.15Å; W187-W199 HydrophobicContact CE3-CB 4.03Å; W187-W199 HydrophobicContact CZ3-CB 4.27Å; T188-W199 CarbonylContact O-C 3.54Å; T188-W199 WeakPolarHBondContact O-CA 3.47Å; I189-W199 HydrophobicContact CB-CD2 3.82Å; I189-W199 HydrophobicContact CB-CE3 3.74Å; I189-W199 HydrophobicContact CB-CG 4.36Å; I189-W199 HydrophobicContact CB-CH2 4.37Å; I189-W199 HydrophobicContact CB-CZ2 4.42Å; I189-W199 HydrophobicContact CB-CZ3 4.03Å; I189-W199 HydrophobicContact CD1-CD2 4.07Å; I189-W199 HydrophobicContact CD1-CG 4.06Å; I189-W199 HydrophobicContact CD1-CZ2 4.5Å; I189-W199 HydrophobicContact CG2-CD2 4.03Å; I189-W199 HydrophobicContact CG2-CE3 3.82Å; I189-W199 HydrophobicContact CG2-CH2 3.53Å; I189-W199 HydrophobicContact CG2-CZ2 3.72Å; I189-W199 HydrophobicContact CG2-CZ3 3.57Å
200	E	96.9	Very high	92.9	Very high	80 Å²	80	70.1 Å²	70.1	37%	0.374	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.2	178.9	-61.9	173	159.7	0	0	108.5	K170 W187 T188	K170-E200 IonicContact NZ-OE2 3.27Å; K170-E200 PolarHBondContact NZ-OE2 2.94Å; W187-E200 CarbonylContact C-O 3.57Å; W187-E200 VanDerWaalsContact CA-O 3.25Å; W187-E200 WeakPolarHBondContact CA-O 3.47Å; T188-E200 HydrophobicContact CG2-CB 3.98Å; T188-E200 PolarHBondContact N-O 3.16Å; T188-E200 PolarHBondContact O-N 3.22Å
201	E	97.8	Very high	92.6	Very high	122 Å²	122	70.3 Å²	70.3	57%	0.57	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	136.7	167.9	-169.4	171.5	-170.2	0	0	109.1	W187	W187-E201 HydrophobicContact CD2-CB 3.94Å; W187-E201 HydrophobicContact CD2-CG 4.25Å; W187-E201 HydrophobicContact CE3-CB 3.93Å; W187-E201 HydrophobicContact CH2-CB 3.81Å; W187-E201 HydrophobicContact CH2-CG 4.44Å; W187-E201 HydrophobicContact CZ2-CB 3.79Å; W187-E201 HydrophobicContact CZ2-CG 3.91Å; W187-E201 HydrophobicContact CZ3-CB 3.88Å
202	I	97.9	Very high	92.4	Very high	19 Å²	19	70.3 Å²	70.3	10%	0.097	37%	0.369	C	S	.	.			trans	-107.7	124.1	-173.5	-59.6	-61.9	0	0	0	110.3	W172 M186 T188 Q204 H247	W172-I202 HydrophobicContact CH2-CG1 4.49Å; W172-I202 HydrophobicContact CZ3-CD1 4.45Å; W172-I202 HydrophobicContact CZ3-CG1 3.88Å; W172-I202 HydrophobicContact CZ3-CG2 4.48Å; M186-I202 HydrophobicContact CB-CB 4.04Å; M186-I202 HydrophobicContact CG-CB 3.85Å; M186-I202 HydrophobicContact CG-CG1 4.19Å; M186-I202 HydrophobicContact CG-CG2 4.31Å; M186-I202 PolarHBondContact O-N 3.42Å; T188-I202 HydrophobicContact CG2-CD1 3.81Å; T188-I202 HydrophobicContact CG2-CG1 4.03Å; I202-Q204 PolarHBondContact O-N 2.82Å; I202-H247 HydrophobicContact CG2-CB 3.94Å; I202-H247 VanDerWaalsContact CG2-CG 3.5Å
203	D	96.5	Very high	92.4	Very high	150 Å²	150	64.3 Å²	64.3	80%	0.802	34%	0.341	S	S	*	.			trans	-67.9	119.3	169.4	-70	-40	0	0	0	110.3	H247	D203-H247 WeakPolarHBondContact O-CB 3.5Å
204	Q	96.4	Very high	92.7	Very high	42 Å²	42	62.2 Å²	62.2	20%	0.196	33%	0.33	C	S	.	.			trans	-100.6	145.9	-176.4	-62.8	171	89.6	0	0	110.7	N184 M186 I202 I208	N184-Q204 PolarHBondContact O-NE2 3.16Å; M186-Q204 HydrophobicContact CB-CG 3.93Å; I202-Q204 PolarHBondContact O-N 2.82Å; Q204-I208 HydrophobicContact CB-CD1 3.82Å; Q204-I208 HydrophobicContact CB-CG1 4.18Å
205	S	92.3	Very high	92.8	Very high	46 Å²	46	57.2 Å²	57.2	32%	0.322	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	168.5	176.1	66.5	0	0	0	0	112.1	H247 W249	S205-H247 PolarHBondContact N-O 3.05Å; S205-H247 PolarHBondContact OG-O 3.14Å; S205-W249 PolarHBondContact O-N 2.99Å
206	G	88.3	Confident	93.1	Very high	57 Å²	57	49.9 Å²	49.9	59%	0.588	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	83.5	-149.5	177.4	0	0	0	0	0	114.2	I208 W249	G206-I208 VanDerWaalsContact C-N 3.31Å; G206-I208 PolarHBondContact O-N 3.4Å; G206-W249 WeakPolarHBondContact CA-O 3.21Å
207	E	86.3	Confident	93.4	Very high	86 Å²	86	44.1 Å²	44.1	40%	0.402	25%	0.253	S	S	.	.	S	Bend	trans	-83.3	70.5	-178.1	-69.5	178.4	99.1	0	0	111.3	F240 W249 R251	E207-F240 WeakPolarHBondContact O-CD1 3.2Å; E207-F240 WeakPolarHBondContact O-CE1 3.36Å; E207-W249 PolarHBondContact N-O 2.65Å; E207-W249 WeakPolarHBondContact O-CB 3.44Å; E207-R251 HydrophobicContact CB-CB 4.09Å; E207-R251 VanDerWaalsContact CD-CB 3.42Å; E207-R251 HydrophobicContact CG-CB 4.42Å; E207-R251 VanDerWaalsContact OE1-CB 3.31Å; E207-R251 WeakPolarHBondContact OE1-CB 3.44Å; E207-R251 IonicContact OE1-NE 2.74Å; E207-R251 PolarHBondContact OE1-NE 3.34Å; E207-R251 VanDerWaalsContact OE1-NE 3.16Å; E207-R251 VanDerWaalsContact OE2-CB 3.26Å; E207-R251 WeakPolarHBondContact OE2-CB 3.25Å; E207-R251 PolarHBondContact OE2-N 2.95Å
208	I	90.8	Very high	93.6	Very high	65 Å²	65	44 Å²	44	33%	0.333	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-58.8	131	-176.8	-52.7	173.7	0	0	0	110.3	Q204 G206	Q204-I208 HydrophobicContact CB-CD1 3.82Å; Q204-I208 HydrophobicContact CB-CG1 4.18Å; G206-I208 VanDerWaalsContact C-N 3.31Å; G206-I208 PolarHBondContact O-N 3.4Å
209	P	90.3	Very high	93.7	Very high	2 Å²	2	43 Å²	43	1%	0.013	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-56	144.3	174.6	-21.9	29.6	0	0	0	111.8	F174 F240 W249	F174-P209 HydrophobicContact CE1-CB 4.22Å; F174-P209 HydrophobicContact CE1-CG 4.11Å; F174-P209 HydrophobicContact CZ-CB 3.97Å; F174-P209 HydrophobicContact CZ-CG 3.82Å; P209-F240 HydrophobicContact CB-CD1 4.45Å; P209-F240 HydrophobicContact CB-CD2 4.12Å; P209-F240 HydrophobicContact CB-CE2 4.19Å; P209-F240 HydrophobicContact CB-CG 4.25Å; P209-F240 HydrophobicContact CB-CZ 4.4Å; P209-F240 HydrophobicContact CG-CB 3.89Å; P209-F240 HydrophobicContact CG-CD1 3.91Å; P209-F240 HydrophobicContact CG-CD2 4.05Å; P209-F240 HydrophobicContact CG-CE1 4.41Å; P209-F240 HydrophobicContact CG-CG 3.71Å; P209-W249 HydrophobicContact CG-CD2 3.89Å; P209-W249 HydrophobicContact CG-CE3 3.73Å; P209-W249 HydrophobicContact CG-CH2 4.08Å; P209-W249 HydrophobicContact CG-CZ2 4.2Å; P209-W249 HydrophobicContact CG-CZ3 3.84Å
210	P	88.6	Confident	93.6	Very high	46 Å²	46	42.6 Å²	42.6	30%	0.299	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-63	161.4	173.4	29.6	-35.4	0	0	0	110.5	C212	P210-C212 PolarHBondContact O-N 2.93Å
211	S	90.9	Very high	93.2	Very high	40 Å²	40	44.7 Å²	44.7	28%	0.28	25%	0.249	S	C	.	.	S	Bend	trans	-56.5	127.5	178.4	60.9	0	0	0	0	112.3	R182 L183 S231	R182-S211 VanDerWaalsContact O-CB 3.28Å; R182-S211 WeakPolarHBondContact O-CB 3.41Å; L183-S211 CarbonylContact O-C 3.54Å; L183-S211 WeakPolarHBondContact O-CA 3.48Å; L183-S211 WeakPolarHBondContact O-CB 3.47Å; S211-S231 WeakPolarHBondContact O-CA 3.43Å; S211-S231 WeakPolarHBondContact O-CB 3.41Å; S211-S231 PolarHBondContact O-OG 3.2Å
212	C	91.1	Very high	93	Very high	7 Å²	7	44 Å²	44	5%	0.047	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	156	-167.6	62.3	0	0	0	0	113.2	A175 G176 L183 P210 F215 Q230	A175-C212 WeakPolarHBondContact CB-O 3.29Å; G176-C212 PolarHBondContact N-O 3.35Å; L183-C212 PolarHBondContact O-N 3.05Å; P210-C212 PolarHBondContact O-N 2.93Å; C212-F215 HydrophobicContact CB-CD1 4.03Å; C212-F215 HydrophobicContact CB-CE1 4.1Å; C212-F215 WeakPolarHBondContact SG-CE1 3.08Å; C212-Q230 WeakPolarHBondContact CA-O 3.11Å
213	C	93.4	Very high	92.9	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.027	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	173.4	170.2	65.8	0	0	0	0	110.2	A161 F215 Q230	A161-C213 HydrophobicContact CB-CB 3.96Å; A161-C213 CarbonylContact O-C 3.59Å; A161-C213 VanDerWaalsContact O-CA 3.26Å; A161-C213 WeakPolarHBondContact O-CA 3.42Å; A161-C213 WeakPolarHBondContact O-CB 3.33Å; C213-F215 VanDerWaalsContact C-N 3.3Å; C213-F215 PolarHBondContact O-N 3.21Å; C213-Q230 PolarHBondContact N-O 2.71Å; C213-Q230 PolarHBondContact O-N 3.23Å
214	N	94	Very high	92.9	Very high	22 Å²	22	39 Å²	39	12%	0.118	22%	0.219	C	C	.	.	S	Bend	trans	60.2	36.4	178.9	-67.5	-44.2	0	0	0	113.9	H104 A161 Q230 Y269 G270 F322	H104-N214 PolarHBondContact CE1-OD1 3.01Å; A161-N214 VanDerWaalsContact CB-OD1 3.31Å; A161-N214 WeakPolarHBondContact CB-OD1 3.33Å; A161-N214 PolarHBondContact O-N 3.16Å; N214-Q230 HydrophobicContact CB-CB 4.38Å; N214-Q230 PolarHBondContact ND2-OE1 3.01Å; N214-Y269 HydrophobicContact CB-CD2 4.37Å; N214-Y269 WeakPolarHBondContact O-CA 3.45Å; N214-G270 PolarHBondContact O-N 2.89Å; N214-F322 HydrophobicContact CB-CE1 4.12Å; N214-F322 WeakPolarHBondContact OD1-CE1 3.23Å
215	F	93.7	Very high	92.9	Very high	12 Å²	12	37.2 Å²	37.2	5%	0.053	21%	0.211	C	C	.	.			trans	-121.8	151.6	175.5	64.3	-85.3	0	0	0	110.2	F174 A175 C212 C213 V217 V226	F174-F215 AromaticContact CD1-CE2 3.95Å; F174-F215 HydrophobicContact CD1-CE2 3.95Å; F174-F215 AromaticContact CD1-CZ 3.73Å; F174-F215 HydrophobicContact CD1-CZ 3.73Å; F174-F215 HydrophobicContact CE1-CZ 4.23Å; A175-F215 HydrophobicContact CB-CE1 3.93Å; A175-F215 HydrophobicContact CB-CZ 3.82Å; C212-F215 HydrophobicContact CB-CD1 4.03Å; C212-F215 HydrophobicContact CB-CE1 4.1Å; C212-F215 WeakPolarHBondContact SG-CE1 3.08Å; C213-F215 VanDerWaalsContact C-N 3.3Å; C213-F215 PolarHBondContact O-N 3.21Å; F215-V217 HydrophobicContact CD2-CG1 4.01Å; F215-V217 HydrophobicContact CE2-CG1 3.54Å; F215-V226 HydrophobicContact CD2-CG1 3.64Å; F215-V226 HydrophobicContact CE2-CG1 3.81Å; F215-V226 HydrophobicContact CE2-CG2 4.18Å; F215-V226 HydrophobicContact CG-CG1 4.34Å
216	P	94.1	Very high	93	Very high	19 Å²	19	35.2 Å²	35.2	12%	0.123	20%	0.196	C	C	.	.			trans	-86.2	157.1	170.2	35.9	-34.6	0	0	0	111.5	H271 M273	P216-H271 VanDerWaalsContact CD-CE1 3.42Å; P216-H271 WeakPolarHBondContact CD-CE1 3.29Å; P216-H271 WeakPolarHBondContact CD-NE2 3.18Å; P216-H271 VanDerWaalsContact CG-CD2 3.48Å; P216-H271 WeakPolarHBondContact CG-CD2 3.36Å; P216-H271 WeakPolarHBondContact CG-NE2 3.41Å; P216-M273 HydrophobicContact CB-CB 3.77Å; P216-M273 HydrophobicContact CG-CB 3.37Å
217	V	96.6	Very high	93.2	Very high	22 Å²	22	32.5 Å²	32.5	13%	0.133	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	145.3	166.4	-61.2	0	0	0	0	109.5	A164 F215 M224 F225 V226	A164-V217 WeakPolarHBondContact O-CG2 3.36Å; F215-V217 HydrophobicContact CD2-CG1 4.01Å; F215-V217 HydrophobicContact CE2-CG1 3.54Å; V217-M224 HydrophobicContact CB-CG 4.29Å; V217-M224 HydrophobicContact CB-SD 4.17Å; V217-M224 HydrophobicContact CG1-SD 4.23Å; V217-F225 WeakPolarHBondContact CA-O 3.26Å; V217-V226 HydrophobicContact CG1-CG2 4Å
218	A	97.2	Very high	93.4	Very high	8 Å²	8	28.9 Å²	28.9	7%	0.066	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.8	174.1	0	0	0	0	0	109.7	M224 F225 M273 A275 L280	A218-M224 CarbonylContact O-C 3.6Å; A218-M224 WeakPolarHBondContact O-CA 3.4Å; A218-F225 PolarHBondContact N-O 3.24Å; A218-F225 PolarHBondContact O-N 3.15Å; A218-M273 HydrophobicContact CB-CE 3.92Å; A218-M273 HydrophobicContact CB-CG 4.16Å; A218-A275 HydrophobicContact CB-CB 4.24Å; A218-L280 HydrophobicContact CB-CD2 4.06Å
219	V	97	Very high	93.2	Very high	40 Å²	40	26 Å²	26	24%	0.242	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.5	173.1	172.8	0	0	0	0	108.7	T165 Y167 K223 M224 F244 A275	T165-V219 HydrophobicContact CG2-CG2 3.56Å; T165-V219 WeakPolarHBondContact OG1-CG2 3.43Å; Y167-V219 HydrophobicContact CD2-CG1 4.13Å; V219-K223 VanDerWaalsContact CA-O 3.3Å; V219-K223 WeakPolarHBondContact CA-O 3.18Å; V219-M224 HydrophobicContact CG2-CB 4.26Å; V219-F244 HydrophobicContact CG1-CE2 4.34Å; V219-F244 HydrophobicContact CG2-CE2 4.16Å; V219-F244 HydrophobicContact CG2-CZ 3.93Å; V219-A275 VanDerWaalsContact O-CB 3.26Å; V219-A275 WeakPolarHBondContact O-CB 3.45Å
220	C	94.9	Very high	93	Very high	6 Å²	6	28.6 Å²	28.6	4%	0.041	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	129.9	176.7	-177.3	0	0	0	0	108.2	D222 K223 F225 A275 D277 L280 V300	C220-D222 PolarHBondContact O-N 3.23Å; C220-K223 PolarHBondContact N-O 2.87Å; C220-K223 PolarHBondContact O-N 3.02Å; C220-K223 VanDerWaalsContact O-N 3.11Å; C220-F225 HydrophobicContact CB-CD2 4.15Å; C220-F225 HydrophobicContact CB-CE2 3.83Å; C220-F225 WeakPolarHBondContact O-CE2 3.42Å; C220-A275 HydrophobicContact CB-CB 4.09Å; C220-D277 PolarHBondContact SG-O 3.21Å; C220-L280 HydrophobicContact CB-CD2 3.81Å; C220-V300 HydrophobicContact CB-CG1 4.48Å
221	R	89.4	Confident	92.5	Very high	124 Å²	124	27 Å²	27	47%	0.468	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.8	57.3	178.8	-59.2	-172.6	176.6	-169.1	9	114	K223 D301	R221-K223 PolarHBondContact O-N 3.2Å; R221-K223 VanDerWaalsContact O-N 3.16Å; R221-D301 IonicContact CZ-OD1 3.97Å; R221-D301 IonicContact CZ-OD2 3.06Å; R221-D301 VanDerWaalsContact CZ-OD2 3.27Å; R221-D301 IonicContact NH1-OD1 3.82Å; R221-D301 PolarHBondContact NH1-OD1 3.48Å; R221-D301 IonicContact NH1-OD2 3.51Å; R221-D301 PolarHBondContact NH1-OD2 3.32Å; R221-D301 VanDerWaalsContact NH1-OD2 3.13Å; R221-D301 IonicContact NH2-OD1 3.56Å; R221-D301 IonicContact NH2-OD2 3.79Å; R221-D301 PolarHBondContact NH2-OD2 3.47Å
222	D	92.4	Very high	91.1	Very high	106 Å²	106	27.7 Å²	27.7	57%	0.567	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.8	20.3	175.8	-51.9	-39.3	0	0	0	115.5	Y167 C220 F244	Y167-D222 HydrophobicContact CE2-CB 4.06Å; Y167-D222 WeakPolarHBondContact OH-CB 3.09Å; C220-D222 PolarHBondContact O-N 3.23Å; D222-F244 WeakPolarHBondContact O-CD2 3.47Å
223	K	96	Very high	89.3	Confident	65 Å²	65	32.1 Å²	32.1	28%	0.283	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	144.3	176.3	-63.8	-179.8	-177.1	-178.4	0	110.8	V219 C220 R221 F225 F242	V219-K223 VanDerWaalsContact CA-O 3.3Å; V219-K223 WeakPolarHBondContact CA-O 3.18Å; C220-K223 PolarHBondContact N-O 2.87Å; C220-K223 PolarHBondContact O-N 3.02Å; C220-K223 VanDerWaalsContact O-N 3.11Å; R221-K223 PolarHBondContact O-N 3.2Å; R221-K223 VanDerWaalsContact O-N 3.16Å; K223-F225 HydrophobicContact CB-CD2 4.49Å; K223-F225 HydrophobicContact CB-CE2 3.83Å; K223-F225 HydrophobicContact CB-CZ 4.3Å; K223-F242 WeakPolarHBondContact CA-O 3.29Å
224	M	97.5	Very high	87.5	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	135.4	170.1	174	171.2	62.4	0	0	109.9	T165 F174 M186 V217 A218 V219 Q241 F242 F244 W249	T165-M224 HydrophobicContact CG2-SD 3.82Å; F174-M224 HydrophobicContact CB-CE 4.38Å; M186-M224 HydrophobicContact CE-CE 3.31Å; M186-M224 HydrophobicContact SD-CE 4.08Å; V217-M224 HydrophobicContact CB-CG 4.29Å; V217-M224 HydrophobicContact CB-SD 4.17Å; V217-M224 HydrophobicContact CG1-SD 4.23Å; A218-M224 CarbonylContact O-C 3.6Å; A218-M224 WeakPolarHBondContact O-CA 3.4Å; V219-M224 HydrophobicContact CG2-CB 4.26Å; M224-Q241 CarbonylContact O-C 3.59Å; M224-Q241 VanDerWaalsContact O-CA 3.27Å; M224-Q241 WeakPolarHBondContact O-CA 3.46Å; M224-F242 HydrophobicContact CB-CB 4.27Å; M224-F242 HydrophobicContact CE-CB 4.18Å; M224-F242 HydrophobicContact CE-CD1 4.07Å; M224-F242 HydrophobicContact CE-CG 4.3Å; M224-F242 PolarHBondContact N-O 3.06Å; M224-F242 VanDerWaalsContact N-O 3.07Å; M224-F242 PolarHBondContact O-N 3.2Å; M224-F244 HydrophobicContact CB-CE1 4.38Å; M224-F244 HydrophobicContact CB-CE2 4.07Å; M224-F244 HydrophobicContact CB-CZ 3.66Å; M224-W249 HydrophobicContact CE-CH2 3.9Å; M224-W249 HydrophobicContact CE-CZ2 4.11Å
225	F	96.5	Very high	86	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	137.9	177.4	-67	-99.5	0	0	0	110.8	V217 A218 C220 K223 L239 F240 Q241 I252 M273 L280 Y298 V300	V217-F225 WeakPolarHBondContact CA-O 3.26Å; A218-F225 PolarHBondContact N-O 3.24Å; A218-F225 PolarHBondContact O-N 3.15Å; C220-F225 HydrophobicContact CB-CD2 4.15Å; C220-F225 HydrophobicContact CB-CE2 3.83Å; C220-F225 WeakPolarHBondContact O-CE2 3.42Å; K223-F225 HydrophobicContact CB-CD2 4.49Å; K223-F225 HydrophobicContact CB-CE2 3.83Å; K223-F225 HydrophobicContact CB-CZ 4.3Å; F225-L239 HydrophobicContact CB-CD1 4.33Å; F225-L239 HydrophobicContact CD1-CD1 4.28Å; F225-L239 HydrophobicContact CD1-CD2 4.42Å; F225-L239 HydrophobicContact CD1-CG 4.39Å; F225-F240 VanDerWaalsContact CA-O 3.29Å; F225-F240 WeakPolarHBondContact CA-O 3.45Å; F225-Q241 HydrophobicContact CD1-CB 3.99Å; F225-Q241 HydrophobicContact CE1-CB 3.84Å; F225-Q241 HydrophobicContact CZ-CB 4.29Å; F225-I252 HydrophobicContact CD1-CD1 3.98Å; F225-I252 HydrophobicContact CE1-CD1 3.58Å; F225-M273 HydrophobicContact CB-CE 4.13Å; F225-M273 VanDerWaalsContact O-CE 3.22Å; F225-M273 WeakPolarHBondContact O-CE 3.4Å; F225-L280 HydrophobicContact CB-CD1 3.64Å; F225-L280 HydrophobicContact CD1-CD1 3.55Å; F225-L280 HydrophobicContact CD2-CD1 3.99Å; F225-L280 HydrophobicContact CD2-CD2 4.31Å; F225-L280 HydrophobicContact CE1-CD1 4.13Å; F225-L280 HydrophobicContact CG-CD1 3.45Å; F225-L280 VanDerWaalsContact CG-CD1 3.45Å; F225-L280 HydrophobicContact CG-CD2 4.5Å; F225-Y298 HydrophobicContact CE1-CE1 4.5Å; F225-V300 HydrophobicContact CE1-CG1 4.18Å; F225-V300 HydrophobicContact CE2-CG1 4.28Å; F225-V300 HydrophobicContact CZ-CB 4.33Å; F225-V300 HydrophobicContact CZ-CG1 3.77Å
226	V	94.8	Very high	85	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.2	176.2	175.9	0	0	0	0	108.4	F174 F215 V217 F240 W249	F174-V226 HydrophobicContact CD1-CG2 4Å; F174-V226 HydrophobicContact CE1-CG1 4.46Å; F174-V226 HydrophobicContact CE1-CG2 4.13Å; F215-V226 HydrophobicContact CD2-CG1 3.64Å; F215-V226 HydrophobicContact CE2-CG1 3.81Å; F215-V226 HydrophobicContact CE2-CG2 4.18Å; F215-V226 HydrophobicContact CG-CG1 4.34Å; V217-V226 HydrophobicContact CG1-CG2 4Å; V226-F240 PolarHBondContact N-O 3.01Å; V226-F240 PolarHBondContact O-N 3.25Å; V226-W249 HydrophobicContact CB-CH2 4.36Å; V226-W249 HydrophobicContact CB-CZ3 4.28Å; V226-W249 HydrophobicContact CG2-CH2 3.5Å; V226-W249 VanDerWaalsContact CG2-CH2 3.5Å; V226-W249 HydrophobicContact CG2-CZ3 3.85Å
227	F	92.6	Very high	84.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.6	179.4	-178.5	-112.9	0	0	0	111.5	N237 L239 P265 R268 H271 M273 V282 W305	F227-N237 VanDerWaalsContact CE2-O 3.28Å; F227-N237 WeakPolarHBondContact CE2-O 3.3Å; F227-L239 HydrophobicContact CB-CD1 3.82Å; F227-L239 HydrophobicContact CD2-CB 4.11Å; F227-L239 HydrophobicContact CD2-CD1 4.17Å; F227-L239 HydrophobicContact CG-CD1 4.4Å; F227-P265 HydrophobicContact CE1-CB 3.94Å; F227-P265 HydrophobicContact CE1-CG 3.79Å; F227-P265 HydrophobicContact CZ-CB 3.79Å; F227-P265 HydrophobicContact CZ-CG 3.6Å; F227-R268 HydrophobicContact CE1-CG 4.25Å; F227-H271 AromaticContact CD1-NE2 3.5Å; F227-H271 PolarHBondContact O-CE1 3.46Å; F227-H271 VanDerWaalsContact O-CE1 3.31Å; F227-H271 PolarHBondContact O-NE2 3.47Å; F227-M273 HydrophobicContact CB-CE 4.33Å; F227-M273 HydrophobicContact CB-SD 3.93Å; F227-V282 HydrophobicContact CD1-CG1 4.2Å; F227-V282 HydrophobicContact CD1-CG2 4.15Å; F227-V282 HydrophobicContact CE1-CG1 4.13Å; F227-W305 HydrophobicContact CD2-CH2 4.26Å; F227-W305 AromaticContact CD2-CZ2 3.99Å; F227-W305 HydrophobicContact CD2-CZ2 3.99Å; F227-W305 HydrophobicContact CE2-CH2 4.18Å; F227-W305 AromaticContact CE2-CZ2 3.82Å; F227-W305 HydrophobicContact CE2-CZ2 3.82Å; F227-W305 HydrophobicContact CG-CH2 4.48Å; F227-W305 HydrophobicContact CZ-CH2 4.33Å; F227-W305 HydrophobicContact CZ-CZ2 4.34Å
228	S	90.1	Very high	84	Confident	11 Å²	11	45.7 Å²	45.7	8%	0.077	26%	0.255	C	S	.	.			trans	51.4	-142.2	172.9	-157	0	0	0	0	114.1	T236 N238 R268	S228-T236 WeakPolarHBondContact CA-O 3.18Å; S228-T236 PolarHBondContact OG-O 3.27Å; S228-N238 PolarHBondContact N-O 2.86Å; S228-R268 WeakPolarHBondContact CB-O 3.21Å; S228-R268 PolarHBondContact OG-N 2.94Å; S228-R268 PolarHBondContact OG-O 2.9Å; S228-R268 VanDerWaalsContact OG-O 3.1Å
229	G	87.1	Confident	83.6	Confident	3 Å²	3	45.5 Å²	45.5	3%	0.031	25%	0.253	C	S	.	.			trans	108.1	-177	-174.8	0	0	0	0	0	114.2	R268	G229-R268 WeakPolarHBondContact CA-O 3.39Å; G229-R268 PolarHBondContact N-O 2.96Å
230	Q	84.8	Confident	83.4	Confident	58 Å²	58	44.2 Å²	44.2	27%	0.271	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	112.5	-179.9	-165.6	179.6	9.4	0	0	110.4	R182 C212 C213 N214	R182-Q230 VanDerWaalsContact CD-O 3.28Å; R182-Q230 WeakPolarHBondContact CD-O 3.37Å; R182-Q230 PolarHBondContact NE-O 3.05Å; C212-Q230 WeakPolarHBondContact CA-O 3.11Å; C213-Q230 PolarHBondContact N-O 2.71Å; C213-Q230 PolarHBondContact O-N 3.23Å; N214-Q230 HydrophobicContact CB-CB 4.38Å; N214-Q230 PolarHBondContact ND2-OE1 3.01Å
231	S	77.6	Confident	83.4	Confident	13 Å²	13	45.2 Å²	45.2	9%	0.091	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	161.7	174.4	-175.9	0	0	0	0	111.6	S211 K234	S211-S231 WeakPolarHBondContact O-CA 3.43Å; S211-S231 WeakPolarHBondContact O-CB 3.41Å; S211-S231 PolarHBondContact O-OG 3.2Å; S231-K234 WeakPolarHBondContact CB-O 3.32Å; S231-K234 PolarHBondContact OG-O 3.36Å
232	G	61.9	Low	83.7	Confident	54 Å²	54	39.3 Å²	39.3	56%	0.557	23%	0.226	S	C	*	.	S	Bend	trans	-65.9	-51.4	-176.5	0	0	0	0	0	114.5
233	A	53.2	Low	83.9	Confident	100 Å²	100	38.5 Å²	38.5	83%	0.826	22%	0.219	S	C	*	.	S	Bend	trans	-125.3	-15.8	-174.9	0	0	0	0	0	114.5
234	K	56.4	Low	83.9	Confident	159 Å²	159	35.8 Å²	35.8	69%	0.691	21%	0.207	S	C	*	.			trans	-135.2	90.7	-179.6	-69.1	-176.8	-179.4	178.7	0	110	S231 T236	S231-K234 WeakPolarHBondContact CB-O 3.32Å; S231-K234 PolarHBondContact OG-O 3.36Å; K234-T236 HydrophobicContact CB-CG2 4.47Å; K234-T236 PolarHBondContact O-N 3.19Å
235	I	63	Low	83.6	Confident	84 Å²	84	45.2 Å²	45.2	43%	0.431	25%	0.248	S	C	.	.			trans	-79.2	113.2	170.7	-57.5	176.4	0	0	0	107.3	R267	I235-R267 HydrophobicContact CG2-CB 4.13Å; I235-R267 HydrophobicContact CG2-CG 4.43Å
236	T	72	Confident	83.3	Confident	37 Å²	37	46.9 Å²	46.9	23%	0.227	27%	0.266	C	S	.	.			trans	-111.4	157.2	-179.5	72	0	0	0	0	110.8	S228 K234 N238	S228-T236 WeakPolarHBondContact CA-O 3.18Å; S228-T236 PolarHBondContact OG-O 3.27Å; K234-T236 HydrophobicContact CB-CG2 4.47Å; K234-T236 PolarHBondContact O-N 3.19Å; T236-N238 VanDerWaalsContact C-N 3.33Å
237	N	83.5	Confident	83.4	Confident	51 Å²	51	49.6 Å²	49.6	27%	0.273	28%	0.279	S	S	.	.			trans	-102.4	28.2	165.9	64.7	-23.6	0	0	0	110.8	F227 P264 R267	F227-N237 VanDerWaalsContact CE2-O 3.28Å; F227-N237 WeakPolarHBondContact CE2-O 3.3Å; N237-P264 WeakPolarHBondContact ND2-CG 3.49Å; N237-R267 HydrophobicContact CB-CB 4.21Å
238	N	85.2	Confident	83.4	Confident	33 Å²	33	53.9 Å²	53.9	18%	0.176	30%	0.3	C	S	.	.			trans	-74.1	143.1	178.6	-67.8	-17.3	0	0	0	109.6	S228 T236 F240 R251	S228-N238 PolarHBondContact N-O 2.86Å; T236-N238 VanDerWaalsContact C-N 3.33Å; N238-F240 HydrophobicContact CB-CD2 4.14Å; N238-F240 HydrophobicContact CB-CE2 3.47Å; N238-F240 VanDerWaalsContact CB-CE2 3.47Å; N238-F240 HydrophobicContact CB-CZ 3.97Å; N238-R251 HydrophobicContact CB-CG 4.4Å
239	L	90.1	Very high	83.6	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.6	167.9	-178.4	65.7	0	0	0	108	F225 F227 I252 Y298 W305	F225-L239 HydrophobicContact CB-CD1 4.33Å; F225-L239 HydrophobicContact CD1-CD1 4.28Å; F225-L239 HydrophobicContact CD1-CD2 4.42Å; F225-L239 HydrophobicContact CD1-CG 4.39Å; F227-L239 HydrophobicContact CB-CD1 3.82Å; F227-L239 HydrophobicContact CD2-CB 4.11Å; F227-L239 HydrophobicContact CD2-CD1 4.17Å; F227-L239 HydrophobicContact CG-CD1 4.4Å; L239-I252 HydrophobicContact CB-CB 4.25Å; L239-I252 HydrophobicContact CD2-CB 4.38Å; L239-I252 HydrophobicContact CD2-CD1 3.79Å; L239-I252 HydrophobicContact CD2-CG2 4.38Å; L239-I252 HydrophobicContact CG-CB 4.34Å; L239-I252 HydrophobicContact CG-CD1 4.01Å; L239-I252 HydrophobicContact CG-CG1 4.5Å; L239-I252 WeakPolarHBondContact O-CB 3.5Å; L239-I252 PolarHBondContact O-N 2.99Å; L239-Y298 HydrophobicContact CD2-CD1 3.62Å; L239-Y298 HydrophobicContact CD2-CD2 3.97Å; L239-Y298 HydrophobicContact CD2-CE1 3.49Å; L239-Y298 VanDerWaalsContact CD2-CE1 3.49Å; L239-Y298 HydrophobicContact CD2-CE2 3.85Å; L239-Y298 HydrophobicContact CD2-CG 3.85Å; L239-W305 HydrophobicContact CD2-CZ2 4.15Å
240	F	92.3	Very high	83.6	Confident	13 Å²	13	56 Å²	56	6%	0.057	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.2	175.8	-65.3	-97.2	0	0	0	109.5	E207 P209 F225 V226 N238 W249 T250 R251	E207-F240 WeakPolarHBondContact O-CD1 3.2Å; E207-F240 WeakPolarHBondContact O-CE1 3.36Å; P209-F240 HydrophobicContact CB-CD1 4.45Å; P209-F240 HydrophobicContact CB-CD2 4.12Å; P209-F240 HydrophobicContact CB-CE2 4.19Å; P209-F240 HydrophobicContact CB-CG 4.25Å; P209-F240 HydrophobicContact CB-CZ 4.4Å; P209-F240 HydrophobicContact CG-CB 3.89Å; P209-F240 HydrophobicContact CG-CD1 3.91Å; P209-F240 HydrophobicContact CG-CD2 4.05Å; P209-F240 HydrophobicContact CG-CE1 4.41Å; P209-F240 HydrophobicContact CG-CG 3.71Å; F225-F240 VanDerWaalsContact CA-O 3.29Å; F225-F240 WeakPolarHBondContact CA-O 3.45Å; V226-F240 PolarHBondContact N-O 3.01Å; V226-F240 PolarHBondContact O-N 3.25Å; N238-F240 HydrophobicContact CB-CD2 4.14Å; N238-F240 HydrophobicContact CB-CE2 3.47Å; N238-F240 VanDerWaalsContact CB-CE2 3.47Å; N238-F240 HydrophobicContact CB-CZ 3.97Å; F240-W249 HydrophobicContact CB-CE3 3.78Å; F240-W249 HydrophobicContact CB-CZ3 3.85Å; F240-T250 WeakPolarHBondContact CA-O 3.45Å; F240-R251 HydrophobicContact CD1-CB 3.85Å; F240-R251 HydrophobicContact CD1-CG 4.12Å; F240-R251 HydrophobicContact CE1-CB 3.71Å; F240-R251 HydrophobicContact CE1-CG 3.77Å; F240-R251 HydrophobicContact CZ-CG 4.11Å
241	Q	94.3	Very high	83.6	Confident	27 Å²	27	56.7 Å²	56.7	13%	0.126	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	143.3	169.3	66.2	174.8	31.7	0	0	110.3	M224 F225 W249 T250 I252	M224-Q241 CarbonylContact O-C 3.59Å; M224-Q241 VanDerWaalsContact O-CA 3.27Å; M224-Q241 WeakPolarHBondContact O-CA 3.46Å; F225-Q241 HydrophobicContact CD1-CB 3.99Å; F225-Q241 HydrophobicContact CE1-CB 3.84Å; F225-Q241 HydrophobicContact CZ-CB 4.29Å; Q241-W249 WeakPolarHBondContact O-CA 3.5Å; Q241-T250 PolarHBondContact N-O 2.95Å; Q241-T250 PolarHBondContact O-N 3.49Å; Q241-I252 HydrophobicContact CB-CD1 4.16Å; Q241-I252 HydrophobicContact CB-CG1 4.47Å; Q241-I252 HydrophobicContact CG-CD1 4.27Å; Q241-I252 HydrophobicContact CG-CG1 4.18Å
242	F	97.2	Very high	83.8	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.9	174.4	-179.9	-106.1	0	0	0	109.9	W172 M186 K223 M224 F244 H247 M248 W249	W172-F242 HydrophobicContact CE3-CE1 4.35Å; W172-F242 AromaticContact CZ3-CE1 3.99Å; W172-F242 HydrophobicContact CZ3-CE1 3.99Å; W172-F242 HydrophobicContact CZ3-CZ 4.34Å; M186-F242 HydrophobicContact CE-CD1 4.27Å; M186-F242 HydrophobicContact CE-CD2 4.37Å; M186-F242 HydrophobicContact CE-CE1 4.17Å; M186-F242 HydrophobicContact CE-CE2 4.27Å; M186-F242 HydrophobicContact CE-CG 4.35Å; M186-F242 HydrophobicContact CE-CZ 4.15Å; K223-F242 WeakPolarHBondContact CA-O 3.29Å; M224-F242 HydrophobicContact CB-CB 4.27Å; M224-F242 HydrophobicContact CE-CB 4.18Å; M224-F242 HydrophobicContact CE-CD1 4.07Å; M224-F242 HydrophobicContact CE-CG 4.3Å; M224-F242 PolarHBondContact N-O 3.06Å; M224-F242 VanDerWaalsContact N-O 3.07Å; M224-F242 PolarHBondContact O-N 3.2Å; F242-F244 AromaticContact CD1-CD1 3.96Å; F242-F244 HydrophobicContact CD1-CD1 3.96Å; F242-F244 HydrophobicContact CD1-CE1 4.22Å; F242-F244 HydrophobicContact CD1-CG 4.34Å; F242-F244 AromaticContact CE1-CD1 3.82Å; F242-F244 HydrophobicContact CE1-CD1 3.82Å; F242-F244 HydrophobicContact CE1-CE1 4.36Å; F242-F244 HydrophobicContact CE1-CG 4.38Å; F242-H247 VanDerWaalsContact CE2-C 3.45Å; F242-H247 HydrophobicContact CE2-CB 4.19Å; F242-H247 HydrophobicContact CZ-CB 4.02Å; F242-H247 AromaticContact CZ-CD2 3.94Å; F242-M248 WeakPolarHBondContact CA-O 3.18Å; F242-W249 HydrophobicContact CB-CD2 3.86Å; F242-W249 HydrophobicContact CB-CE3 3.69Å; F242-W249 HydrophobicContact CB-CH2 3.67Å; F242-W249 HydrophobicContact CB-CZ2 3.85Å; F242-W249 HydrophobicContact CB-CZ3 3.59Å; F242-W249 AromaticContact CD2-CD1 3.75Å; F242-W249 AromaticContact CD2-CD2 3.77Å; F242-W249 HydrophobicContact CD2-CD2 3.77Å; F242-W249 AromaticContact CD2-CE2 3.49Å; F242-W249 VanDerWaalsContact CD2-CE2 3.49Å; F242-W249 HydrophobicContact CD2-CE3 4.47Å; F242-W249 AromaticContact CD2-CG 3.96Å; F242-W249 HydrophobicContact CD2-CG 3.96Å; F242-W249 AromaticContact CD2-CZ2 3.99Å; F242-W249 HydrophobicContact CD2-CZ2 3.99Å; F242-W249 AromaticContact CD2-NE1 3.47Å; F242-W249 AromaticContact CE2-NE1 3.88Å; F242-W249 HydrophobicContact CG-CD2 4.28Å; F242-W249 HydrophobicContact CG-CH2 4.39Å; F242-W249 HydrophobicContact CG-CZ2 4.1Å
243	E	96.1	Very high	84	Confident	88 Å²	88	56.2 Å²	56.2	41%	0.411	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	114.6	171.8	-177.3	174.9	-178.3	0	0	110.3	K245 G246 H247 M248	E243-K245 VanDerWaalsContact C-N 3.34Å; E243-K245 PolarHBondContact O-N 3.02Å; E243-G246 PolarHBondContact O-N 3.01Å; E243-H247 WeakPolarHBondContact O-CA 3.44Å; E243-H247 PolarHBondContact O-N 3.28Å; E243-M248 PolarHBondContact N-O 2.66Å
244	F	96	Very high	84.2	Confident	9 Å²	9	53 Å²	53	4%	0.039	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-35	-176	-67.5	-78.4	0	0	0	113.8	T165 Y167 W172 V219 D222 M224 F242 H247	T165-F244 HydrophobicContact CG2-CZ 4.24Å; Y167-F244 HydrophobicContact CD1-CB 3.68Å; Y167-F244 AromaticContact CD1-CD1 3.72Å; Y167-F244 HydrophobicContact CD1-CD1 3.72Å; Y167-F244 AromaticContact CD1-CD2 3.32Å; Y167-F244 HydrophobicContact CD1-CD2 3.32Å; Y167-F244 HydrophobicContact CD1-CE1 4.11Å; Y167-F244 AromaticContact CD1-CE2 3.76Å; Y167-F244 HydrophobicContact CD1-CE2 3.76Å; Y167-F244 AromaticContact CD1-CG 3.3Å; Y167-F244 HydrophobicContact CD1-CG 3.3Å; Y167-F244 HydrophobicContact CD1-CZ 4.11Å; Y167-F244 AromaticContact CD2-CD2 3.92Å; Y167-F244 HydrophobicContact CD2-CD2 3.92Å; Y167-F244 AromaticContact CD2-CE2 3.75Å; Y167-F244 HydrophobicContact CD2-CE2 3.75Å; Y167-F244 HydrophobicContact CD2-CZ 4.39Å; Y167-F244 HydrophobicContact CE1-CB 3.47Å; Y167-F244 VanDerWaalsContact CE1-CB 3.47Å; Y167-F244 HydrophobicContact CE1-CD1 4.39Å; Y167-F244 AromaticContact CE1-CD2 3.48Å; Y167-F244 HydrophobicContact CE1-CD2 3.48Å; Y167-F244 VanDerWaalsContact CE1-CD2 3.48Å; Y167-F244 HydrophobicContact CE1-CE2 4.26Å; Y167-F244 AromaticContact CE1-CG 3.55Å; Y167-F244 HydrophobicContact CE1-CG 3.55Å; Y167-F244 HydrophobicContact CE2-CD2 4.06Å; Y167-F244 HydrophobicContact CE2-CE2 4.27Å; Y167-F244 HydrophobicContact CG-CD1 4.22Å; Y167-F244 AromaticContact CG-CD2 3.55Å; Y167-F244 HydrophobicContact CG-CD2 3.55Å; Y167-F244 HydrophobicContact CG-CE1 4.14Å; Y167-F244 AromaticContact CG-CE2 3.46Å; Y167-F244 HydrophobicContact CG-CE2 3.46Å; Y167-F244 VanDerWaalsContact CG-CE2 3.46Å; Y167-F244 AromaticContact CG-CG 3.93Å; Y167-F244 HydrophobicContact CG-CG 3.93Å; Y167-F244 AromaticContact CG-CZ 3.76Å; Y167-F244 HydrophobicContact CG-CZ 3.76Å; Y167-F244 AromaticContact CZ-CD2 3.84Å; W172-F244 HydrophobicContact CB-CE1 4.44Å; W172-F244 AromaticContact CD1-CE1 3.89Å; W172-F244 AromaticContact CD2-CD1 3.8Å; W172-F244 HydrophobicContact CD2-CD1 3.8Å; W172-F244 AromaticContact CD2-CE1 3.68Å; W172-F244 HydrophobicContact CD2-CE1 3.68Å; W172-F244 AromaticContact CE2-CD1 3.58Å; W172-F244 AromaticContact CE2-CE1 3.81Å; W172-F244 HydrophobicContact CE3-CD1 4.11Å; W172-F244 HydrophobicContact CE3-CE1 4.19Å; W172-F244 HydrophobicContact CG-CD1 4.35Å; W172-F244 AromaticContact CG-CE1 3.77Å; W172-F244 HydrophobicContact CG-CE1 3.77Å; W172-F244 HydrophobicContact CH2-CD1 4.05Å; W172-F244 AromaticContact CZ2-CD1 3.74Å; W172-F244 HydrophobicContact CZ2-CD1 3.74Å; W172-F244 HydrophobicContact CZ2-CE1 4.42Å; W172-F244 HydrophobicContact CZ3-CD1 4.21Å; W172-F244 AromaticContact NE1-CD1 3.98Å; W172-F244 AromaticContact NE1-CE1 3.91Å; V219-F244 HydrophobicContact CG1-CE2 4.34Å; V219-F244 HydrophobicContact CG2-CE2 4.16Å; V219-F244 HydrophobicContact CG2-CZ 3.93Å; D222-F244 WeakPolarHBondContact O-CD2 3.47Å; M224-F244 HydrophobicContact CB-CE1 4.38Å; M224-F244 HydrophobicContact CB-CE2 4.07Å; M224-F244 HydrophobicContact CB-CZ 3.66Å; F242-F244 AromaticContact CD1-CD1 3.96Å; F242-F244 HydrophobicContact CD1-CD1 3.96Å; F242-F244 HydrophobicContact CD1-CE1 4.22Å; F242-F244 HydrophobicContact CD1-CG 4.34Å; F242-F244 AromaticContact CE1-CD1 3.82Å; F242-F244 HydrophobicContact CE1-CD1 3.82Å; F242-F244 HydrophobicContact CE1-CE1 4.36Å; F242-F244 HydrophobicContact CE1-CG 4.38Å; F244-H247 PolarHBondContact O-CD2 3.41Å; F244-H247 PolarHBondContact O-NE2 2.91Å
245	K	91.7	Very high	84.1	Confident	199 Å²	199	47.5 Å²	47.5	87%	0.865	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-30.4	-176.8	-170.4	176.9	179	-179.5	0	113.2	E243	E243-K245 VanDerWaalsContact C-N 3.34Å; E243-K245 PolarHBondContact O-N 3.02Å
246	G	89.9	Confident	83.6	Confident	39 Å²	39	45.3 Å²	45.3	40%	0.402	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-3	-176.9	0	0	0	0	0	114.8	E243 M248	E243-G246 PolarHBondContact O-N 3.01Å; G246-M248 PolarHBondContact O-N 3.49Å
247	H	95.7	Very high	82.3	Confident	60 Å²	60	48 Å²	48	28%	0.278	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	41.7	-173.5	-52.7	149.8	0	0	0	113.4	W172 I202 D203 S205 F242 E243 F244	W172-H247 AromaticContact CH2-NE2 3.88Å; I202-H247 HydrophobicContact CG2-CB 3.94Å; I202-H247 VanDerWaalsContact CG2-CG 3.5Å; D203-H247 WeakPolarHBondContact O-CB 3.5Å; S205-H247 PolarHBondContact N-O 3.05Å; S205-H247 PolarHBondContact OG-O 3.14Å; F242-H247 VanDerWaalsContact CE2-C 3.45Å; F242-H247 HydrophobicContact CE2-CB 4.19Å; F242-H247 HydrophobicContact CZ-CB 4.02Å; F242-H247 AromaticContact CZ-CD2 3.94Å; E243-H247 WeakPolarHBondContact O-CA 3.44Å; E243-H247 PolarHBondContact O-N 3.28Å; F244-H247 PolarHBondContact O-CD2 3.41Å; F244-H247 PolarHBondContact O-NE2 2.91Å
248	M	93.4	Very high	80.4	Confident	89 Å²	89	46 Å²	46	44%	0.438	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.4	-172.1	-169.6	176.8	-64.4	0	0	110.8	F242 E243 G246	F242-M248 WeakPolarHBondContact CA-O 3.18Å; E243-M248 PolarHBondContact N-O 2.66Å; G246-M248 PolarHBondContact O-N 3.49Å
249	W	93.5	Very high	78.8	Confident	3 Å²	3	48.4 Å²	48.4	1%	0.011	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	137.5	170.1	-73.4	101	0	0	0	111.1	F174 M186 S205 G206 E207 P209 M224 V226 F240 Q241 F242	F174-W249 HydrophobicContact CD1-CH2 4.29Å; F174-W249 HydrophobicContact CD1-CZ2 4.23Å; F174-W249 AromaticContact CD2-CZ2 3.87Å; F174-W249 HydrophobicContact CD2-CZ2 3.87Å; F174-W249 HydrophobicContact CE1-CH2 4.13Å; F174-W249 HydrophobicContact CE1-CZ2 4.02Å; F174-W249 AromaticContact CE2-CZ2 3.63Å; F174-W249 HydrophobicContact CE2-CZ2 3.63Å; F174-W249 HydrophobicContact CG-CZ2 4.17Å; F174-W249 HydrophobicContact CZ-CH2 4.26Å; F174-W249 AromaticContact CZ-CZ2 3.72Å; F174-W249 HydrophobicContact CZ-CZ2 3.72Å; M186-W249 HydrophobicContact CE-CZ2 3.61Å; S205-W249 PolarHBondContact O-N 2.99Å; G206-W249 WeakPolarHBondContact CA-O 3.21Å; E207-W249 PolarHBondContact N-O 2.65Å; E207-W249 WeakPolarHBondContact O-CB 3.44Å; P209-W249 HydrophobicContact CG-CD2 3.89Å; P209-W249 HydrophobicContact CG-CE3 3.73Å; P209-W249 HydrophobicContact CG-CH2 4.08Å; P209-W249 HydrophobicContact CG-CZ2 4.2Å; P209-W249 HydrophobicContact CG-CZ3 3.84Å; M224-W249 HydrophobicContact CE-CH2 3.9Å; M224-W249 HydrophobicContact CE-CZ2 4.11Å; V226-W249 HydrophobicContact CB-CH2 4.36Å; V226-W249 HydrophobicContact CB-CZ3 4.28Å; V226-W249 HydrophobicContact CG2-CH2 3.5Å; V226-W249 VanDerWaalsContact CG2-CH2 3.5Å; V226-W249 HydrophobicContact CG2-CZ3 3.85Å; F240-W249 HydrophobicContact CB-CE3 3.78Å; F240-W249 HydrophobicContact CB-CZ3 3.85Å; Q241-W249 WeakPolarHBondContact O-CA 3.5Å; F242-W249 HydrophobicContact CB-CD2 3.86Å; F242-W249 HydrophobicContact CB-CE3 3.69Å; F242-W249 HydrophobicContact CB-CH2 3.67Å; F242-W249 HydrophobicContact CB-CZ2 3.85Å; F242-W249 HydrophobicContact CB-CZ3 3.59Å; F242-W249 AromaticContact CD2-CD1 3.75Å; F242-W249 AromaticContact CD2-CD2 3.77Å; F242-W249 HydrophobicContact CD2-CD2 3.77Å; F242-W249 AromaticContact CD2-CE2 3.49Å; F242-W249 VanDerWaalsContact CD2-CE2 3.49Å; F242-W249 HydrophobicContact CD2-CE3 4.47Å; F242-W249 AromaticContact CD2-CG 3.96Å; F242-W249 HydrophobicContact CD2-CG 3.96Å; F242-W249 AromaticContact CD2-CZ2 3.99Å; F242-W249 HydrophobicContact CD2-CZ2 3.99Å; F242-W249 AromaticContact CD2-NE1 3.47Å; F242-W249 AromaticContact CE2-NE1 3.88Å; F242-W249 HydrophobicContact CG-CD2 4.28Å; F242-W249 HydrophobicContact CG-CH2 4.39Å; F242-W249 HydrophobicContact CG-CZ2 4.1Å
250	T	87.9	Confident	76.9	Confident	56 Å²	56	51.1 Å²	51.1	34%	0.344	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	128.5	168.6	-47.6	0	0	0	0	108	F240 Q241 I252	F240-T250 WeakPolarHBondContact CA-O 3.45Å; Q241-T250 PolarHBondContact N-O 2.95Å; Q241-T250 PolarHBondContact O-N 3.49Å; T250-I252 PolarHBondContact O-N 2.62Å
251	R	85.8	Confident	75.4	Confident	73 Å²	73	51.3 Å²	51.3	28%	0.275	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	125.3	168.5	-172.6	178.5	61.7	93.7	1.2	107.1	E207 N238 F240 P253	E207-R251 HydrophobicContact CB-CB 4.09Å; E207-R251 VanDerWaalsContact CD-CB 3.42Å; E207-R251 HydrophobicContact CG-CB 4.42Å; E207-R251 VanDerWaalsContact OE1-CB 3.31Å; E207-R251 WeakPolarHBondContact OE1-CB 3.44Å; E207-R251 IonicContact OE1-NE 2.74Å; E207-R251 PolarHBondContact OE1-NE 3.34Å; E207-R251 VanDerWaalsContact OE1-NE 3.16Å; E207-R251 VanDerWaalsContact OE2-CB 3.26Å; E207-R251 WeakPolarHBondContact OE2-CB 3.25Å; E207-R251 PolarHBondContact OE2-N 2.95Å; N238-R251 HydrophobicContact CB-CG 4.4Å; F240-R251 HydrophobicContact CD1-CB 3.85Å; F240-R251 HydrophobicContact CD1-CG 4.12Å; F240-R251 HydrophobicContact CE1-CB 3.71Å; F240-R251 HydrophobicContact CE1-CG 3.77Å; F240-R251 HydrophobicContact CZ-CG 4.11Å; R251-P253 VanDerWaalsContact O-CD 3.27Å; R251-P253 WeakPolarHBondContact O-CD 3.47Å
252	I	79.9	Confident	74.2	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.041	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	117.1	172.6	-64	-173.4	0	0	0	106.5	F225 L239 Q241 T250 T254 Y298	F225-I252 HydrophobicContact CD1-CD1 3.98Å; F225-I252 HydrophobicContact CE1-CD1 3.58Å; L239-I252 HydrophobicContact CB-CB 4.25Å; L239-I252 HydrophobicContact CD2-CB 4.38Å; L239-I252 HydrophobicContact CD2-CD1 3.79Å; L239-I252 HydrophobicContact CD2-CG2 4.38Å; L239-I252 HydrophobicContact CG-CB 4.34Å; L239-I252 HydrophobicContact CG-CD1 4.01Å; L239-I252 HydrophobicContact CG-CG1 4.5Å; L239-I252 WeakPolarHBondContact O-CB 3.5Å; L239-I252 PolarHBondContact O-N 2.99Å; Q241-I252 HydrophobicContact CB-CD1 4.16Å; Q241-I252 HydrophobicContact CB-CG1 4.47Å; Q241-I252 HydrophobicContact CG-CD1 4.27Å; Q241-I252 HydrophobicContact CG-CG1 4.18Å; T250-I252 PolarHBondContact O-N 2.62Å; I252-T254 PolarHBondContact O-N 3.07Å; I252-Y298 HydrophobicContact CD1-CE1 4.2Å; I252-Y298 HydrophobicContact CG2-CE2 4.38Å; I252-Y298 WeakPolarHBondContact CG2-OH 3.4Å
253	P	66.6	Low	73.1	Confident	48 Å²	48	56.6 Å²	56.6	31%	0.312	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-60.4	127.2	-179.6	21.4	-28.9	0	0	0	109.2	R251 E255	R251-P253 VanDerWaalsContact O-CD 3.27Å; R251-P253 WeakPolarHBondContact O-CD 3.47Å; P253-E255 HydrophobicContact CB-CG 4.01Å; P253-E255 PolarHBondContact O-N 3.27Å
254	T	57.2	Low	72.5	Confident	32 Å²	32	53 Å²	53	20%	0.196	29%	0.293	C	S	.	.			trans	-76.8	32	-176.1	-40.7	0	0	0	0	111.6	I252 H256 P264	I252-T254 PolarHBondContact O-N 3.07Å; T254-H256 PolarHBondContact O-CE1 3.05Å; T254-H256 PolarHBondContact O-N 3.36Å; T254-H256 PolarHBondContact O-ND1 2.81Å; T254-P264 HydrophobicContact CG2-CB 3.89Å; T254-P264 HydrophobicContact CG2-CG 3.28Å
255	E	55.4	Low	72.1	Confident	44 Å²	44	52.6 Å²	52.6	21%	0.206	29%	0.292	C	S	.	.			trans	-90.9	47.5	-166.6	-62.1	167.1	-177.7	0	0	111.8	P253 L257 L258	P253-E255 HydrophobicContact CB-CG 4.01Å; P253-E255 PolarHBondContact O-N 3.27Å; E255-L257 PolarHBondContact O-N 3.35Å; E255-L258 HydrophobicContact CB-CD1 3.48Å; E255-L258 VanDerWaalsContact CB-CD1 3.48Å; E255-L258 HydrophobicContact CB-CG 3.92Å; E255-L258 HydrophobicContact CG-CD1 4.16Å; E255-L258 WeakPolarHBondContact O-CB 3.44Å; E255-L258 PolarHBondContact O-N 3.03Å; E255-L258 WeakPolarHBondContact OE2-CD1 3.18Å
256	H	52.6	Low	71.9	Confident	38 Å²	38	48 Å²	48	18%	0.176	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-48.4	-27.7	173.4	56.3	-85.2	0	0	0	114	T254 L258 R259 G260 S261 P262 P263 P264	T254-H256 PolarHBondContact O-CE1 3.05Å; T254-H256 PolarHBondContact O-N 3.36Å; T254-H256 PolarHBondContact O-ND1 2.81Å; H256-L258 VanDerWaalsContact C-N 3.33Å; H256-L258 PolarHBondContact O-N 2.91Å; H256-R259 PolarHBondContact O-N 3.24Å; H256-G260 PolarHBondContact O-N 3.15Å; H256-S261 CarbonylContact C-O 3.46Å; H256-S261 VanDerWaalsContact CA-OG 3.27Å; H256-S261 WeakPolarHBondContact CA-OG 3.47Å; H256-S261 WeakPolarHBondContact CB-O 3.49Å; H256-S261 PolarHBondContact O-N 3.16Å; H256-S261 VanDerWaalsContact O-O 3.04Å; H256-S261 PolarHBondContact O-OG 2.67Å; H256-P262 WeakPolarHBondContact CB-O 3.32Å; H256-P263 WeakPolarHBondContact CD2-CA 3.35Å; H256-P263 VanDerWaalsContact CG-CA 3.42Å; H256-P263 WeakPolarHBondContact NE2-CA 3.45Å; H256-P263 WeakPolarHBondContact NE2-CB 3.47Å; H256-P264 VanDerWaalsContact CE1-CD 3.49Å; H256-P264 WeakPolarHBondContact CE1-CD 3.33Å; H256-P264 WeakPolarHBondContact ND1-CD 3.24Å
257	L	43.3	Very low	71.8	Confident	93 Å²	93	52.1 Å²	52.1	49%	0.487	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-60	-37.7	175	-65.1	169.8	0	0	0	112.8	E255 R259 G260	E255-L257 PolarHBondContact O-N 3.35Å; L257-R259 PolarHBondContact O-N 3.31Å; L257-G260 PolarHBondContact O-N 3.41Å
258	L	45.4	Very low	71.6	Confident	11 Å²	11	49.4 Å²	49.4	6%	0.058	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-67.5	-26.1	-177.8	-67.2	174.9	0	0	0	113.3	E255 H256 R501 Q504 L505 Q508	E255-L258 HydrophobicContact CB-CD1 3.48Å; E255-L258 VanDerWaalsContact CB-CD1 3.48Å; E255-L258 HydrophobicContact CB-CG 3.92Å; E255-L258 HydrophobicContact CG-CD1 4.16Å; E255-L258 WeakPolarHBondContact O-CB 3.44Å; E255-L258 PolarHBondContact O-N 3.03Å; E255-L258 WeakPolarHBondContact OE2-CD1 3.18Å; H256-L258 VanDerWaalsContact C-N 3.33Å; H256-L258 PolarHBondContact O-N 2.91Å; L258-R501 PolarHBondContact O-NE 2.97Å; L258-R501 PolarHBondContact O-NH1 2.75Å; L258-R501 PolarHBondContact O-NH2 3.3Å; L258-Q504 HydrophobicContact CD2-CB 4.25Å; L258-L505 HydrophobicContact CB-CD2 3.85Å; L258-L505 HydrophobicContact CD1-CD2 3.52Å; L258-L505 HydrophobicContact CD2-CB 4.36Å; L258-L505 HydrophobicContact CD2-CD2 3.63Å; L258-L505 HydrophobicContact CD2-CG 3.83Å; L258-L505 HydrophobicContact CG-CD2 3.86Å; L258-Q508 VanDerWaalsContact CD1-OE1 3.24Å; L258-Q508 HydrophobicContact CD2-CG 4.45Å
259	R	50	Low	71.6	Confident	82 Å²	82	49.1 Å²	49.1	31%	0.309	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-101	-3	-176.1	-64.6	-176.5	-178.7	138.9	-7.1	112.6	H256 L257 S261 S302 Q303 T304 R501	H256-R259 PolarHBondContact O-N 3.24Å; L257-R259 PolarHBondContact O-N 3.31Å; R259-S261 PolarHBondContact O-N 3.28Å; R259-S302 WeakPolarHBondContact CD-O 3.36Å; R259-S302 PolarHBondContact NE-O 2.9Å; R259-S302 PolarHBondContact NH1-O 2.8Å; R259-Q303 PolarHBondContact NH1-O 3.14Å; R259-T304 HydrophobicContact CB-CG2 3.8Å; R259-T304 HydrophobicContact CG-CG2 4.18Å; R259-R501 PolarHBondContact O-NH2 3.32Å
260	G	49.9	Very low	71.6	Confident	61 Å²	61	49.2 Å²	49.2	63%	0.629	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	19.4	-169.1	0	0	0	0	0	112.7	H256 L257	H256-G260 PolarHBondContact O-N 3.15Å; L257-G260 PolarHBondContact O-N 3.41Å
261	S	62.6	Low	72	Confident	18 Å²	18	47 Å²	47	13%	0.126	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-88.9	150.6	179.2	54.9	0	0	0	0	110.9	H256 R259	H256-S261 CarbonylContact C-O 3.46Å; H256-S261 VanDerWaalsContact CA-OG 3.27Å; H256-S261 WeakPolarHBondContact CA-OG 3.47Å; H256-S261 WeakPolarHBondContact CB-O 3.49Å; H256-S261 PolarHBondContact O-N 3.16Å; H256-S261 VanDerWaalsContact O-O 3.04Å; H256-S261 PolarHBondContact O-OG 2.67Å; R259-S261 PolarHBondContact O-N 3.28Å
262	P	67.9	Low	72.6	Confident	57 Å²	57	44 Å²	44	37%	0.37	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-51.3	150.4	172.9	-27.7	32.8	0	0	0	113.5	H256 W305	H256-P262 WeakPolarHBondContact CB-O 3.32Å; P262-W305 WeakPolarHBondContact CD-O 3.48Å
263	P	73.5	Confident	73.4	Confident	81 Å²	81	44.1 Å²	44.1	53%	0.526	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-53.1	152.1	170.9	23	-32.4	0	0	0	112.8	H256	H256-P263 WeakPolarHBondContact CD2-CA 3.35Å; H256-P263 VanDerWaalsContact CG-CA 3.42Å; H256-P263 WeakPolarHBondContact NE2-CA 3.45Å; H256-P263 WeakPolarHBondContact NE2-CB 3.47Å
264	P	83.3	Confident	74.9	Confident	11 Å²	11	42.5 Å²	42.5	7%	0.071	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-53.7	158.7	167.1	34.9	-45.6	0	0	0	109.6	N237 T254 H256 Q266 W305	N237-P264 WeakPolarHBondContact ND2-CG 3.49Å; T254-P264 HydrophobicContact CG2-CB 3.89Å; T254-P264 HydrophobicContact CG2-CG 3.28Å; H256-P264 VanDerWaalsContact CE1-CD 3.49Å; H256-P264 WeakPolarHBondContact CE1-CD 3.33Å; H256-P264 WeakPolarHBondContact ND1-CD 3.24Å; P264-Q266 PolarHBondContact O-N 3.26Å; P264-W305 HydrophobicContact CB-CD2 4.45Å; P264-W305 HydrophobicContact CB-CG 4.35Å
265	P	89	Confident	76.8	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-50.3	142.8	167.8	-10.2	13.3	0	0	0	110.7	F227 R268 V282 H296 W305	F227-P265 HydrophobicContact CE1-CB 3.94Å; F227-P265 HydrophobicContact CE1-CG 3.79Å; F227-P265 HydrophobicContact CZ-CB 3.79Å; F227-P265 HydrophobicContact CZ-CG 3.6Å; P265-R268 VanDerWaalsContact CB-NH2 3.33Å; P265-V282 HydrophobicContact CG-CG1 4.39Å; P265-H296 HydrophobicContact CG-CB 3.7Å; P265-W305 VanDerWaalsContact CD-CE3 3.41Å; P265-W305 HydrophobicContact CG-CD2 4.48Å; P265-W305 HydrophobicContact CG-CE3 3.91Å; P265-W305 HydrophobicContact CG-CH2 3.83Å; P265-W305 HydrophobicContact CG-CZ2 4.41Å; P265-W305 HydrophobicContact CG-CZ3 3.55Å
266	Q	87.6	Confident	78.6	Confident	102 Å²	102	41.9 Å²	41.9	48%	0.477	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-53.6	151.8	170.3	-64.9	149.5	-7.7	0	0	110.4	P264 R268 A287	P264-Q266 PolarHBondContact O-N 3.26Å; Q266-R268 WeakPolarHBondContact O-CG 3.4Å; Q266-R268 PolarHBondContact O-N 3.22Å; Q266-R268 PolarHBondContact O-NE 2.96Å; Q266-A287 HydrophobicContact CB-CB 4.08Å
267	R	87.5	Confident	80.4	Confident	126 Å²	126	44.5 Å²	44.5	48%	0.475	24%	0.241	S	C	.	.	S	Bend	trans	-49.8	131.4	175.9	65.3	-174.3	176.9	-161.3	-3.2	110.6	I235 N237 A287 D288	I235-R267 HydrophobicContact CG2-CB 4.13Å; I235-R267 HydrophobicContact CG2-CG 4.43Å; N237-R267 HydrophobicContact CB-CB 4.21Å; R267-A287 WeakPolarHBondContact O-CA 3.44Å; R267-A287 WeakPolarHBondContact O-CB 3.4Å; R267-D288 IonicContact CZ-OD1 2.87Å; R267-D288 VanDerWaalsContact CZ-OD1 3.23Å; R267-D288 IonicContact NE-OD1 3.13Å; R267-D288 PolarHBondContact NE-OD1 3.27Å; R267-D288 IonicContact NH2-OD1 3.43Å; R267-D288 PolarHBondContact NH2-OD1 3.25Å
268	R	90.9	Very high	82.6	Confident	3 Å²	3	40.9 Å²	40.9	1%	0.011	22%	0.221	C	C	.	.			trans	-155.3	154.6	-172.5	56.7	-177.1	71.6	-167.6	7.5	113	F227 S228 G229 P265 Q266 H271 G284 A286 A287 H296	F227-R268 HydrophobicContact CE1-CG 4.25Å; S228-R268 WeakPolarHBondContact CB-O 3.21Å; S228-R268 PolarHBondContact OG-N 2.94Å; S228-R268 PolarHBondContact OG-O 2.9Å; S228-R268 VanDerWaalsContact OG-O 3.1Å; G229-R268 WeakPolarHBondContact CA-O 3.39Å; G229-R268 PolarHBondContact N-O 2.96Å; P265-R268 VanDerWaalsContact CB-NH2 3.33Å; Q266-R268 WeakPolarHBondContact O-CG 3.4Å; Q266-R268 PolarHBondContact O-N 3.22Å; Q266-R268 PolarHBondContact O-NE 2.96Å; R268-H271 HydrophobicContact CG-CB 4.23Å; R268-H271 PolarHBondContact O-CE1 3.22Å; R268-H271 PolarHBondContact O-ND1 2.99Å; R268-G284 WeakPolarHBondContact CD-O 3.32Å; R268-G284 PolarHBondContact NH1-O 3.08Å; R268-A286 WeakPolarHBondContact CA-O 3.42Å; R268-A286 WeakPolarHBondContact CB-O 3.29Å; R268-A287 HydrophobicContact CB-CB 4.23Å; R268-H296 PolarHBondContact NH2-NE2 3.33Å
269	Y	93.4	Very high	84.8	Confident	83 Å²	83	40.8 Å²	40.8	33%	0.325	22%	0.22	S	C	.	.	B	Isolated β-bridge	trans	-133.2	158.5	172.9	67.5	-86.7	0	0	0	110.4	N214 H271 G285 A286 L321 F322	N214-Y269 HydrophobicContact CB-CD2 4.37Å; N214-Y269 WeakPolarHBondContact O-CA 3.45Å; Y269-H271 PolarHBondContact O-N 3.39Å; Y269-G285 VanDerWaalsContact O-CA 3.27Å; Y269-G285 WeakPolarHBondContact O-CA 3.45Å; Y269-A286 HydrophobicContact CE1-CB 3.94Å; Y269-A286 HydrophobicContact CE2-CB 4.44Å; Y269-A286 PolarHBondContact N-O 2.96Å; Y269-A286 PolarHBondContact O-N 3.26Å; Y269-L321 HydrophobicContact CD2-CD1 4.4Å; Y269-L321 HydrophobicContact CE2-CD1 3.81Å; Y269-F322 HydrophobicContact CD2-CE1 4.21Å; Y269-F322 AromaticContact CD2-CZ 3.8Å; Y269-F322 HydrophobicContact CD2-CZ 3.8Å; Y269-F322 HydrophobicContact CE2-CE2 4.32Å; Y269-F322 AromaticContact CE2-CZ 3.85Å; Y269-F322 HydrophobicContact CE2-CZ 3.85Å
270	G	93.9	Very high	87	Confident	6 Å²	6	36.9 Å²	36.9	6%	0.062	21%	0.206	C	C	.	.	S	Bend	trans	64.6	20.5	-175.7	0	0	0	0	0	113.8	N214 L321 F322	N214-G270 PolarHBondContact O-N 2.89Å; G270-L321 CarbonylContact O-C 3.55Å; G270-L321 WeakPolarHBondContact O-CA 3.31Å; G270-F322 VanDerWaalsContact CA-CD1 3.48Å; G270-F322 PolarHBondContact O-N 3.26Å
271	H	96.4	Very high	89.2	Confident	8 Å²	8	34 Å²	34	4%	0.037	18%	0.176	C	C	.	.			trans	-84.8	164.7	170.5	60.7	-78	0	0	0	109.8	P216 F227 R268 Y269 F283 G284	P216-H271 VanDerWaalsContact CD-CE1 3.42Å; P216-H271 WeakPolarHBondContact CD-CE1 3.29Å; P216-H271 WeakPolarHBondContact CD-NE2 3.18Å; P216-H271 VanDerWaalsContact CG-CD2 3.48Å; P216-H271 WeakPolarHBondContact CG-CD2 3.36Å; P216-H271 WeakPolarHBondContact CG-NE2 3.41Å; F227-H271 AromaticContact CD1-NE2 3.5Å; F227-H271 PolarHBondContact O-CE1 3.46Å; F227-H271 VanDerWaalsContact O-CE1 3.31Å; F227-H271 PolarHBondContact O-NE2 3.47Å; R268-H271 HydrophobicContact CG-CB 4.23Å; R268-H271 PolarHBondContact O-CE1 3.22Å; R268-H271 PolarHBondContact O-ND1 2.99Å; Y269-H271 PolarHBondContact O-N 3.39Å; H271-F283 WeakPolarHBondContact CB-O 3.47Å; H271-G284 WeakPolarHBondContact CB-O 3.49Å
272	T	97.5	Very high	90.9	Very high	11 Å²	11	33.1 Å²	33.1	7%	0.067	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	149.5	170.3	53.2	0	0	0	0	110.1	V282 F283 H323 A325	T272-V282 WeakPolarHBondContact O-CA 2.97Å; T272-F283 PolarHBondContact N-O 2.92Å; T272-F283 PolarHBondContact O-N 3.04Å; T272-F283 VanDerWaalsContact O-N 3.09Å; T272-H323 VanDerWaalsContact CG2-CD2 3.4Å; T272-H323 WeakPolarHBondContact CG2-CD2 2.99Å; T272-H323 VanDerWaalsContact CG2-NE2 3.34Å; T272-H323 WeakPolarHBondContact CG2-NE2 3.17Å; T272-H323 VanDerWaalsContact CG2-O 3.32Å; T272-H323 WeakPolarHBondContact CG2-O 3.29Å; T272-H323 PolarHBondContact OG1-NE2 2.88Å; T272-A325 HydrophobicContact CG2-CB 3.79Å
273	M	97.4	Very high	92.3	Very high	10 Å²	10	30.4 Å²	30.4	5%	0.049	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.1	169.8	-176.1	171.9	64.5	0	0	108.1	P216 A218 F225 F227 L280 Y281 V282	P216-M273 HydrophobicContact CB-CB 3.77Å; P216-M273 HydrophobicContact CG-CB 3.37Å; A218-M273 HydrophobicContact CB-CE 3.92Å; A218-M273 HydrophobicContact CB-CG 4.16Å; F225-M273 HydrophobicContact CB-CE 4.13Å; F225-M273 VanDerWaalsContact O-CE 3.22Å; F225-M273 WeakPolarHBondContact O-CE 3.4Å; F227-M273 HydrophobicContact CB-CE 4.33Å; F227-M273 HydrophobicContact CB-SD 3.93Å; M273-L280 HydrophobicContact CG-CB 4.29Å; M273-L280 HydrophobicContact SD-CB 4.26Å; M273-L280 HydrophobicContact SD-CD1 4.28Å; M273-Y281 CarbonylContact C-O 3.55Å; M273-Y281 WeakPolarHBondContact CA-O 3.26Å; M273-V282 HydrophobicContact CB-CG2 4.17Å; M273-V282 HydrophobicContact CG-CG2 3.86Å; M273-V282 HydrophobicContact SD-CG2 4.03Å
274	V	97.7	Very high	93.3	Very high	15 Å²	15	26.6 Å²	26.6	9%	0.091	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	147.4	176.8	-61.1	0	0	0	0	110.1	L280 Y281 A325 V327 M332 F353	V274-L280 WeakPolarHBondContact O-CA 3.46Å; V274-Y281 PolarHBondContact N-O 2.92Å; V274-Y281 PolarHBondContact O-N 2.96Å; V274-A325 HydrophobicContact CG1-CB 3.8Å; V274-V327 HydrophobicContact CB-CG2 3.73Å; V274-V327 HydrophobicContact CG1-CG2 4.22Å; V274-V327 HydrophobicContact CG2-CG2 3.81Å; V274-M332 HydrophobicContact CG2-CB 4.47Å; V274-M332 HydrophobicContact CG2-CG 4.14Å; V274-M332 HydrophobicContact CG2-SD 3.55Å; V274-M332 VanDerWaalsContact CG2-SD 3.55Å; V274-F353 HydrophobicContact CG2-CZ 3.91Å
275	A	96.6	Very high	93.8	Very high	31 Å²	31	26 Å²	26	26%	0.256	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136.6	173.8	0	0	0	0	0	110.1	A218 V219 C220 H279 L280	A218-A275 HydrophobicContact CB-CB 4.24Å; V219-A275 VanDerWaalsContact O-CB 3.26Å; V219-A275 WeakPolarHBondContact O-CB 3.45Å; C220-A275 HydrophobicContact CB-CB 4.09Å; A275-H279 WeakPolarHBondContact CA-O 3.26Å; A275-L280 HydrophobicContact CB-CD2 3.94Å
276	F	94.3	Very high	94	Very high	32 Å²	32	26.6 Å²	26.6	14%	0.14	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	126.6	168.1	176	-99.1	0	0	0	109.5	R278 H279 Y281 V327 Q329 D330 F353 S355	F276-R278 PolarHBondContact O-N 3.39Å; F276-R278 VanDerWaalsContact O-N 3.15Å; F276-H279 PolarHBondContact N-O 3.36Å; F276-H279 PolarHBondContact O-N 3.03Å; F276-Y281 HydrophobicContact CB-CD2 4.35Å; F276-Y281 HydrophobicContact CB-CE2 4.03Å; F276-Y281 HydrophobicContact CD1-CE2 4.46Å; F276-V327 HydrophobicContact CD2-CG1 4.24Å; F276-Q329 WeakPolarHBondContact CE2-O 3.15Å; F276-D330 HydrophobicContact CE2-CB 4.4Å; F276-D330 HydrophobicContact CZ-CB 4.17Å; F276-F353 HydrophobicContact CB-CD1 4.38Å; F276-F353 HydrophobicContact CB-CD2 3.76Å; F276-F353 HydrophobicContact CB-CE1 4.27Å; F276-F353 HydrophobicContact CB-CE2 3.6Å; F276-F353 HydrophobicContact CB-CG 4.14Å; F276-F353 HydrophobicContact CB-CZ 3.83Å; F276-F353 HydrophobicContact CD1-CB 3.48Å; F276-F353 VanDerWaalsContact CD1-CB 3.48Å; F276-F353 HydrophobicContact CD1-CD1 4.26Å; F276-F353 AromaticContact CD1-CD2 3.68Å; F276-F353 HydrophobicContact CD1-CD2 3.68Å; F276-F353 HydrophobicContact CD1-CE2 4.41Å; F276-F353 AromaticContact CD1-CG 3.58Å; F276-F353 HydrophobicContact CD1-CG 3.58Å; F276-F353 AromaticContact CD2-CD2 3.66Å; F276-F353 HydrophobicContact CD2-CD2 3.66Å; F276-F353 HydrophobicContact CD2-CE2 4.02Å; F276-F353 HydrophobicContact CD2-CG 4.4Å; F276-F353 HydrophobicContact CE1-CB 3.48Å; F276-F353 VanDerWaalsContact CE1-CB 3.48Å; F276-F353 HydrophobicContact CE1-CD2 4.18Å; F276-F353 HydrophobicContact CE1-CG 4.06Å; F276-F353 HydrophobicContact CE2-CD2 4.18Å; F276-F353 HydrophobicContact CG-CB 4.13Å; F276-F353 HydrophobicContact CG-CD1 4.44Å; F276-F353 AromaticContact CG-CD2 3.38Å; F276-F353 HydrophobicContact CG-CD2 3.38Å; F276-F353 AromaticContact CG-CE2 3.74Å; F276-F353 HydrophobicContact CG-CE2 3.74Å; F276-F353 AromaticContact CG-CG 3.77Å; F276-F353 HydrophobicContact CG-CG 3.77Å; F276-F353 HydrophobicContact CG-CZ 4.39Å; F276-F353 HydrophobicContact CZ-CB 4.14Å; F276-F353 HydrophobicContact CZ-CD2 4.4Å; F276-S355 WeakPolarHBondContact CE1-OG 3.4Å; F276-S355 VanDerWaalsContact CZ-OG 3.28Å; F276-S355 WeakPolarHBondContact CZ-OG 3.5Å
277	D	89.8	Confident	94.1	Very high	92 Å²	92	21.8 Å²	21.8	49%	0.492	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	-113.7	-170.1	178.7	39.5	0	0	0	111.8	C220	C220-D277 PolarHBondContact SG-O 3.21Å
278	R	89.3	Confident	93.8	Very high	18 Å²	18	19.9 Å²	19.9	7%	0.068	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	7.2	178.8	73.9	178.9	-178	-84.4	-5.3	113.4	F276 D299 V300 Y356	F276-R278 PolarHBondContact O-N 3.39Å; F276-R278 VanDerWaalsContact O-N 3.15Å; R278-D299 IonicContact CZ-OD2 3.85Å; R278-D299 IonicContact NE-OD1 2.71Å; R278-D299 IonicContact NE-OD2 3.62Å; R278-D299 PolarHBondContact NE-OD2 3.13Å; R278-D299 IonicContact NH2-OD2 2.66Å; R278-V300 HydrophobicContact CB-CG2 4.12Å; R278-V300 WeakPolarHBondContact O-CG1 3.46Å; R278-V300 VanDerWaalsContact O-CG2 3.24Å; R278-V300 WeakPolarHBondContact O-CG2 3.19Å; R278-V300 PolarHBondContact O-N 3.25Å; R278-Y356 PolarHBondContact NH1-O 2.95Å
279	H	93.1	Very high	93.2	Very high	8 Å²	8	28.3 Å²	28.3	4%	0.037	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142.4	-169.7	-55.6	102	0	0	0	111.4	A275 F276 Y281 C297 Y298 D299	A275-H279 WeakPolarHBondContact CA-O 3.26Å; F276-H279 PolarHBondContact N-O 3.36Å; F276-H279 PolarHBondContact O-N 3.03Å; H279-Y281 HydrophobicContact CB-CD2 4.13Å; H279-Y281 HydrophobicContact CB-CE2 3.49Å; H279-Y281 VanDerWaalsContact CB-CE2 3.49Å; H279-C297 PolarHBondContact CD2-SG 3.5Å; H279-Y298 CarbonylContact C-O 3.51Å; H279-Y298 VanDerWaalsContact CA-O 3.31Å; H279-Y298 WeakPolarHBondContact CA-O 3.47Å; H279-D299 IonicContact NE2-OD2 3.15Å
280	L	95.7	Very high	93	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	118.4	166.9	-53.2	174.2	0	0	0	108.4	A218 C220 F225 M273 V274 A275 C297 Y298 V300	A218-L280 HydrophobicContact CB-CD2 4.06Å; C220-L280 HydrophobicContact CB-CD2 3.81Å; F225-L280 HydrophobicContact CB-CD1 3.64Å; F225-L280 HydrophobicContact CD1-CD1 3.55Å; F225-L280 HydrophobicContact CD2-CD1 3.99Å; F225-L280 HydrophobicContact CD2-CD2 4.31Å; F225-L280 HydrophobicContact CE1-CD1 4.13Å; F225-L280 HydrophobicContact CG-CD1 3.45Å; F225-L280 VanDerWaalsContact CG-CD1 3.45Å; F225-L280 HydrophobicContact CG-CD2 4.5Å; M273-L280 HydrophobicContact CG-CB 4.29Å; M273-L280 HydrophobicContact SD-CB 4.26Å; M273-L280 HydrophobicContact SD-CD1 4.28Å; V274-L280 WeakPolarHBondContact O-CA 3.46Å; A275-L280 HydrophobicContact CB-CD2 3.94Å; L280-C297 CarbonylContact O-C 3.59Å; L280-C297 WeakPolarHBondContact O-CA 3.29Å; L280-Y298 HydrophobicContact CD1-CD1 3.93Å; L280-Y298 HydrophobicContact CG-CD1 4.41Å; L280-Y298 PolarHBondContact N-O 2.86Å; L280-Y298 PolarHBondContact O-N 3.5Å; L280-V300 HydrophobicContact CD1-CG1 4.32Å; L280-V300 HydrophobicContact CG-CG1 4.14Å
281	Y	96.8	Very high	92.9	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	122.4	179.7	-68.9	-87.9	0	0	0	110.1	M273 V274 F276 H279 L295 H296 C297 I308 F351 F353	M273-Y281 CarbonylContact C-O 3.55Å; M273-Y281 WeakPolarHBondContact CA-O 3.26Å; V274-Y281 PolarHBondContact N-O 2.92Å; V274-Y281 PolarHBondContact O-N 2.96Å; F276-Y281 HydrophobicContact CB-CD2 4.35Å; F276-Y281 HydrophobicContact CB-CE2 4.03Å; F276-Y281 HydrophobicContact CD1-CE2 4.46Å; H279-Y281 HydrophobicContact CB-CD2 4.13Å; H279-Y281 HydrophobicContact CB-CE2 3.49Å; H279-Y281 VanDerWaalsContact CB-CE2 3.49Å; Y281-L295 HydrophobicContact CD1-CD1 4.35Å; Y281-L295 HydrophobicContact CD1-CD2 4.15Å; Y281-L295 HydrophobicContact CD1-CG 4.29Å; Y281-H296 CarbonylContact C-O 3.55Å; Y281-H296 WeakPolarHBondContact CA-O 3.42Å; Y281-C297 HydrophobicContact CD1-CB 3.95Å; Y281-C297 HydrophobicContact CE1-CB 3.84Å; Y281-I308 HydrophobicContact CE1-CD1 4.41Å; Y281-I308 HydrophobicContact CE1-CG1 4.25Å; Y281-F351 HydrophobicContact CE1-CE1 4.36Å; Y281-F353 HydrophobicContact CD1-CD1 4.28Å; Y281-F353 AromaticContact CD1-CE1 3.98Å; Y281-F353 HydrophobicContact CD1-CE1 3.98Å; Y281-F353 AromaticContact CD2-CD1 3.79Å; Y281-F353 HydrophobicContact CD2-CD1 3.79Å; Y281-F353 AromaticContact CD2-CE1 3.23Å; Y281-F353 HydrophobicContact CD2-CE1 3.23Å; Y281-F353 AromaticContact CD2-CZ 3.94Å; Y281-F353 HydrophobicContact CD2-CZ 3.94Å; Y281-F353 AromaticContact CE1-CD1 3.97Å; Y281-F353 HydrophobicContact CE1-CD1 3.97Å; Y281-F353 HydrophobicContact CE1-CE1 4.14Å; Y281-F353 AromaticContact CE2-CD1 3.41Å; Y281-F353 HydrophobicContact CE2-CD1 3.41Å; Y281-F353 VanDerWaalsContact CE2-CD1 3.41Å; Y281-F353 AromaticContact CE2-CE1 3.4Å; Y281-F353 HydrophobicContact CE2-CE1 3.4Å; Y281-F353 HydrophobicContact CE2-CG 4.33Å; Y281-F353 HydrophobicContact CE2-CZ 4.26Å; Y281-F353 HydrophobicContact CG-CD1 4.19Å; Y281-F353 AromaticContact CG-CE1 3.53Å; Y281-F353 HydrophobicContact CG-CE1 3.53Å; Y281-F353 HydrophobicContact CG-CZ 4.43Å; Y281-F353 AromaticContact CZ-CD1 3.52Å; Y281-F353 AromaticContact CZ-CE1 3.87Å
282	V	96.9	Very high	92.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.6	-179.5	175	0	0	0	0	110	F227 P265 T272 M273 H296 W305	F227-V282 HydrophobicContact CD1-CG1 4.2Å; F227-V282 HydrophobicContact CD1-CG2 4.15Å; F227-V282 HydrophobicContact CE1-CG1 4.13Å; P265-V282 HydrophobicContact CG-CG1 4.39Å; T272-V282 WeakPolarHBondContact O-CA 2.97Å; M273-V282 HydrophobicContact CB-CG2 4.17Å; M273-V282 HydrophobicContact CG-CG2 3.86Å; M273-V282 HydrophobicContact SD-CG2 4.03Å; V282-H296 HydrophobicContact CB-CB 4.41Å; V282-H296 PolarHBondContact N-O 3.44Å; V282-H296 PolarHBondContact O-N 3.33Å; V282-W305 HydrophobicContact CB-CZ3 4.4Å; V282-W305 HydrophobicContact CG2-CH2 3.9Å; V282-W305 HydrophobicContact CG2-CZ3 4.02Å
283	F	97.3	Very high	92.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.1	-178.6	-174.6	-101.1	0	0	0	112.6	W38 H271 T272 N293 L295 P317 R320 H323 I334	W38-F283 HydrophobicContact CH2-CD1 4.48Å; W38-F283 HydrophobicContact CH2-CD2 4.09Å; W38-F283 HydrophobicContact CH2-CE2 4.14Å; W38-F283 HydrophobicContact CH2-CG 4.27Å; W38-F283 HydrophobicContact CH2-CZ 4.41Å; W38-F283 AromaticContact CZ2-CD2 3.83Å; W38-F283 HydrophobicContact CZ2-CD2 3.83Å; W38-F283 AromaticContact CZ2-CE2 3.87Å; W38-F283 HydrophobicContact CZ2-CE2 3.87Å; W38-F283 HydrophobicContact CZ2-CG 4.42Å; H271-F283 WeakPolarHBondContact CB-O 3.47Å; T272-F283 PolarHBondContact N-O 2.92Å; T272-F283 PolarHBondContact O-N 3.04Å; T272-F283 VanDerWaalsContact O-N 3.09Å; F283-N293 VanDerWaalsContact CE2-O 3.27Å; F283-N293 WeakPolarHBondContact CE2-O 3.46Å; F283-L295 HydrophobicContact CB-CD1 3.87Å; F283-L295 HydrophobicContact CD2-CB 4.27Å; F283-L295 HydrophobicContact CD2-CD1 4.17Å; F283-L295 HydrophobicContact CG-CD1 4.46Å; F283-P317 HydrophobicContact CE1-CB 4.28Å; F283-P317 HydrophobicContact CE1-CG 4.36Å; F283-P317 HydrophobicContact CE2-CG 4.45Å; F283-P317 HydrophobicContact CZ-CB 3.83Å; F283-P317 HydrophobicContact CZ-CG 3.79Å; F283-R320 HydrophobicContact CE1-CG 4.13Å; F283-H323 AromaticContact CD1-NE2 3.52Å; F283-H323 PolarHBondContact O-CE1 3.32Å; F283-H323 VanDerWaalsContact O-CE1 3.32Å; F283-H323 PolarHBondContact O-NE2 3.4Å; F283-I334 HydrophobicContact CD1-CD1 3.9Å; F283-I334 HydrophobicContact CE1-CD1 3.46Å; F283-I334 VanDerWaalsContact CE1-CD1 3.46Å; F283-I334 HydrophobicContact CZ-CD1 4.15Å
284	G	95.3	Very high	92.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.2	C	C	.	.			trans	66.4	-148.5	171.9	0	0	0	0	0	114.6	R268 H271 P292	R268-G284 WeakPolarHBondContact CD-O 3.32Å; R268-G284 PolarHBondContact NH1-O 3.08Å; H271-G284 WeakPolarHBondContact CB-O 3.49Å; G284-P292 WeakPolarHBondContact CA-O 3.1Å
285	G	94.4	Very high	92.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.197	C	C	.	.			trans	94.9	-174.7	-172.6	0	0	0	0	0	112.8	Y269 P292 R320	Y269-G285 VanDerWaalsContact O-CA 3.27Å; Y269-G285 WeakPolarHBondContact O-CA 3.45Å; G285-P292 WeakPolarHBondContact O-CD 3.35Å; G285-R320 PolarHBondContact N-O 3.27Å
286	A	92.1	Very high	92.1	Very high	13 Å²	13	35 Å²	35	11%	0.107	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-111.8	125.4	168.8	0	0	0	0	0	109.8	R268 Y269 T290 L291 L321	R268-A286 WeakPolarHBondContact CA-O 3.42Å; R268-A286 WeakPolarHBondContact CB-O 3.29Å; Y269-A286 HydrophobicContact CE1-CB 3.94Å; Y269-A286 HydrophobicContact CE2-CB 4.44Å; Y269-A286 PolarHBondContact N-O 2.96Å; Y269-A286 PolarHBondContact O-N 3.26Å; A286-T290 WeakPolarHBondContact CA-O 3.23Å; A286-L291 HydrophobicContact CB-CD2 4.13Å; A286-L321 HydrophobicContact CB-CB 4.5Å; A286-L321 HydrophobicContact CB-CD1 4.07Å
287	A	89.2	Confident	92	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.008	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-129.7	120.7	179.5	0	0	0	0	0	109.7	Q266 R267 R268 N289 T290 P292	Q266-A287 HydrophobicContact CB-CB 4.08Å; R267-A287 WeakPolarHBondContact O-CA 3.44Å; R267-A287 WeakPolarHBondContact O-CB 3.4Å; R268-A287 HydrophobicContact CB-CB 4.23Å; A287-N289 VanDerWaalsContact C-N 3.31Å; A287-N289 PolarHBondContact O-N 3.46Å; A287-T290 PolarHBondContact N-O 2.99Å; A287-T290 WeakPolarHBondContact O-CA 3.17Å; A287-T290 WeakPolarHBondContact O-CB 3.47Å; A287-T290 PolarHBondContact O-N 2.91Å; A287-T290 PolarHBondContact O-OG1 3.03Å; A287-P292 HydrophobicContact CB-CG 4.09Å
288	D	80.9	Confident	92.1	Very high	86 Å²	86	29.3 Å²	29.3	46%	0.46	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	49.2	176.8	-61.9	-34	0	0	0	114.3	R267 T290	R267-D288 IonicContact CZ-OD1 2.87Å; R267-D288 VanDerWaalsContact CZ-OD1 3.23Å; R267-D288 IonicContact NE-OD1 3.13Å; R267-D288 PolarHBondContact NE-OD1 3.27Å; R267-D288 IonicContact NH2-OD1 3.43Å; R267-D288 PolarHBondContact NH2-OD1 3.25Å; D288-T290 PolarHBondContact O-N 3.38Å
289	N	80.3	Confident	92.1	Very high	179 Å²	179	29.2 Å²	29.2	96%	0.957	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.4	10.5	-176.5	-56.3	-33.7	0	0	0	116.1	A287	A287-N289 VanDerWaalsContact C-N 3.31Å; A287-N289 PolarHBondContact O-N 3.46Å
290	T	89	Confident	91.8	Very high	76 Å²	76	29.8 Å²	29.8	47%	0.466	16%	0.162	S	C	.	.	B	Isolated β-bridge	trans	-109.8	159.5	173.6	71.4	0	0	0	0	111.3	A286 A287 D288 P292	A286-T290 WeakPolarHBondContact CA-O 3.23Å; A287-T290 PolarHBondContact N-O 2.99Å; A287-T290 WeakPolarHBondContact O-CA 3.17Å; A287-T290 WeakPolarHBondContact O-CB 3.47Å; A287-T290 PolarHBondContact O-N 2.91Å; A287-T290 PolarHBondContact O-OG1 3.03Å; D288-T290 PolarHBondContact O-N 3.38Å; T290-P292 VanDerWaalsContact O-CD 3.27Å; T290-P292 WeakPolarHBondContact O-CD 3.27Å
291	L	91.4	Very high	91	Very high	40 Å²	40	31.9 Å²	31.9	21%	0.209	17%	0.173	C	C	.	.			trans	-106.3	90.4	171.3	-60.7	-177.2	0	0	0	109	A286 G319 L321	A286-L291 HydrophobicContact CB-CD2 4.13Å; L291-G319 WeakPolarHBondContact O-CA 3.11Å; L291-L321 HydrophobicContact CD2-CB 4.5Å; L291-L321 HydrophobicContact CD2-CD2 3.48Å; L291-L321 VanDerWaalsContact CD2-CD2 3.48Å
292	P	91.6	Very high	90	Very high	13 Å²	13	33.1 Å²	33.1	8%	0.084	18%	0.181	C	C	.	.			trans	-60.6	145.3	176.4	24.1	-35.2	0	0	0	111.3	G284 G285 A287 T290	G284-P292 WeakPolarHBondContact CA-O 3.1Å; G285-P292 WeakPolarHBondContact O-CD 3.35Å; A287-P292 HydrophobicContact CB-CG 4.09Å; T290-P292 VanDerWaalsContact O-CD 3.27Å; T290-P292 WeakPolarHBondContact O-CD 3.27Å
293	N	93.3	Very high	89.1	Confident	69 Å²	69	36.3 Å²	36.3	37%	0.369	20%	0.197	S	C	.	.			trans	-121.4	12.7	172	68.5	-24.8	0	0	0	112.4	F283	F283-N293 VanDerWaalsContact CE2-O 3.27Å; F283-N293 WeakPolarHBondContact CE2-O 3.46Å
294	E	93.8	Very high	88.2	Confident	97 Å²	97	37.8 Å²	37.8	45%	0.453	21%	0.206	S	C	.	.			trans	-73.9	140.7	173.9	-65.4	171.1	-166.3	0	0	110.3	H296	E294-H296 IonicContact OE2-CE1 3.76Å; E294-H296 PolarHBondContact OE2-CE1 3.37Å; E294-H296 IonicContact OE2-NE2 3.06Å
295	L	95.4	Very high	87.8	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.3	170.7	-178	66.1	0	0	0	108.6	W38 Y281 F283 I308 M332 F351	W38-L295 HydrophobicContact CZ2-CD1 4.42Å; W38-L295 HydrophobicContact CZ2-CD2 4.14Å; Y281-L295 HydrophobicContact CD1-CD1 4.35Å; Y281-L295 HydrophobicContact CD1-CD2 4.15Å; Y281-L295 HydrophobicContact CD1-CG 4.29Å; F283-L295 HydrophobicContact CB-CD1 3.87Å; F283-L295 HydrophobicContact CD2-CB 4.27Å; F283-L295 HydrophobicContact CD2-CD1 4.17Å; F283-L295 HydrophobicContact CG-CD1 4.46Å; L295-I308 HydrophobicContact CB-CB 4.32Å; L295-I308 HydrophobicContact CD2-CB 4.13Å; L295-I308 HydrophobicContact CD2-CG1 4.23Å; L295-I308 HydrophobicContact CD2-CG2 4.3Å; L295-I308 HydrophobicContact CG-CB 4.28Å; L295-I308 HydrophobicContact CG-CG1 4.29Å; L295-I308 PolarHBondContact O-N 3.3Å; L295-M332 HydrophobicContact CD1-CE 3.97Å; L295-F351 HydrophobicContact CD2-CD1 3.85Å; L295-F351 HydrophobicContact CD2-CD2 4.01Å; L295-F351 HydrophobicContact CD2-CE1 3.37Å; L295-F351 HydrophobicContact CD2-CE2 3.53Å; L295-F351 HydrophobicContact CD2-CG 4.14Å; L295-F351 HydrophobicContact CD2-CZ 3.2Å
296	H	94.4	Very high	87.4	Confident	8 Å²	8	42.3 Å²	42.3	4%	0.037	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	145.7	174.1	-56.6	-94.5	0	0	0	109.8	P265 R268 Y281 V282 E294 W305 E306	P265-H296 HydrophobicContact CG-CB 3.7Å; R268-H296 PolarHBondContact NH2-NE2 3.33Å; Y281-H296 CarbonylContact C-O 3.55Å; Y281-H296 WeakPolarHBondContact CA-O 3.42Å; V282-H296 HydrophobicContact CB-CB 4.41Å; V282-H296 PolarHBondContact N-O 3.44Å; V282-H296 PolarHBondContact O-N 3.33Å; E294-H296 IonicContact OE2-CE1 3.76Å; E294-H296 PolarHBondContact OE2-CE1 3.37Å; E294-H296 IonicContact OE2-NE2 3.06Å; H296-W305 HydrophobicContact CB-CE3 3.97Å; H296-W305 HydrophobicContact CB-CZ3 3.93Å; H296-E306 CarbonylContact C-O 3.6Å; H296-E306 WeakPolarHBondContact CA-O 2.85Å
297	C	93.3	Very high	87.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.4	176.7	169.3	0	0	0	0	108.6	H279 L280 Y281 W305 E306 I308	H279-C297 PolarHBondContact CD2-SG 3.5Å; L280-C297 CarbonylContact O-C 3.59Å; L280-C297 WeakPolarHBondContact O-CA 3.29Å; Y281-C297 HydrophobicContact CD1-CB 3.95Å; Y281-C297 HydrophobicContact CE1-CB 3.84Å; C297-W305 CarbonylContact O-C 3.58Å; C297-W305 WeakPolarHBondContact O-CA 3.46Å; C297-E306 HydrophobicContact CB-CG 3.6Å; C297-E306 PolarHBondContact N-O 3Å; C297-E306 PolarHBondContact O-N 2.96Å; C297-E306 PolarHBondContact SG-OE1 3.41Å; C297-I308 HydrophobicContact CB-CD1 3.69Å; C297-I308 HydrophobicContact CB-CG1 3.73Å
298	Y	91.6	Very high	87.5	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	115.6	172.1	178.7	-98.6	0	0	0	109.2	F225 L239 I252 H279 L280 V300 Q303 T304 W305	F225-Y298 HydrophobicContact CE1-CE1 4.5Å; L239-Y298 HydrophobicContact CD2-CD1 3.62Å; L239-Y298 HydrophobicContact CD2-CD2 3.97Å; L239-Y298 HydrophobicContact CD2-CE1 3.49Å; L239-Y298 VanDerWaalsContact CD2-CE1 3.49Å; L239-Y298 HydrophobicContact CD2-CE2 3.85Å; L239-Y298 HydrophobicContact CD2-CG 3.85Å; I252-Y298 HydrophobicContact CD1-CE1 4.2Å; I252-Y298 HydrophobicContact CG2-CE2 4.38Å; I252-Y298 WeakPolarHBondContact CG2-OH 3.4Å; H279-Y298 CarbonylContact C-O 3.51Å; H279-Y298 VanDerWaalsContact CA-O 3.31Å; H279-Y298 WeakPolarHBondContact CA-O 3.47Å; L280-Y298 HydrophobicContact CD1-CD1 3.93Å; L280-Y298 HydrophobicContact CG-CD1 4.41Å; L280-Y298 PolarHBondContact N-O 2.86Å; L280-Y298 PolarHBondContact O-N 3.5Å; Y298-V300 HydrophobicContact CD1-CG1 4.12Å; Y298-V300 HydrophobicContact CE1-CB 4.47Å; Y298-V300 HydrophobicContact CE1-CG1 4.15Å; Y298-Q303 HydrophobicContact CE2-CB 4.48Å; Y298-Q303 WeakPolarHBondContact CE2-O 3.4Å; Y298-Q303 WeakPolarHBondContact OH-CA 3.46Å; Y298-Q303 WeakPolarHBondContact OH-CB 3.34Å; Y298-Q303 VanDerWaalsContact OH-CG 3.31Å; Y298-Q303 WeakPolarHBondContact OH-CG 3.39Å; Y298-T304 WeakPolarHBondContact CA-O 3.31Å; Y298-W305 AromaticContact CD2-CD1 3.73Å; Y298-W305 AromaticContact CD2-CD2 3.8Å; Y298-W305 HydrophobicContact CD2-CD2 3.8Å; Y298-W305 AromaticContact CD2-CE2 3.55Å; Y298-W305 AromaticContact CD2-CG 3.94Å; Y298-W305 HydrophobicContact CD2-CG 3.94Å; Y298-W305 HydrophobicContact CD2-CZ2 4.09Å; Y298-W305 AromaticContact CD2-NE1 3.47Å; Y298-W305 AromaticContact CE2-NE1 3.93Å; Y298-W305 HydrophobicContact CG-CD2 4.32Å; Y298-W305 HydrophobicContact CG-CZ2 4.23Å
299	D	87.7	Confident	87.9	Confident	16 Å²	16	47.4 Å²	47.4	9%	0.086	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	117.4	173.7	-178.8	-36.7	0	0	0	108.7	R278 H279 D301 S302 Q303 T304	R278-D299 IonicContact CZ-OD2 3.85Å; R278-D299 IonicContact NE-OD1 2.71Å; R278-D299 IonicContact NE-OD2 3.62Å; R278-D299 PolarHBondContact NE-OD2 3.13Å; R278-D299 IonicContact NH2-OD2 2.66Å; H279-D299 IonicContact NE2-OD2 3.15Å; D299-D301 PolarHBondContact O-N 3.39Å; D299-D301 WeakPolarHBondContact OD1-CA 3.32Å; D299-D301 VanDerWaalsContact OD1-CB 3.25Å; D299-D301 WeakPolarHBondContact OD1-CB 3.47Å; D299-D301 PolarHBondContact OD1-N 3.42Å; D299-S302 VanDerWaalsContact CB-OG 3.27Å; D299-S302 WeakPolarHBondContact CB-OG 3.12Å; D299-S302 VanDerWaalsContact CG-OG 3.24Å; D299-S302 PolarHBondContact OD1-N 2.84Å; D299-S302 VanDerWaalsContact OD1-N 3.13Å; D299-Q303 WeakPolarHBondContact O-CA 3.42Å; D299-Q303 PolarHBondContact O-N 3.28Å; D299-T304 PolarHBondContact N-O 2.78Å; D299-T304 PolarHBondContact O-N 2.98Å
300	V	87.2	Confident	88.3	Confident	21 Å²	21	41 Å²	41	13%	0.127	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-18.1	-176.3	-56.3	0	0	0	0	113.5	C220 F225 R278 L280 Y298	C220-V300 HydrophobicContact CB-CG1 4.48Å; F225-V300 HydrophobicContact CE1-CG1 4.18Å; F225-V300 HydrophobicContact CE2-CG1 4.28Å; F225-V300 HydrophobicContact CZ-CB 4.33Å; F225-V300 HydrophobicContact CZ-CG1 3.77Å; R278-V300 HydrophobicContact CB-CG2 4.12Å; R278-V300 WeakPolarHBondContact O-CG1 3.46Å; R278-V300 VanDerWaalsContact O-CG2 3.24Å; R278-V300 WeakPolarHBondContact O-CG2 3.19Å; R278-V300 PolarHBondContact O-N 3.25Å; L280-V300 HydrophobicContact CD1-CG1 4.32Å; L280-V300 HydrophobicContact CG-CG1 4.14Å; Y298-V300 HydrophobicContact CD1-CG1 4.12Å; Y298-V300 HydrophobicContact CE1-CB 4.47Å; Y298-V300 HydrophobicContact CE1-CG1 4.15Å
301	D	80.2	Confident	88.2	Confident	44 Å²	44	38.5 Å²	38.5	24%	0.235	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-51.5	-179.2	-81.4	-28.3	0	0	0	113.1	R221 D299 K358	R221-D301 IonicContact CZ-OD1 3.97Å; R221-D301 IonicContact CZ-OD2 3.06Å; R221-D301 VanDerWaalsContact CZ-OD2 3.27Å; R221-D301 IonicContact NH1-OD1 3.82Å; R221-D301 PolarHBondContact NH1-OD1 3.48Å; R221-D301 IonicContact NH1-OD2 3.51Å; R221-D301 PolarHBondContact NH1-OD2 3.32Å; R221-D301 VanDerWaalsContact NH1-OD2 3.13Å; R221-D301 IonicContact NH2-OD1 3.56Å; R221-D301 IonicContact NH2-OD2 3.79Å; R221-D301 PolarHBondContact NH2-OD2 3.47Å; D299-D301 PolarHBondContact O-N 3.39Å; D299-D301 WeakPolarHBondContact OD1-CA 3.32Å; D299-D301 VanDerWaalsContact OD1-CB 3.25Å; D299-D301 WeakPolarHBondContact OD1-CB 3.47Å; D299-D301 PolarHBondContact OD1-N 3.42Å; D301-K358 HydrophobicContact CB-CD 4.07Å; D301-K358 IonicContact OD2-NZ 2.76Å
302	S	74	Confident	87.9	Confident	26 Å²	26	46.6 Å²	46.6	18%	0.182	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.8	173.5	58.1	0	0	0	0	111.1	R259 D299 T304	R259-S302 WeakPolarHBondContact CD-O 3.36Å; R259-S302 PolarHBondContact NE-O 2.9Å; R259-S302 PolarHBondContact NH1-O 2.8Å; D299-S302 VanDerWaalsContact CB-OG 3.27Å; D299-S302 WeakPolarHBondContact CB-OG 3.12Å; D299-S302 VanDerWaalsContact CG-OG 3.24Å; D299-S302 PolarHBondContact OD1-N 2.84Å; D299-S302 VanDerWaalsContact OD1-N 3.13Å; S302-T304 PolarHBondContact O-N 3.32Å; S302-T304 PolarHBondContact OG-OG1 3.2Å
303	Q	79.5	Confident	87.6	Confident	68 Å²	68	49.4 Å²	49.4	32%	0.318	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	34.3	-175.1	-68.9	179	-16.6	0	0	112	R259 Y298 D299	R259-Q303 PolarHBondContact NH1-O 3.14Å; Y298-Q303 HydrophobicContact CE2-CB 4.48Å; Y298-Q303 WeakPolarHBondContact CE2-O 3.4Å; Y298-Q303 WeakPolarHBondContact OH-CA 3.46Å; Y298-Q303 WeakPolarHBondContact OH-CB 3.34Å; Y298-Q303 VanDerWaalsContact OH-CG 3.31Å; Y298-Q303 WeakPolarHBondContact OH-CG 3.39Å; D299-Q303 WeakPolarHBondContact O-CA 3.42Å; D299-Q303 PolarHBondContact O-N 3.28Å
304	T	78.6	Confident	87.6	Confident	31 Å²	31	47.3 Å²	47.3	19%	0.19	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146	-176.4	50.7	0	0	0	0	111.6	R259 Y298 D299 S302	R259-T304 HydrophobicContact CB-CG2 3.8Å; R259-T304 HydrophobicContact CG-CG2 4.18Å; Y298-T304 WeakPolarHBondContact CA-O 3.31Å; D299-T304 PolarHBondContact N-O 2.78Å; D299-T304 PolarHBondContact O-N 2.98Å; S302-T304 PolarHBondContact O-N 3.32Å; S302-T304 PolarHBondContact OG-OG1 3.2Å
305	W	86.1	Confident	87.7	Confident	13 Å²	13	47.6 Å²	47.6	5%	0.049	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	147.4	167.2	-72.4	96	0	0	0	110.8	F227 L239 P262 P264 P265 V282 H296 C297 Y298	F227-W305 HydrophobicContact CD2-CH2 4.26Å; F227-W305 AromaticContact CD2-CZ2 3.99Å; F227-W305 HydrophobicContact CD2-CZ2 3.99Å; F227-W305 HydrophobicContact CE2-CH2 4.18Å; F227-W305 AromaticContact CE2-CZ2 3.82Å; F227-W305 HydrophobicContact CE2-CZ2 3.82Å; F227-W305 HydrophobicContact CG-CH2 4.48Å; F227-W305 HydrophobicContact CZ-CH2 4.33Å; F227-W305 HydrophobicContact CZ-CZ2 4.34Å; L239-W305 HydrophobicContact CD2-CZ2 4.15Å; P262-W305 WeakPolarHBondContact CD-O 3.48Å; P264-W305 HydrophobicContact CB-CD2 4.45Å; P264-W305 HydrophobicContact CB-CG 4.35Å; P265-W305 VanDerWaalsContact CD-CE3 3.41Å; P265-W305 HydrophobicContact CG-CD2 4.48Å; P265-W305 HydrophobicContact CG-CE3 3.91Å; P265-W305 HydrophobicContact CG-CH2 3.83Å; P265-W305 HydrophobicContact CG-CZ2 4.41Å; P265-W305 HydrophobicContact CG-CZ3 3.55Å; V282-W305 HydrophobicContact CB-CZ3 4.4Å; V282-W305 HydrophobicContact CG2-CH2 3.9Å; V282-W305 HydrophobicContact CG2-CZ3 4.02Å; H296-W305 HydrophobicContact CB-CE3 3.97Å; H296-W305 HydrophobicContact CB-CZ3 3.93Å; C297-W305 CarbonylContact O-C 3.58Å; C297-W305 WeakPolarHBondContact O-CA 3.46Å; Y298-W305 AromaticContact CD2-CD1 3.73Å; Y298-W305 AromaticContact CD2-CD2 3.8Å; Y298-W305 HydrophobicContact CD2-CD2 3.8Å; Y298-W305 AromaticContact CD2-CE2 3.55Å; Y298-W305 AromaticContact CD2-CG 3.94Å; Y298-W305 HydrophobicContact CD2-CG 3.94Å; Y298-W305 HydrophobicContact CD2-CZ2 4.09Å; Y298-W305 AromaticContact CD2-NE1 3.47Å; Y298-W305 AromaticContact CE2-NE1 3.93Å; Y298-W305 HydrophobicContact CG-CD2 4.32Å; Y298-W305 HydrophobicContact CG-CZ2 4.23Å
306	E	86.6	Confident	87.6	Confident	81 Å²	81	50.8 Å²	50.8	38%	0.379	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150.8	167.2	66.5	-175.7	178.2	0	0	109.7	H296 C297 I308	H296-E306 CarbonylContact C-O 3.6Å; H296-E306 WeakPolarHBondContact CA-O 2.85Å; C297-E306 HydrophobicContact CB-CG 3.6Å; C297-E306 PolarHBondContact N-O 3Å; C297-E306 PolarHBondContact O-N 2.96Å; C297-E306 PolarHBondContact SG-OE1 3.41Å; E306-I308 HydrophobicContact CG-CD1 3.96Å; E306-I308 VanDerWaalsContact OE1-CD1 3.28Å; E306-I308 WeakPolarHBondContact OE1-CD1 3.5Å
307	V	91.3	Very high	87.7	Confident	44 Å²	44	50.4 Å²	50.4	27%	0.267	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	119.9	166.9	-177.9	0	0	0	0	106.5	H309	V307-H309 PolarHBondContact O-N 3.02Å
308	I	91.4	Very high	87.7	Confident	9 Å²	9	52.9 Å²	52.9	5%	0.046	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.1	178.1	-60	-63.4	0	0	0	108.5	H36 Y281 L295 C297 E306 P310 F351	H36-I308 HydrophobicContact CB-CG2 3.91Å; Y281-I308 HydrophobicContact CE1-CD1 4.41Å; Y281-I308 HydrophobicContact CE1-CG1 4.25Å; L295-I308 HydrophobicContact CB-CB 4.32Å; L295-I308 HydrophobicContact CD2-CB 4.13Å; L295-I308 HydrophobicContact CD2-CG1 4.23Å; L295-I308 HydrophobicContact CD2-CG2 4.3Å; L295-I308 HydrophobicContact CG-CB 4.28Å; L295-I308 HydrophobicContact CG-CG1 4.29Å; L295-I308 PolarHBondContact O-N 3.3Å; C297-I308 HydrophobicContact CB-CD1 3.69Å; C297-I308 HydrophobicContact CB-CG1 3.73Å; E306-I308 HydrophobicContact CG-CD1 3.96Å; E306-I308 VanDerWaalsContact OE1-CD1 3.28Å; E306-I308 WeakPolarHBondContact OE1-CD1 3.5Å; I308-P310 WeakPolarHBondContact O-CD 3.37Å; I308-F351 HydrophobicContact CG2-CE2 4.44Å; I308-F351 HydrophobicContact CG2-CZ 4Å
309	H	89.2	Confident	87.9	Confident	154 Å²	154	53.3 Å²	53.3	71%	0.713	28%	0.281	S	S	*	.			trans	-85.1	114.6	171.7	-64.3	-61.4	0	0	0	109.2	V307	V307-H309 PolarHBondContact O-N 3.02Å
310	P	89.5	Confident	88.3	Confident	46 Å²	46	52.5 Å²	52.5	30%	0.299	28%	0.277	S	S	.	.			trans	-62.9	154.2	179.3	-20.4	33	0	0	0	112.1	H36 I308 M316	H36-P310 VanDerWaalsContact O-CA 3.29Å; H36-P310 WeakPolarHBondContact O-CA 3.35Å; I308-P310 WeakPolarHBondContact O-CD 3.37Å; P310-M316 HydrophobicContact CB-SD 3.64Å; P310-M316 HydrophobicContact CG-CE 3.68Å; P310-M316 HydrophobicContact CG-SD 3.33Å; P310-M316 WeakPolarHBondContact CG-SD 3.24Å
311	S	87	Confident	88.7	Confident	22 Å²	22	52.4 Å²	52.4	15%	0.154	28%	0.275	C	S	.	.			trans	-59.4	151.2	171.1	71.1	0	0	0	0	111.4	H36 R37 D313 S314	H36-S311 PolarHBondContact O-N 3.11Å; H36-S311 VanDerWaalsContact O-N 3.11Å; R37-S311 WeakPolarHBondContact CA-OG 3.4Å; R37-S311 WeakPolarHBondContact CB-OG 3.18Å; R37-S311 WeakPolarHBondContact CG-OG 3.4Å; S311-D313 WeakPolarHBondContact CB-OD1 3.46Å; S311-D313 PolarHBondContact O-N 2.96Å; S311-D313 VanDerWaalsContact O-N 3.11Å; S311-D313 PolarHBondContact OG-OD1 3.36Å; S311-S314 PolarHBondContact N-OG 3.37Å; S311-S314 WeakPolarHBondContact O-CB 3.42Å; S311-S314 PolarHBondContact O-N 2.85Å; S311-S314 PolarHBondContact O-OG 2.89Å; S311-S314 PolarHBondContact OG-OG 3.37Å
312	Q	84.9	Confident	89.5	Confident	211 Å²	211	51.8 Å²	51.8	99%	0.986	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.3	-176.6	-66.4	-177.3	5.4	0	0	113.7
313	D	85.1	Confident	90.6	Very high	71 Å²	71	51 Å²	51	38%	0.38	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	18.6	178.7	67.4	-28.3	0	0	0	113.6	R37 S311	R37-D313 WeakPolarHBondContact CD-OD2 3.5Å; R37-D313 IonicContact CZ-OD2 2.73Å; R37-D313 PolarHBondContact NE-O 3.32Å; R37-D313 IonicContact NE-OD1 3.72Å; R37-D313 IonicContact NE-OD2 2.77Å; R37-D313 PolarHBondContact NE-OD2 3.41Å; R37-D313 VanDerWaalsContact NE-OD2 3.11Å; R37-D313 IonicContact NH1-OD2 3.62Å; R37-D313 PolarHBondContact NH1-OD2 3.01Å; R37-D313 IonicContact NH2-OD2 3.53Å; S311-D313 WeakPolarHBondContact CB-OD1 3.46Å; S311-D313 PolarHBondContact O-N 2.96Å; S311-D313 VanDerWaalsContact O-N 3.11Å; S311-D313 PolarHBondContact OG-OD1 3.36Å
314	S	93.2	Very high	91.5	Very high	25 Å²	25	48.2 Å²	48.2	18%	0.175	25%	0.253	C	S	.	.			trans	-78	134.9	-179.4	-76.7	0	0	0	0	113.9	R37 W38 S311 M316	R37-S314 WeakPolarHBondContact CA-OG 3.47Å; W38-S314 PolarHBondContact N-OG 3.36Å; W38-S314 WeakPolarHBondContact O-CA 3.32Å; S311-S314 PolarHBondContact N-OG 3.37Å; S311-S314 WeakPolarHBondContact O-CB 3.42Å; S311-S314 PolarHBondContact O-N 2.85Å; S311-S314 PolarHBondContact O-OG 2.89Å; S311-S314 PolarHBondContact OG-OG 3.37Å; S314-M316 PolarHBondContact O-N 3.01Å
315	E	95.3	Very high	92.4	Very high	104 Å²	104	47.6 Å²	47.6	49%	0.486	25%	0.251	S	S	.	.			trans	-93.4	84.1	169.8	-64.4	179.2	146.5	0	0	109.9	W38 R40 Y349	W38-E315 WeakPolarHBondContact CB-O 3.39Å; W38-E315 PolarHBondContact O-N 3.39Å; R40-E315 HydrophobicContact CB-CB 4.23Å; R40-E315 VanDerWaalsContact CB-OE2 3.25Å; R40-E315 WeakPolarHBondContact CB-OE2 3.47Å; R40-E315 PolarHBondContact N-OE2 3.18Å; E315-Y349 WeakPolarHBondContact O-CD1 3.48Å; E315-Y349 WeakPolarHBondContact O-CE1 3.36Å
316	M	94.3	Very high	93	Very high	69 Å²	69	47.4 Å²	47.4	34%	0.34	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-64.4	135.8	-171.3	-69.8	-60.9	-67.3	0	0	113.5	W38 P310 S314	W38-M316 HydrophobicContact CB-SD 4.24Å; W38-M316 HydrophobicContact CG-SD 3.84Å; P310-M316 HydrophobicContact CB-SD 3.64Å; P310-M316 HydrophobicContact CG-CE 3.68Å; P310-M316 HydrophobicContact CG-SD 3.33Å; P310-M316 WeakPolarHBondContact CG-SD 3.24Å; S314-M316 PolarHBondContact O-N 3.01Å
317	P	95.7	Very high	93.5	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-68	144.2	167.4	-5.5	18.2	0	0	0	111.1	W38 F283 I334 Y349	W38-P317 HydrophobicContact CD2-CG 3.89Å; W38-P317 HydrophobicContact CE3-CG 3.49Å; W38-P317 VanDerWaalsContact CE3-CG 3.49Å; W38-P317 HydrophobicContact CH2-CG 4.1Å; W38-P317 HydrophobicContact CZ2-CG 4.47Å; W38-P317 HydrophobicContact CZ3-CG 3.61Å; F283-P317 HydrophobicContact CE1-CB 4.28Å; F283-P317 HydrophobicContact CE1-CG 4.36Å; F283-P317 HydrophobicContact CE2-CG 4.45Å; F283-P317 HydrophobicContact CZ-CB 3.83Å; F283-P317 HydrophobicContact CZ-CG 3.79Å; P317-I334 HydrophobicContact CB-CD1 3.84Å; P317-I334 HydrophobicContact CG-CD1 3.61Å; P317-Y349 HydrophobicContact CB-CD1 4.1Å; P317-Y349 HydrophobicContact CB-CD2 3.82Å; P317-Y349 HydrophobicContact CB-CE1 4.08Å; P317-Y349 HydrophobicContact CB-CE2 3.82Å; P317-Y349 HydrophobicContact CB-CG 3.98Å; P317-Y349 HydrophobicContact CG-CD1 3.76Å; P317-Y349 HydrophobicContact CG-CD2 4.06Å; P317-Y349 HydrophobicContact CG-CE1 4.16Å; P317-Y349 HydrophobicContact CG-CE2 4.45Å; P317-Y349 HydrophobicContact CG-CG 3.7Å
318	S	94.3	Very high	93.7	Very high	51 Å²	51	44 Å²	44	36%	0.357	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-65.9	157.3	167.6	55.7	0	0	0	0	112.1	R320	S318-R320 PolarHBondContact O-N 3.03Å; S318-R320 PolarHBondContact O-NE 2.87Å; S318-R320 PolarHBondContact OG-NH2 3.46Å
319	G	94.4	Very high	93.6	Very high	12 Å²	12	50.4 Å²	50.4	12%	0.124	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-55	131.3	173.7	0	0	0	0	0	111.7	L291	L291-G319 WeakPolarHBondContact O-CA 3.11Å
320	R	96	Very high	93.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.			trans	-155.4	147.6	-172.2	59.2	-173.8	68.9	-149.8	-3.3	113	F283 G285 S318 H323 G336 T338 V339 E347	F283-R320 HydrophobicContact CE1-CG 4.13Å; G285-R320 PolarHBondContact N-O 3.27Å; S318-R320 PolarHBondContact O-N 3.03Å; S318-R320 PolarHBondContact O-NE 2.87Å; S318-R320 PolarHBondContact OG-NH2 3.46Å; R320-H323 HydrophobicContact CG-CB 4.31Å; R320-H323 PolarHBondContact O-ND1 3.19Å; R320-G336 PolarHBondContact NH1-O 3.38Å; R320-G336 VanDerWaalsContact NH1-O 3.14Å; R320-T338 VanDerWaalsContact CA-O 3.28Å; R320-T338 WeakPolarHBondContact CA-O 3.27Å; R320-V339 HydrophobicContact CB-CG1 4.05Å; R320-E347 IonicContact CZ-OE2 3.15Å; R320-E347 IonicContact NH1-OE2 3.37Å; R320-E347 IonicContact NH2-OE2 3.59Å; R320-E347 PolarHBondContact NH2-OE2 3.44Å
321	L	95.7	Very high	93.9	Very high	19 Å²	19	43.4 Å²	43.4	10%	0.099	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-123.9	161.2	170.9	78.3	151.7	0	0	0	112.1	Y269 G270 A286 L291 H323 G337 T338	Y269-L321 HydrophobicContact CD2-CD1 4.4Å; Y269-L321 HydrophobicContact CE2-CD1 3.81Å; G270-L321 CarbonylContact O-C 3.55Å; G270-L321 WeakPolarHBondContact O-CA 3.31Å; A286-L321 HydrophobicContact CB-CB 4.5Å; A286-L321 HydrophobicContact CB-CD1 4.07Å; L291-L321 HydrophobicContact CD2-CB 4.5Å; L291-L321 HydrophobicContact CD2-CD2 3.48Å; L291-L321 VanDerWaalsContact CD2-CD2 3.48Å; L321-H323 PolarHBondContact O-N 3.42Å; L321-H323 VanDerWaalsContact O-N 3.1Å; L321-G337 CarbonylContact O-C 3.56Å; L321-G337 WeakPolarHBondContact O-CA 3.41Å; L321-T338 HydrophobicContact CD2-CG2 4.36Å; L321-T338 PolarHBondContact N-O 3.08Å; L321-T338 PolarHBondContact O-N 3.4Å
322	F	96.9	Very high	94.4	Very high	31 Å²	31	42.4 Å²	42.4	14%	0.136	22%	0.224	C	C	.	.	S	Bend	trans	52.9	29	-177.3	-55.8	-51.9	0	0	0	113.6	S53 K54 H104 N214 Y269 G270	S53-F322 CarbonylContact C-O 3.54Å; S53-F322 WeakPolarHBondContact CA-O 3.33Å; K54-F322 HydrophobicContact CB-CB 4.43Å; K54-F322 HydrophobicContact CG-CB 3.69Å; K54-F322 HydrophobicContact CG-CD1 4.26Å; K54-F322 HydrophobicContact CG-CD2 3.95Å; K54-F322 HydrophobicContact CG-CG 3.73Å; K54-F322 PolarHBondContact N-O 2.85Å; H104-F322 AromaticContact CE1-CD1 3.84Å; H104-F322 AromaticContact CE1-CE1 3.61Å; H104-F322 AromaticContact CE1-CZ 3.99Å; N214-F322 HydrophobicContact CB-CE1 4.12Å; N214-F322 WeakPolarHBondContact OD1-CE1 3.23Å; Y269-F322 HydrophobicContact CD2-CE1 4.21Å; Y269-F322 AromaticContact CD2-CZ 3.8Å; Y269-F322 HydrophobicContact CD2-CZ 3.8Å; Y269-F322 HydrophobicContact CE2-CE2 4.32Å; Y269-F322 AromaticContact CE2-CZ 3.85Å; Y269-F322 HydrophobicContact CE2-CZ 3.85Å; G270-F322 VanDerWaalsContact CA-CD1 3.48Å; G270-F322 PolarHBondContact O-N 3.26Å
323	H	98.1	Very high	95	Very high	9 Å²	9	32.7 Å²	32.7	4%	0.042	18%	0.179	C	C	.	.			trans	-78.8	165.8	160.5	62.7	-75.5	0	0	0	108.4	T272 F283 R320 L321 F335 G336	T272-H323 VanDerWaalsContact CG2-CD2 3.4Å; T272-H323 WeakPolarHBondContact CG2-CD2 2.99Å; T272-H323 VanDerWaalsContact CG2-NE2 3.34Å; T272-H323 WeakPolarHBondContact CG2-NE2 3.17Å; T272-H323 VanDerWaalsContact CG2-O 3.32Å; T272-H323 WeakPolarHBondContact CG2-O 3.29Å; T272-H323 PolarHBondContact OG1-NE2 2.88Å; F283-H323 AromaticContact CD1-NE2 3.52Å; F283-H323 PolarHBondContact O-CE1 3.32Å; F283-H323 VanDerWaalsContact O-CE1 3.32Å; F283-H323 PolarHBondContact O-NE2 3.4Å; R320-H323 HydrophobicContact CG-CB 4.31Å; R320-H323 PolarHBondContact O-ND1 3.19Å; L321-H323 PolarHBondContact O-N 3.42Å; L321-H323 VanDerWaalsContact O-N 3.1Å; H323-F335 WeakPolarHBondContact CB-O 3.47Å; H323-G336 WeakPolarHBondContact CB-O 3.45Å
324	A	98.2	Very high	95.6	Very high	10 Å²	10	29.4 Å²	29.4	8%	0.083	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	153.6	174.6	0	0	0	0	0	110.2	V57 I334 F335	V57-A324 HydrophobicContact CB-CB 3.69Å; V57-A324 HydrophobicContact CG2-CB 3.46Å; V57-A324 VanDerWaalsContact CG2-CB 3.46Å; A324-I334 WeakPolarHBondContact O-CA 3.22Å; A324-F335 PolarHBondContact N-O 3.46Å; A324-F335 PolarHBondContact O-N 2.95Å
325	A	98.3	Very high	95.9	Very high	18 Å²	18	28.3 Å²	28.3	15%	0.149	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	146.2	-175.8	0	0	0	0	0	110.7	T272 V274 M332 Y333 I334	T272-A325 HydrophobicContact CG2-CB 3.79Å; V274-A325 HydrophobicContact CG1-CB 3.8Å; A325-M332 HydrophobicContact CB-CG 4.36Å; A325-M332 HydrophobicContact CB-SD 4.39Å; A325-Y333 CarbonylContact C-O 3.52Å; A325-Y333 WeakPolarHBondContact CA-O 3.49Å; A325-I334 HydrophobicContact CB-CG2 3.88Å
326	A	98	Very high	96	Very high	9 Å²	9	23.3 Å²	23.3	7%	0.074	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	158.6	169	0	0	0	0	0	110.6	V57 A59 I64 Y333	V57-A326 HydrophobicContact CG1-CB 3.79Å; A59-A326 HydrophobicContact CB-CB 4.01Å; I64-A326 HydrophobicContact CD1-CB 4.04Å; A326-Y333 PolarHBondContact N-O 3.45Å; A326-Y333 PolarHBondContact O-N 3.29Å
327	V	97.4	Very high	96.1	Very high	42 Å²	42	20 Å²	20	26%	0.255	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.8	-179.5	175.3	0	0	0	0	109.2	A59 V274 F276 A331 F353	A59-V327 WeakPolarHBondContact CB-O 3.39Å; V274-V327 HydrophobicContact CB-CG2 3.73Å; V274-V327 HydrophobicContact CG1-CG2 4.22Å; V274-V327 HydrophobicContact CG2-CG2 3.81Å; F276-V327 HydrophobicContact CD2-CG1 4.24Å; V327-A331 WeakPolarHBondContact CA-O 3.46Å; V327-F353 HydrophobicContact CB-CE2 4.4Å; V327-F353 HydrophobicContact CG1-CE2 3.8Å; V327-F353 HydrophobicContact CG2-CE2 3.75Å; V327-F353 HydrophobicContact CG2-CZ 3.92Å
328	I	95.1	Very high	96.2	Very high	12 Å²	12	20.4 Å²	20.4	6%	0.062	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.2	166.5	-66	171.6	0	0	0	106.2	A59 I64 V84 D330 A331 Y333	A59-I328 HydrophobicContact CB-CD1 4.21Å; A59-I328 HydrophobicContact CB-CG1 3.54Å; I64-I328 HydrophobicContact CD1-CD1 3.4Å; I64-I328 HydrophobicContact CD1-CG1 3.92Å; I64-I328 HydrophobicContact CG1-CD1 3.72Å; V84-I328 HydrophobicContact CG2-CD1 3.67Å; I328-D330 PolarHBondContact O-N 2.69Å; I328-D330 VanDerWaalsContact O-N 3.1Å; I328-A331 PolarHBondContact N-O 3.19Å; I328-A331 PolarHBondContact O-N 3.44Å; I328-Y333 HydrophobicContact CB-CD2 4.38Å; I328-Y333 HydrophobicContact CB-CE2 3.9Å; I328-Y333 HydrophobicContact CD1-CE2 4.36Å; I328-Y333 HydrophobicContact CG1-CE2 4.41Å
329	Q	90.2	Very high	96.2	Very high	143 Å²	143	19.3 Å²	19.3	67%	0.668	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	-115	-178.8	-59.2	175	3.9	0	0	111	F276	F276-Q329 WeakPolarHBondContact CE2-O 3.15Å
330	D	89.5	Confident	95.9	Very high	53 Å²	53	24.1 Å²	24.1	28%	0.283	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	16.3	-175.3	64.8	-17.8	0	0	0	113.7	F276 I328 R350 Q352 F353	F276-D330 HydrophobicContact CE2-CB 4.4Å; F276-D330 HydrophobicContact CZ-CB 4.17Å; I328-D330 PolarHBondContact O-N 2.69Å; I328-D330 VanDerWaalsContact O-N 3.1Å; D330-R350 IonicContact OD1-NH2 3.42Å; D330-Q352 PolarHBondContact O-NE2 2.77Å; D330-Q352 PolarHBondContact OD2-NE2 3.13Å; D330-F353 VanDerWaalsContact C-CD2 3.49Å; D330-F353 VanDerWaalsContact O-CB 3.29Å; D330-F353 WeakPolarHBondContact O-CB 3.28Å; D330-F353 VanDerWaalsContact O-CD2 3.31Å; D330-F353 WeakPolarHBondContact O-CD2 3.43Å; D330-F353 PolarHBondContact O-N 2.74Å
331	A	94.3	Very high	95.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.7	179.8	0	0	0	0	0	114	V327 I328 Y333 R350 F351	V327-A331 WeakPolarHBondContact CA-O 3.46Å; I328-A331 PolarHBondContact N-O 3.19Å; I328-A331 PolarHBondContact O-N 3.44Å; A331-Y333 HydrophobicContact CB-CE2 3.87Å; A331-R350 HydrophobicContact CB-CG 3.88Å; A331-R350 VanDerWaalsContact CB-CZ 3.42Å; A331-F351 CarbonylContact C-O 3.6Å; A331-F351 VanDerWaalsContact CA-O 3.24Å; A331-F351 WeakPolarHBondContact CA-O 3.5Å; A331-F351 WeakPolarHBondContact CB-O 3.26Å
332	M	97.4	Very high	94.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	135.6	168.2	171.7	177.3	61.6	0	0	110.3	W38 V274 L295 A325 I334 R350 F351 F353	W38-M332 HydrophobicContact CH2-CE 3.44Å; W38-M332 VanDerWaalsContact CH2-CE 3.44Å; W38-M332 HydrophobicContact CZ2-CE 3.87Å; W38-M332 HydrophobicContact CZ3-CE 4.3Å; V274-M332 HydrophobicContact CG2-CB 4.47Å; V274-M332 HydrophobicContact CG2-CG 4.14Å; V274-M332 HydrophobicContact CG2-SD 3.55Å; V274-M332 VanDerWaalsContact CG2-SD 3.55Å; L295-M332 HydrophobicContact CD1-CE 3.97Å; A325-M332 HydrophobicContact CB-CG 4.36Å; A325-M332 HydrophobicContact CB-SD 4.39Å; M332-I334 HydrophobicContact CE-CG2 4.42Å; M332-I334 HydrophobicContact CG-CG2 4.05Å; M332-I334 HydrophobicContact SD-CG2 4.11Å; M332-R350 CarbonylContact O-C 3.55Å; M332-R350 WeakPolarHBondContact O-CA 3.29Å; M332-F351 HydrophobicContact CB-CB 4.3Å; M332-F351 HydrophobicContact CE-CB 3.83Å; M332-F351 HydrophobicContact CE-CD1 3.94Å; M332-F351 HydrophobicContact CE-CG 4.06Å; M332-F351 PolarHBondContact N-O 2.84Å; M332-F351 PolarHBondContact O-N 2.87Å; M332-F353 HydrophobicContact CB-CE1 4.01Å; M332-F353 HydrophobicContact CB-CE2 3.87Å; M332-F353 HydrophobicContact CB-CZ 3.43Å; M332-F353 VanDerWaalsContact CB-CZ 3.43Å; M332-F353 HydrophobicContact CG-CZ 4.47Å
333	Y	98.3	Very high	94.8	Very high	8 Å²	8	37.8 Å²	37.8	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127	173.6	-65	-96.6	0	0	0	108.9	L41 I64 V84 A325 A326 I328 A331 M348 Y349 R350	L41-Y333 HydrophobicContact CD1-CD1 3.85Å; L41-Y333 HydrophobicContact CD1-CE1 3.74Å; I64-Y333 HydrophobicContact CD1-CD2 4.08Å; I64-Y333 HydrophobicContact CD1-CG 4.05Å; I64-Y333 HydrophobicContact CG1-CD1 4.47Å; I64-Y333 HydrophobicContact CG1-CD2 4.48Å; I64-Y333 HydrophobicContact CG1-CG 4.11Å; V84-Y333 HydrophobicContact CG1-CE1 4.44Å; V84-Y333 WeakPolarHBondContact CG1-OH 3.27Å; V84-Y333 HydrophobicContact CG2-CE1 4.18Å; A325-Y333 CarbonylContact C-O 3.52Å; A325-Y333 WeakPolarHBondContact CA-O 3.49Å; A326-Y333 PolarHBondContact N-O 3.45Å; A326-Y333 PolarHBondContact O-N 3.29Å; I328-Y333 HydrophobicContact CB-CD2 4.38Å; I328-Y333 HydrophobicContact CB-CE2 3.9Å; I328-Y333 HydrophobicContact CD1-CE2 4.36Å; I328-Y333 HydrophobicContact CG1-CE2 4.41Å; A331-Y333 HydrophobicContact CB-CE2 3.87Å; Y333-M348 HydrophobicContact CD1-CE 3.43Å; Y333-M348 VanDerWaalsContact CD1-CE 3.43Å; Y333-M348 HydrophobicContact CE1-CE 4.24Å; Y333-M348 HydrophobicContact CG-CE 4.08Å; Y333-Y349 CarbonylContact C-O 3.54Å; Y333-Y349 VanDerWaalsContact CA-O 3.32Å; Y333-Y349 WeakPolarHBondContact CA-O 3.44Å; Y333-R350 HydrophobicContact CD1-CB 4.13Å; Y333-R350 HydrophobicContact CD1-CG 4.23Å; Y333-R350 HydrophobicContact CE1-CB 3.98Å; Y333-R350 HydrophobicContact CE1-CG 3.76Å; Y333-R350 HydrophobicContact CE2-CG 4.39Å; Y333-R350 WeakPolarHBondContact OH-CD 3.49Å; Y333-R350 PolarHBondContact OH-NE 2.99Å; Y333-R350 VanDerWaalsContact OH-NE 3.08Å
334	I	98.2	Very high	94.7	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	141.6	173.5	68.4	172	0	0	0	110	W38 F283 P317 A324 A325 M332 M348 Y349	W38-I334 HydrophobicContact CH2-CD1 3.93Å; W38-I334 HydrophobicContact CH2-CG2 4.33Å; W38-I334 HydrophobicContact CZ3-CD1 3.64Å; W38-I334 HydrophobicContact CZ3-CG1 3.95Å; W38-I334 HydrophobicContact CZ3-CG2 4.39Å; F283-I334 HydrophobicContact CD1-CD1 3.9Å; F283-I334 HydrophobicContact CE1-CD1 3.46Å; F283-I334 VanDerWaalsContact CE1-CD1 3.46Å; F283-I334 HydrophobicContact CZ-CD1 4.15Å; P317-I334 HydrophobicContact CB-CD1 3.84Å; P317-I334 HydrophobicContact CG-CD1 3.61Å; A324-I334 WeakPolarHBondContact O-CA 3.22Å; A325-I334 HydrophobicContact CB-CG2 3.88Å; M332-I334 HydrophobicContact CE-CG2 4.42Å; M332-I334 HydrophobicContact CG-CG2 4.05Å; M332-I334 HydrophobicContact SD-CG2 4.11Å; I334-M348 WeakPolarHBondContact O-CA 3.34Å; I334-Y349 HydrophobicContact CD1-CD2 4.35Å; I334-Y349 HydrophobicContact CG1-CD2 4.33Å; I334-Y349 HydrophobicContact CG1-CG 4.47Å; I334-Y349 PolarHBondContact N-O 3.26Å; I334-Y349 PolarHBondContact O-N 3.06Å
335	F	98.4	Very high	94.6	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.009	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	139.7	179.3	178.8	-105.9	0	0	0	112.7	C44 R52 H55 V57 V66 W89 H323 A324 G346 E347 M348	C44-F335 HydrophobicContact CB-CE2 3.75Å; C44-F335 HydrophobicContact CB-CZ 3.89Å; R52-F335 HydrophobicContact CG-CE1 3.89Å; H55-F335 AromaticContact CE1-CD1 3.97Å; H55-F335 PolarHBondContact CE1-O 3.06Å; H55-F335 VanDerWaalsContact CE1-O 3.26Å; H55-F335 AromaticContact NE2-CD1 3.47Å; H55-F335 WeakPolarHBondContact NE2-CD1 3.09Å; H55-F335 PolarHBondContact NE2-O 2.83Å; V57-F335 HydrophobicContact CG2-CB 4.28Å; V66-F335 HydrophobicContact CB-CD1 4.46Å; V66-F335 HydrophobicContact CG1-CD1 3.72Å; V66-F335 HydrophobicContact CG1-CE1 3.78Å; V66-F335 HydrophobicContact CG2-CD1 3.92Å; V66-F335 HydrophobicContact CG2-CE1 4.23Å; V66-F335 HydrophobicContact CG2-CG 4.46Å; W89-F335 HydrophobicContact CH2-CD1 4.38Å; W89-F335 AromaticContact CH2-CD2 3.53Å; W89-F335 HydrophobicContact CH2-CD2 3.53Å; W89-F335 HydrophobicContact CH2-CE1 4.39Å; W89-F335 AromaticContact CH2-CE2 3.51Å; W89-F335 HydrophobicContact CH2-CE2 3.51Å; W89-F335 AromaticContact CH2-CG 3.98Å; W89-F335 HydrophobicContact CH2-CG 3.98Å; W89-F335 AromaticContact CH2-CZ 3.97Å; W89-F335 HydrophobicContact CH2-CZ 3.97Å; W89-F335 AromaticContact CZ2-CD2 3.49Å; W89-F335 HydrophobicContact CZ2-CD2 3.49Å; W89-F335 VanDerWaalsContact CZ2-CD2 3.49Å; W89-F335 AromaticContact CZ2-CE2 3.46Å; W89-F335 HydrophobicContact CZ2-CE2 3.46Å; W89-F335 VanDerWaalsContact CZ2-CE2 3.46Å; W89-F335 HydrophobicContact CZ2-CG 4.35Å; W89-F335 HydrophobicContact CZ2-CZ 4.31Å; W89-F335 HydrophobicContact CZ3-CE2 4.43Å; H323-F335 WeakPolarHBondContact CB-O 3.47Å; A324-F335 PolarHBondContact N-O 3.46Å; A324-F335 PolarHBondContact O-N 2.95Å; F335-G346 WeakPolarHBondContact CE2-O 3.48Å; F335-E347 WeakPolarHBondContact CA-O 3.44Å; F335-E347 WeakPolarHBondContact CD2-O 3.24Å; F335-M348 HydrophobicContact CD2-CB 4.2Å
336	G	97.6	Very high	94.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.			trans	62.6	-139.9	169.6	0	0	0	0	0	114.3	R320 H323 S345 E347	R320-G336 PolarHBondContact NH1-O 3.38Å; R320-G336 VanDerWaalsContact NH1-O 3.14Å; H323-G336 WeakPolarHBondContact CB-O 3.45Å; G336-S345 VanDerWaalsContact CA-O 3.26Å; G336-S345 WeakPolarHBondContact CA-O 3.04Å; G336-E347 PolarHBondContact N-O 3.06Å
337	G	97.3	Very high	94.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.21	C	C	.	.			trans	95.6	178.9	-174.7	0	0	0	0	0	113.4	R52 L321 R344 S345	R52-G337 PolarHBondContact O-N 3.19Å; L321-G337 CarbonylContact O-C 3.56Å; L321-G337 WeakPolarHBondContact O-CA 3.41Å; G337-R344 WeakPolarHBondContact O-CA 3.25Å; G337-S345 PolarHBondContact O-N 3.46Å
338	T	96.4	Very high	94.4	Very high	9 Å²	9	37.6 Å²	37.6	6%	0.055	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.5	174.9	-58.2	0	0	0	0	109	S53 R320 L321 V343	S53-T338 WeakPolarHBondContact CB-OG1 3.5Å; S53-T338 PolarHBondContact OG-OG1 3.47Å; S53-T338 VanDerWaalsContact OG-OG1 3.09Å; R320-T338 VanDerWaalsContact CA-O 3.28Å; R320-T338 WeakPolarHBondContact CA-O 3.27Å; L321-T338 HydrophobicContact CD2-CG2 4.36Å; L321-T338 PolarHBondContact N-O 3.08Å; L321-T338 PolarHBondContact O-N 3.4Å; T338-V343 WeakPolarHBondContact CA-O 3.36Å
339	V	94	Very high	94.5	Very high	27 Å²	27	37.6 Å²	37.6	16%	0.164	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-171.4	172.7	-60.3	0	0	0	0	109.9	R320 N342 V343	R320-V339 HydrophobicContact CB-CG1 4.05Å; V339-N342 PolarHBondContact O-N 3.22Å; V339-V343 HydrophobicContact CG2-CB 3.89Å; V339-V343 HydrophobicContact CG2-CG1 4.34Å; V339-V343 WeakPolarHBondContact CG2-O 3.48Å; V339-V343 PolarHBondContact N-O 2.9Å
340	D	88.4	Confident	94.8	Very high	113 Å²	113	32.3 Å²	32.3	60%	0.604	17%	0.171	S	C	*	.	G	3₁₀ helix	trans	-48.2	151.3	177.3	-68.5	-33.3	0	0	0	113.3	N342 V343	D340-N342 PolarHBondContact O-N 3.15Å; D340-V343 PolarHBondContact O-N 3.42Å
341	N	84.7	Confident	95.2	Very high	156 Å²	156	29.8 Å²	29.8	83%	0.834	16%	0.157	S	C	*	.	G	3₁₀ helix	trans	57.9	26.6	-175.7	-58.4	-28.4	0	0	0	114.1	V343	N341-V343 HydrophobicContact CB-CG2 4.29Å; N341-V343 PolarHBondContact O-N 3.47Å
342	N	87.1	Confident	95.1	Very high	111 Å²	111	30.1 Å²	30.1	59%	0.594	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	60.8	26.1	177	-161.7	32.8	0	0	0	112.9	V339 D340 R344	V339-N342 PolarHBondContact O-N 3.22Å; D340-N342 PolarHBondContact O-N 3.15Å; N342-R344 PolarHBondContact ND2-NH1 2.82Å; N342-R344 PolarHBondContact O-NH1 3.46Å; N342-R344 PolarHBondContact OD1-NH1 3.41Å
343	V	93.7	Very high	94.8	Very high	70 Å²	70	30.1 Å²	30.1	42%	0.424	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.4	-178.7	177.1	0	0	0	0	110.1	T338 V339 D340 N341	T338-V343 WeakPolarHBondContact CA-O 3.36Å; V339-V343 HydrophobicContact CG2-CB 3.89Å; V339-V343 HydrophobicContact CG2-CG1 4.34Å; V339-V343 WeakPolarHBondContact CG2-O 3.48Å; V339-V343 PolarHBondContact N-O 2.9Å; D340-V343 PolarHBondContact O-N 3.42Å; N341-V343 HydrophobicContact CB-CG2 4.29Å; N341-V343 PolarHBondContact O-N 3.47Å
344	R	95.8	Very high	94	Very high	32 Å²	32	30.1 Å²	30.1	12%	0.121	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	132.6	173.1	-79.2	68.8	176.9	139.3	1.6	109.2	R51 D70 G337 N342	R51-R344 HydrophobicContact CB-CB 3.96Å; R51-R344 WeakPolarHBondContact CB-O 3.34Å; R51-R344 VanDerWaalsContact CD-O 3.24Å; R51-R344 WeakPolarHBondContact CD-O 3.14Å; D70-R344 IonicContact OD1-CZ 3.36Å; D70-R344 IonicContact OD1-NE 3.02Å; D70-R344 PolarHBondContact OD1-NE 3.4Å; D70-R344 IonicContact OD1-NH2 2.81Å; D70-R344 PolarHBondContact OD1-NH2 3.13Å; D70-R344 IonicContact OD2-NH2 3.78Å; G337-R344 WeakPolarHBondContact O-CA 3.25Å; N342-R344 PolarHBondContact ND2-NH1 2.82Å; N342-R344 PolarHBondContact O-NH1 3.46Å; N342-R344 PolarHBondContact OD1-NH1 3.41Å
345	S	95.8	Very high	92.8	Very high	8 Å²	8	33.5 Å²	33.5	6%	0.056	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-94.2	149.7	177	-174	0	0	0	0	111.3	R52 G336 G337 E347	R52-S345 PolarHBondContact N-O 2.95Å; R52-S345 VanDerWaalsContact N-O 3.16Å; G336-S345 VanDerWaalsContact CA-O 3.26Å; G336-S345 WeakPolarHBondContact CA-O 3.04Å; G337-S345 PolarHBondContact O-N 3.46Å; S345-E347 WeakPolarHBondContact OG-CB 3.18Å; S345-E347 VanDerWaalsContact OG-CG 3.24Å; S345-E347 WeakPolarHBondContact OG-CG 3.38Å; S345-E347 PolarHBondContact OG-N 3.26Å; S345-E347 VanDerWaalsContact OG-N 3.1Å; S345-E347 PolarHBondContact OG-OE2 2.87Å; S345-E347 VanDerWaalsContact OG-OE2 3.08Å
346	G	95.4	Very high	91.7	Very high	6 Å²	6	34.8 Å²	34.8	6%	0.062	19%	0.189	C	C	.	.			trans	-116.2	16.4	167	0	0	0	0	0	111.7	P43 C44 F335	P43-G346 WeakPolarHBondContact CA-O 3.33Å; C44-G346 PolarHBondContact N-O 2.98Å; F335-G346 WeakPolarHBondContact CE2-O 3.48Å
347	E	96.6	Very high	90.9	Very high	38 Å²	38	36 Å²	36	18%	0.178	20%	0.197	C	C	.	.			trans	-79.1	147.2	-178.2	-62	171.4	139.1	0	0	111.4	R40 R320 F335 G336 S345 Y349	R40-E347 IonicContact CZ-OE1 3.74Å; R40-E347 IonicContact NE-OE1 2.79Å; R40-E347 IonicContact NH2-OE1 2.84Å; R40-E347 PolarHBondContact NH2-OE1 3.09Å; R320-E347 IonicContact CZ-OE2 3.15Å; R320-E347 IonicContact NH1-OE2 3.37Å; R320-E347 IonicContact NH2-OE2 3.59Å; R320-E347 PolarHBondContact NH2-OE2 3.44Å; F335-E347 WeakPolarHBondContact CA-O 3.44Å; F335-E347 WeakPolarHBondContact CD2-O 3.24Å; G336-E347 PolarHBondContact N-O 3.06Å; S345-E347 WeakPolarHBondContact OG-CB 3.18Å; S345-E347 VanDerWaalsContact OG-CG 3.24Å; S345-E347 WeakPolarHBondContact OG-CG 3.38Å; S345-E347 PolarHBondContact OG-N 3.26Å; S345-E347 VanDerWaalsContact OG-N 3.1Å; S345-E347 PolarHBondContact OG-OE2 2.87Å; S345-E347 VanDerWaalsContact OG-OE2 3.08Å; E347-Y349 HydrophobicContact CB-CD2 4.3Å; E347-Y349 HydrophobicContact CB-CE2 3.68Å; E347-Y349 HydrophobicContact CG-CE2 4.49Å
348	M	97.4	Very high	90.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.8	174	-171.7	166.7	-178	0	0	109.6	L41 I64 F82 W89 Y333 I334 F335	L41-M348 HydrophobicContact CB-CB 4.1Å; L41-M348 HydrophobicContact CB-CG 4.1Å; L41-M348 HydrophobicContact CD1-CE 4.11Å; L41-M348 HydrophobicContact CD1-CG 4.07Å; L41-M348 HydrophobicContact CD1-SD 4.23Å; L41-M348 PolarHBondContact N-O 2.91Å; I64-M348 HydrophobicContact CB-CE 4.22Å; I64-M348 HydrophobicContact CG1-CE 3.92Å; I64-M348 HydrophobicContact CG2-CE 4.42Å; F82-M348 HydrophobicContact CB-CE 4.14Å; F82-M348 HydrophobicContact CB-SD 4.08Å; F82-M348 HydrophobicContact CD1-CE 3.18Å; F82-M348 HydrophobicContact CD1-SD 3.56Å; F82-M348 VanDerWaalsContact CD1-SD 3.56Å; F82-M348 HydrophobicContact CD2-CE 4.43Å; F82-M348 HydrophobicContact CD2-SD 3.7Å; F82-M348 HydrophobicContact CE1-CE 3.54Å; F82-M348 HydrophobicContact CE1-SD 3.77Å; F82-M348 HydrophobicContact CE2-SD 3.9Å; F82-M348 HydrophobicContact CG-CE 3.67Å; F82-M348 HydrophobicContact CG-SD 3.49Å; F82-M348 WeakPolarHBondContact CG-SD 3.5Å; F82-M348 HydrophobicContact CZ-CE 4.29Å; F82-M348 HydrophobicContact CZ-SD 3.92Å; W89-M348 HydrophobicContact CH2-SD 4.08Å; W89-M348 HydrophobicContact CZ2-CB 4.11Å; W89-M348 HydrophobicContact CZ2-CG 4.29Å; W89-M348 HydrophobicContact CZ2-SD 3.35Å; W89-M348 WeakPolarHBondContact CZ2-SD 3.24Å; Y333-M348 HydrophobicContact CD1-CE 3.43Å; Y333-M348 VanDerWaalsContact CD1-CE 3.43Å; Y333-M348 HydrophobicContact CE1-CE 4.24Å; Y333-M348 HydrophobicContact CG-CE 4.08Å; I334-M348 WeakPolarHBondContact O-CA 3.34Å; F335-M348 HydrophobicContact CD2-CB 4.2Å
349	Y	98	Very high	89.7	Confident	13 Å²	13	39.5 Å²	39.5	5%	0.051	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.9	174.4	-64.8	-102.5	0	0	0	110.1	R39 R40 E315 P317 Y333 I334 E347	R39-Y349 CarbonylContact O-C 3.54Å; R39-Y349 WeakPolarHBondContact O-CA 3.32Å; R40-Y349 HydrophobicContact CB-CD1 4.03Å; R40-Y349 HydrophobicContact CB-CE1 3.82Å; R40-Y349 HydrophobicContact CG-CD1 4.26Å; R40-Y349 HydrophobicContact CG-CE1 3.84Å; E315-Y349 WeakPolarHBondContact O-CD1 3.48Å; E315-Y349 WeakPolarHBondContact O-CE1 3.36Å; P317-Y349 HydrophobicContact CB-CD1 4.1Å; P317-Y349 HydrophobicContact CB-CD2 3.82Å; P317-Y349 HydrophobicContact CB-CE1 4.08Å; P317-Y349 HydrophobicContact CB-CE2 3.82Å; P317-Y349 HydrophobicContact CB-CG 3.98Å; P317-Y349 HydrophobicContact CG-CD1 3.76Å; P317-Y349 HydrophobicContact CG-CD2 4.06Å; P317-Y349 HydrophobicContact CG-CE1 4.16Å; P317-Y349 HydrophobicContact CG-CE2 4.45Å; P317-Y349 HydrophobicContact CG-CG 3.7Å; Y333-Y349 CarbonylContact C-O 3.54Å; Y333-Y349 VanDerWaalsContact CA-O 3.32Å; Y333-Y349 WeakPolarHBondContact CA-O 3.44Å; I334-Y349 HydrophobicContact CD1-CD2 4.35Å; I334-Y349 HydrophobicContact CG1-CD2 4.33Å; I334-Y349 HydrophobicContact CG1-CG 4.47Å; I334-Y349 PolarHBondContact N-O 3.26Å; I334-Y349 PolarHBondContact O-N 3.06Å; E347-Y349 HydrophobicContact CB-CD2 4.3Å; E347-Y349 HydrophobicContact CB-CE2 3.68Å; E347-Y349 HydrophobicContact CG-CE2 4.49Å
350	R	96.8	Very high	89.5	Confident	31 Å²	31	39 Å²	39	12%	0.117	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.9	171.7	-176.2	-178.5	-178.9	-82.4	6.3	108.9	E33 W38 R39 L41 D330 A331 M332 Y333 Q352	E33-R350 IonicContact OE1-CZ 3.58Å; E33-R350 IonicContact OE1-NH1 2.62Å; E33-R350 PolarHBondContact OE1-NH1 3.26Å; E33-R350 IonicContact OE1-NH2 2.83Å; E33-R350 IonicContact OE2-CZ 3.48Å; E33-R350 VanDerWaalsContact OE2-CZ 3.24Å; E33-R350 IonicContact OE2-NH1 2.56Å; E33-R350 PolarHBondContact OE2-NH1 3.46Å; E33-R350 IonicContact OE2-NH2 3.03Å; E33-R350 PolarHBondContact OE2-NH2 3.45Å; W38-R350 CarbonylContact C-O 3.58Å; W38-R350 WeakPolarHBondContact CA-O 3.46Å; R39-R350 PolarHBondContact N-O 2.82Å; R39-R350 PolarHBondContact O-N 2.99Å; L41-R350 HydrophobicContact CD1-CB 3.88Å; L41-R350 HydrophobicContact CG-CB 4.17Å; D330-R350 IonicContact OD1-NH2 3.42Å; A331-R350 HydrophobicContact CB-CG 3.88Å; A331-R350 VanDerWaalsContact CB-CZ 3.42Å; M332-R350 CarbonylContact O-C 3.55Å; M332-R350 WeakPolarHBondContact O-CA 3.29Å; Y333-R350 HydrophobicContact CD1-CB 4.13Å; Y333-R350 HydrophobicContact CD1-CG 4.23Å; Y333-R350 HydrophobicContact CE1-CB 3.98Å; Y333-R350 HydrophobicContact CE1-CG 3.76Å; Y333-R350 HydrophobicContact CE2-CG 4.39Å; Y333-R350 WeakPolarHBondContact OH-CD 3.49Å; Y333-R350 PolarHBondContact OH-NE 2.99Å; Y333-R350 VanDerWaalsContact OH-NE 3.08Å; R350-Q352 VanDerWaalsContact CZ-OE1 3.26Å
351	F	96.8	Very high	89.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	125.5	172.5	176.8	-103.8	0	0	0	110	H36 R37 W38 Y281 L295 I308 A331 M332 F353	H36-F351 VanDerWaalsContact CA-CE2 3.49Å; H36-F351 HydrophobicContact CB-CE2 4.19Å; H36-F351 HydrophobicContact CB-CZ 4.14Å; H36-F351 AromaticContact CD2-CZ 3.91Å; R37-F351 WeakPolarHBondContact O-CA 3.44Å; W38-F351 AromaticContact CD1-CD2 3.54Å; W38-F351 AromaticContact CD1-CE2 3.95Å; W38-F351 HydrophobicContact CD2-CB 3.84Å; W38-F351 AromaticContact CD2-CD2 3.67Å; W38-F351 HydrophobicContact CD2-CD2 3.67Å; W38-F351 HydrophobicContact CD2-CG 4.17Å; W38-F351 AromaticContact CE2-CD2 3.34Å; W38-F351 AromaticContact CE2-CG 3.87Å; W38-F351 HydrophobicContact CE3-CB 3.68Å; W38-F351 HydrophobicContact CE3-CD2 4.4Å; W38-F351 HydrophobicContact CE3-CG 4.48Å; W38-F351 AromaticContact CG-CD2 3.84Å; W38-F351 HydrophobicContact CG-CD2 3.84Å; W38-F351 HydrophobicContact CH2-CB 3.82Å; W38-F351 HydrophobicContact CH2-CG 4.35Å; W38-F351 HydrophobicContact CZ2-CB 3.93Å; W38-F351 AromaticContact CZ2-CD2 3.88Å; W38-F351 HydrophobicContact CZ2-CD2 3.88Å; W38-F351 AromaticContact CZ2-CG 3.98Å; W38-F351 HydrophobicContact CZ2-CG 3.98Å; W38-F351 HydrophobicContact CZ3-CB 3.67Å; W38-F351 AromaticContact NE1-CD2 3.24Å; W38-F351 AromaticContact NE1-CE2 3.6Å; Y281-F351 HydrophobicContact CE1-CE1 4.36Å; L295-F351 HydrophobicContact CD2-CD1 3.85Å; L295-F351 HydrophobicContact CD2-CD2 4.01Å; L295-F351 HydrophobicContact CD2-CE1 3.37Å; L295-F351 HydrophobicContact CD2-CE2 3.53Å; L295-F351 HydrophobicContact CD2-CG 4.14Å; L295-F351 HydrophobicContact CD2-CZ 3.2Å; I308-F351 HydrophobicContact CG2-CE2 4.44Å; I308-F351 HydrophobicContact CG2-CZ 4Å; A331-F351 CarbonylContact C-O 3.6Å; A331-F351 VanDerWaalsContact CA-O 3.24Å; A331-F351 WeakPolarHBondContact CA-O 3.5Å; A331-F351 WeakPolarHBondContact CB-O 3.26Å; M332-F351 HydrophobicContact CB-CB 4.3Å; M332-F351 HydrophobicContact CE-CB 3.83Å; M332-F351 HydrophobicContact CE-CD1 3.94Å; M332-F351 HydrophobicContact CE-CG 4.06Å; M332-F351 PolarHBondContact N-O 2.84Å; M332-F351 PolarHBondContact O-N 2.87Å; F351-F353 AromaticContact CD1-CD1 3.78Å; F351-F353 HydrophobicContact CD1-CD1 3.78Å; F351-F353 AromaticContact CD1-CE1 3.92Å; F351-F353 HydrophobicContact CD1-CE1 3.92Å; F351-F353 AromaticContact CE1-CD1 3.67Å; F351-F353 HydrophobicContact CE1-CD1 3.67Å; F351-F353 HydrophobicContact CE1-CE1 4.09Å
352	Q	93.1	Very high	89.9	Confident	7 Å²	7	28.4 Å²	28.4	3%	0.033	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	118.1	176.2	-175.4	60.5	34.4	0	0	111	E33 T34 H36 R37 D330 R350	E33-Q352 HydrophobicContact CG-CG 4.2Å; E33-Q352 PolarHBondContact OE2-OE1 3.03Å; T34-Q352 WeakPolarHBondContact O-CB 3.47Å; T34-Q352 WeakPolarHBondContact O-CG 3.36Å; H36-Q352 WeakPolarHBondContact CA-O 3.47Å; H36-Q352 PolarHBondContact N-O 3.19Å; R37-Q352 PolarHBondContact O-N 3.29Å; D330-Q352 PolarHBondContact O-NE2 2.77Å; D330-Q352 PolarHBondContact OD2-NE2 3.13Å; R350-Q352 VanDerWaalsContact CZ-OE1 3.26Å
353	F	91.3	Very high	90.1	Very high	1 Å²	1	25.9 Å²	25.9	0%	0.004	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-72.1	163.7	174	-65.9	-57.4	0	0	0	112	V274 F276 Y281 V327 D330 M332 F351	V274-F353 HydrophobicContact CG2-CZ 3.91Å; F276-F353 HydrophobicContact CB-CD1 4.38Å; F276-F353 HydrophobicContact CB-CD2 3.76Å; F276-F353 HydrophobicContact CB-CE1 4.27Å; F276-F353 HydrophobicContact CB-CE2 3.6Å; F276-F353 HydrophobicContact CB-CG 4.14Å; F276-F353 HydrophobicContact CB-CZ 3.83Å; F276-F353 HydrophobicContact CD1-CB 3.48Å; F276-F353 VanDerWaalsContact CD1-CB 3.48Å; F276-F353 HydrophobicContact CD1-CD1 4.26Å; F276-F353 AromaticContact CD1-CD2 3.68Å; F276-F353 HydrophobicContact CD1-CD2 3.68Å; F276-F353 HydrophobicContact CD1-CE2 4.41Å; F276-F353 AromaticContact CD1-CG 3.58Å; F276-F353 HydrophobicContact CD1-CG 3.58Å; F276-F353 AromaticContact CD2-CD2 3.66Å; F276-F353 HydrophobicContact CD2-CD2 3.66Å; F276-F353 HydrophobicContact CD2-CE2 4.02Å; F276-F353 HydrophobicContact CD2-CG 4.4Å; F276-F353 HydrophobicContact CE1-CB 3.48Å; F276-F353 VanDerWaalsContact CE1-CB 3.48Å; F276-F353 HydrophobicContact CE1-CD2 4.18Å; F276-F353 HydrophobicContact CE1-CG 4.06Å; F276-F353 HydrophobicContact CE2-CD2 4.18Å; F276-F353 HydrophobicContact CG-CB 4.13Å; F276-F353 HydrophobicContact CG-CD1 4.44Å; F276-F353 AromaticContact CG-CD2 3.38Å; F276-F353 HydrophobicContact CG-CD2 3.38Å; F276-F353 AromaticContact CG-CE2 3.74Å; F276-F353 HydrophobicContact CG-CE2 3.74Å; F276-F353 AromaticContact CG-CG 3.77Å; F276-F353 HydrophobicContact CG-CG 3.77Å; F276-F353 HydrophobicContact CG-CZ 4.39Å; F276-F353 HydrophobicContact CZ-CB 4.14Å; F276-F353 HydrophobicContact CZ-CD2 4.4Å; Y281-F353 HydrophobicContact CD1-CD1 4.28Å; Y281-F353 AromaticContact CD1-CE1 3.98Å; Y281-F353 HydrophobicContact CD1-CE1 3.98Å; Y281-F353 AromaticContact CD2-CD1 3.79Å; Y281-F353 HydrophobicContact CD2-CD1 3.79Å; Y281-F353 AromaticContact CD2-CE1 3.23Å; Y281-F353 HydrophobicContact CD2-CE1 3.23Å; Y281-F353 AromaticContact CD2-CZ 3.94Å; Y281-F353 HydrophobicContact CD2-CZ 3.94Å; Y281-F353 AromaticContact CE1-CD1 3.97Å; Y281-F353 HydrophobicContact CE1-CD1 3.97Å; Y281-F353 HydrophobicContact CE1-CE1 4.14Å; Y281-F353 AromaticContact CE2-CD1 3.41Å; Y281-F353 HydrophobicContact CE2-CD1 3.41Å; Y281-F353 VanDerWaalsContact CE2-CD1 3.41Å; Y281-F353 AromaticContact CE2-CE1 3.4Å; Y281-F353 HydrophobicContact CE2-CE1 3.4Å; Y281-F353 HydrophobicContact CE2-CG 4.33Å; Y281-F353 HydrophobicContact CE2-CZ 4.26Å; Y281-F353 HydrophobicContact CG-CD1 4.19Å; Y281-F353 AromaticContact CG-CE1 3.53Å; Y281-F353 HydrophobicContact CG-CE1 3.53Å; Y281-F353 HydrophobicContact CG-CZ 4.43Å; Y281-F353 AromaticContact CZ-CD1 3.52Å; Y281-F353 AromaticContact CZ-CE1 3.87Å; V327-F353 HydrophobicContact CB-CE2 4.4Å; V327-F353 HydrophobicContact CG1-CE2 3.8Å; V327-F353 HydrophobicContact CG2-CE2 3.75Å; V327-F353 HydrophobicContact CG2-CZ 3.92Å; D330-F353 VanDerWaalsContact C-CD2 3.49Å; D330-F353 VanDerWaalsContact O-CB 3.29Å; D330-F353 WeakPolarHBondContact O-CB 3.28Å; D330-F353 VanDerWaalsContact O-CD2 3.31Å; D330-F353 WeakPolarHBondContact O-CD2 3.43Å; D330-F353 PolarHBondContact O-N 2.74Å; M332-F353 HydrophobicContact CB-CE1 4.01Å; M332-F353 HydrophobicContact CB-CE2 3.87Å; M332-F353 HydrophobicContact CB-CZ 3.43Å; M332-F353 VanDerWaalsContact CB-CZ 3.43Å; M332-F353 HydrophobicContact CG-CZ 4.47Å; F351-F353 AromaticContact CD1-CD1 3.78Å; F351-F353 HydrophobicContact CD1-CD1 3.78Å; F351-F353 AromaticContact CD1-CE1 3.92Å; F351-F353 HydrophobicContact CD1-CE1 3.92Å; F351-F353 AromaticContact CE1-CD1 3.67Å; F351-F353 HydrophobicContact CE1-CD1 3.67Å; F351-F353 HydrophobicContact CE1-CE1 4.09Å
354	S	81.8	Confident	90.2	Very high	8 Å²	8	22.6 Å²	22.6	6%	0.056	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-99.8	128.6	166.2	52.3	0	0	0	0	110.8	H36	H36-S354 VanDerWaalsContact NE2-CB 3.26Å; H36-S354 WeakPolarHBondContact NE2-CB 3.4Å; H36-S354 PolarHBondContact NE2-OG 3.41Å
355	S	71.9	Confident	90.2	Very high	72 Å²	72	21.1 Å²	21.1	50%	0.503	11%	0.113	S	C	.	.			trans	-107.3	62.6	175.4	-58.1	0	0	0	0	110.7	F276	F276-S355 WeakPolarHBondContact CE1-OG 3.4Å; F276-S355 VanDerWaalsContact CZ-OG 3.28Å; F276-S355 WeakPolarHBondContact CZ-OG 3.5Å
356	Y	74.9	Confident	90.1	Very high	28 Å²	28	21 Å²	21	11%	0.11	11%	0.114	C	C	.	.	P	Polyproline II helix	trans	-95.6	133.2	179.3	-60.1	-56.9	0	0	0	112.2	V35 R278 K358 Y699 Q702	V35-Y356 VanDerWaalsContact CG1-OH 3.23Å; V35-Y356 WeakPolarHBondContact CG1-OH 3.36Å; V35-Y356 HydrophobicContact CG2-CE2 4.3Å; V35-Y356 WeakPolarHBondContact CG2-OH 3.24Å; R278-Y356 PolarHBondContact NH1-O 2.95Å; Y356-K358 PolarHBondContact O-N 2.77Å; Y356-Y699 HydrophobicContact CD1-CD2 4.32Å; Y356-Y699 HydrophobicContact CD1-CE1 4.32Å; Y356-Y699 AromaticContact CD1-CE2 3.98Å; Y356-Y699 HydrophobicContact CD1-CE2 3.98Å; Y356-Y699 HydrophobicContact CD2-CE1 4.24Å; Y356-Y699 HydrophobicContact CD2-CE2 4.48Å; Y356-Y699 AromaticContact CD2-CZ 3.83Å; Y356-Y699 WeakPolarHBondContact CD2-OH 3.19Å; Y356-Y699 HydrophobicContact CE2-CE1 4.42Å; Y356-Y699 HydrophobicContact CG-CE1 4.24Å; Y356-Y699 AromaticContact CG-CE2 3.82Å; Y356-Y699 HydrophobicContact CG-CE2 3.82Å; Y356-Y699 AromaticContact CG-CZ 3.62Å; Y356-Q702 HydrophobicContact CE1-CB 4.32Å; Y356-Q702 HydrophobicContact CE1-CG 4.41Å; Y356-Q702 VanDerWaalsContact CE1-OE1 3.3Å; Y356-Q702 VanDerWaalsContact CZ-CD 3.43Å; Y356-Q702 WeakPolarHBondContact OH-CG 3.45Å; Y356-Q702 PolarHBondContact OH-NE2 2.89Å; Y356-Q702 PolarHBondContact OH-OE1 3.15Å
357	P	81	Confident	90	Very high	27 Å²	27	25.8 Å²	25.8	18%	0.175	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-56.9	140	170.9	-20.2	30.4	0	0	0	110.8	N694 R695 A698	P357-N694 WeakPolarHBondContact CG-OD1 3.3Å; P357-R695 HydrophobicContact CB-CB 4.02Å; P357-R695 WeakPolarHBondContact O-CD 3.48Å; P357-R695 PolarHBondContact O-NH1 3.32Å; P357-A698 HydrophobicContact CG-CB 4.2Å
358	K	82.6	Confident	90	Very high	48 Å²	48	24.1 Å²	24.1	21%	0.209	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-56.3	145.1	179.9	-171.1	-163.6	179.9	-178.4	0	111.6	D301 Y356 T360 E363 N693	D301-K358 HydrophobicContact CB-CD 4.07Å; D301-K358 IonicContact OD2-NZ 2.76Å; Y356-K358 PolarHBondContact O-N 2.77Å; K358-T360 PolarHBondContact O-N 2.79Å; K358-E363 VanDerWaalsContact CE-OE1 3.31Å; K358-E363 WeakPolarHBondContact CE-OE1 3.31Å; K358-E363 IonicContact NZ-OE1 2.62Å; K358-E363 PolarHBondContact NZ-OE1 2.91Å; K358-N693 PolarHBondContact O-ND2 3.25Å
359	C	85.9	Confident	89.8	Confident	34 Å²	34	25 Å²	25	23%	0.23	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-68	124.9	166.5	-174.1	0	0	0	0	110
360	T	90.3	Very high	89.6	Confident	17 Å²	17	30.6 Å²	30.6	10%	0.104	16%	0.155	C	C	.	.			trans	-96.3	8.4	-177.1	63	0	0	0	0	113.9	K358 H362 E363 D364 R628 N693	K358-T360 PolarHBondContact O-N 2.79Å; T360-H362 VanDerWaalsContact C-N 3.33Å; T360-H362 PolarHBondContact O-N 2.94Å; T360-E363 VanDerWaalsContact C-OE2 3.28Å; T360-E363 VanDerWaalsContact CA-OE2 3.26Å; T360-E363 WeakPolarHBondContact CA-OE2 3.37Å; T360-E363 PolarHBondContact O-N 3.27Å; T360-D364 VanDerWaalsContact CB-OD2 3.3Å; T360-D364 WeakPolarHBondContact CB-OD2 3.09Å; T360-D364 VanDerWaalsContact O-CB 3.29Å; T360-D364 WeakPolarHBondContact O-CB 3.25Å; T360-D364 PolarHBondContact O-N 3.47Å; T360-D364 PolarHBondContact OG1-OD2 3.19Å; T360-R628 PolarHBondContact OG1-NH1 2.61Å; T360-N693 WeakPolarHBondContact CG2-ND2 3.33Å
361	L	92.3	Very high	89.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-53.7	-48.3	-172.2	-176.9	72	0	0	0	112.6	Y365 L591 V592	L361-Y365 HydrophobicContact CD1-CD2 4.22Å; L361-Y365 HydrophobicContact CD1-CE2 3.52Å; L361-Y365 HydrophobicContact CG-CD2 4.31Å; L361-Y365 HydrophobicContact CG-CE2 4Å; L361-Y365 PolarHBondContact O-N 2.7Å; L361-Y365 VanDerWaalsContact O-N 3.15Å; L361-L591 HydrophobicContact CD2-CD2 4.08Å; L361-L591 HydrophobicContact CD2-CG 4.27Å; L361-L591 HydrophobicContact CG-CD2 4.18Å; L361-V592 HydrophobicContact CD2-CG2 3.85Å
362	H	89.6	Confident	89.2	Confident	46 Å²	46	36 Å²	36	21%	0.213	18%	0.18	C	C	.	.	H	α-helix	trans	-69.7	-38.9	-177.6	-56.5	85.3	0	0	0	111.3	T360 G366 T470 L591	T360-H362 VanDerWaalsContact C-N 3.33Å; T360-H362 PolarHBondContact O-N 2.94Å; H362-G366 PolarHBondContact O-N 3.05Å; H362-T470 PolarHBondContact CD2-O 3.15Å; H362-L591 VanDerWaalsContact CD2-CD2 3.4Å; H362-L591 WeakPolarHBondContact CD2-CD2 3.38Å
363	E	90.9	Very high	89.1	Confident	57 Å²	57	38.3 Å²	38.3	27%	0.266	19%	0.191	S	C	.	.	H	α-helix	trans	-67.4	-40.5	177.8	-67.1	73.2	-163.6	0	0	111.5	K358 T360 G366 K367	K358-E363 VanDerWaalsContact CE-OE1 3.31Å; K358-E363 WeakPolarHBondContact CE-OE1 3.31Å; K358-E363 IonicContact NZ-OE1 2.62Å; K358-E363 PolarHBondContact NZ-OE1 2.91Å; T360-E363 VanDerWaalsContact C-OE2 3.28Å; T360-E363 VanDerWaalsContact CA-OE2 3.26Å; T360-E363 WeakPolarHBondContact CA-OE2 3.37Å; T360-E363 PolarHBondContact O-N 3.27Å; E363-G366 CarbonylContact O-C 3.57Å; E363-G366 WeakPolarHBondContact O-CA 3.34Å; E363-G366 PolarHBondContact O-N 2.72Å; E363-K367 WeakPolarHBondContact O-CG 3.33Å; E363-K367 PolarHBondContact O-N 2.97Å
364	D	95	Very high	89.1	Confident	2 Å²	2	41 Å²	41	1%	0.011	20%	0.203	C	C	.	.	H	α-helix	trans	-74.9	-38.6	-174.7	-71.6	-15.5	0	0	0	111.9	T360 G366 K367 L368 A627 R628 S692	T360-D364 VanDerWaalsContact CB-OD2 3.3Å; T360-D364 WeakPolarHBondContact CB-OD2 3.09Å; T360-D364 VanDerWaalsContact O-CB 3.29Å; T360-D364 WeakPolarHBondContact O-CB 3.25Å; T360-D364 PolarHBondContact O-N 3.47Å; T360-D364 PolarHBondContact OG1-OD2 3.19Å; D364-G366 VanDerWaalsContact C-N 3.34Å; D364-K367 PolarHBondContact O-N 3.25Å; D364-K367 IonicContact OD1-NZ 2.78Å; D364-K367 PolarHBondContact OD1-NZ 3.32Å; D364-L368 PolarHBondContact O-N 3.3Å; D364-A627 WeakPolarHBondContact CB-O 3.18Å; D364-R628 IonicContact OD2-CZ 2.87Å; D364-R628 IonicContact OD2-NH1 3.54Å; D364-R628 PolarHBondContact OD2-NH1 3.21Å; D364-S692 PolarHBondContact OD1-OG 3.21Å; D364-S692 VanDerWaalsContact OD2-CB 3.31Å; D364-S692 WeakPolarHBondContact OD2-CB 3.43Å; D364-S692 PolarHBondContact OD2-OG 3Å
365	Y	95.9	Very high	89.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.7	-33.2	166.5	-66.7	-25.9	0	0	0	112.3	L361 L368 W369 I394 Y469 L591 M595 I624 A627 R628 Y668	L361-Y365 HydrophobicContact CD1-CD2 4.22Å; L361-Y365 HydrophobicContact CD1-CE2 3.52Å; L361-Y365 HydrophobicContact CG-CD2 4.31Å; L361-Y365 HydrophobicContact CG-CE2 4Å; L361-Y365 PolarHBondContact O-N 2.7Å; L361-Y365 VanDerWaalsContact O-N 3.15Å; Y365-L368 PolarHBondContact O-N 2.9Å; Y365-W369 PolarHBondContact O-N 3.4Å; Y365-I394 HydrophobicContact CD1-CD1 4.09Å; Y365-I394 HydrophobicContact CG-CD1 4.3Å; Y365-Y469 VanDerWaalsContact CB-O 3.32Å; Y365-Y469 WeakPolarHBondContact CB-O 3.29Å; Y365-Y469 VanDerWaalsContact O-CD1 3.29Å; Y365-Y469 WeakPolarHBondContact O-CD1 3.36Å; Y365-L591 HydrophobicContact CD2-CD1 3.92Å; Y365-L591 HydrophobicContact CD2-CD2 4.03Å; Y365-L591 HydrophobicContact CD2-CG 4.45Å; Y365-L591 HydrophobicContact CE2-CD1 4.11Å; Y365-M595 HydrophobicContact CE2-CE 4.16Å; Y365-M595 HydrophobicContact CE2-CG 4.1Å; Y365-I624 HydrophobicContact CE1-CG2 4.36Å; Y365-I624 WeakPolarHBondContact OH-CG2 3.24Å; Y365-A627 HydrophobicContact CD1-CB 3.73Å; Y365-A627 HydrophobicContact CE1-CB 3.99Å; Y365-R628 HydrophobicContact CE1-CG 3.89Å; Y365-Y668 PolarHBondContact OH-O 2.88Å
366	G	93.8	Very high	90.8	Very high	6 Å²	6	40.1 Å²	40.1	6%	0.062	19%	0.193	C	C	.	.	H	α-helix	trans	-58.9	-44.8	170.6	0	0	0	0	0	112.7	H362 E363 D364 W369 E370	H362-G366 PolarHBondContact O-N 3.05Å; E363-G366 CarbonylContact O-C 3.57Å; E363-G366 WeakPolarHBondContact O-CA 3.34Å; E363-G366 PolarHBondContact O-N 2.72Å; D364-G366 VanDerWaalsContact C-N 3.34Å; G366-W369 WeakPolarHBondContact O-CB 3.29Å; G366-W369 PolarHBondContact O-N 2.91Å; G366-E370 WeakPolarHBondContact O-CG 3.32Å; G366-E370 PolarHBondContact O-N 3.39Å
367	K	94.5	Very high	91.8	Very high	106 Å²	106	38.8 Å²	38.8	46%	0.461	19%	0.188	S	C	.	.	H	α-helix	trans	-62.9	-42.8	174.5	-71	169.1	-167	159.8	0	111.8	E363 D364 W369 E370 N371	E363-K367 WeakPolarHBondContact O-CG 3.33Å; E363-K367 PolarHBondContact O-N 2.97Å; D364-K367 PolarHBondContact O-N 3.25Å; D364-K367 IonicContact OD1-NZ 2.78Å; D364-K367 PolarHBondContact OD1-NZ 3.32Å; K367-W369 VanDerWaalsContact C-N 3.27Å; K367-W369 PolarHBondContact O-N 3.36Å; K367-E370 PolarHBondContact O-N 3.3Å; K367-N371 WeakPolarHBondContact O-CB 3.49Å; K367-N371 PolarHBondContact O-N 3.17Å; K367-N371 PolarHBondContact O-ND2 3.42Å; K367-N371 PolarHBondContact O-OD1 3.31Å
368	L	95.6	Very high	92.6	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-60.3	-39.1	175.1	-178	75.7	0	0	0	111.5	D364 Y365 N371 R372 Q373 F374 I394 Y469 A623 A627	D364-L368 PolarHBondContact O-N 3.3Å; Y365-L368 PolarHBondContact O-N 2.9Å; L368-N371 WeakPolarHBondContact CA-OD1 3.17Å; L368-N371 PolarHBondContact O-OD1 2.84Å; L368-R372 PolarHBondContact O-N 3.46Å; L368-Q373 WeakPolarHBondContact CD1-O 3.15Å; L368-F374 HydrophobicContact CD1-CD2 4.45Å; L368-I394 HydrophobicContact CD2-CD1 3.56Å; L368-Y469 HydrophobicContact CD2-CE1 4.17Å; L368-A623 HydrophobicContact CD2-CB 4.16Å; L368-A627 HydrophobicContact CB-CB 3.86Å; L368-A627 HydrophobicContact CD1-CB 4.26Å; L368-A627 HydrophobicContact CD2-CB 3.94Å; L368-A627 HydrophobicContact CG-CB 4.2Å
369	W	94.7	Very high	93.3	Very high	18 Å²	18	36.4 Å²	36.4	7%	0.068	18%	0.175	C	C	.	.	H	α-helix	trans	-59.2	-60.5	170.6	172	-113	0	0	0	109.3	Y365 G366 K367 N371 R372 V388 L389 M465 Y469	Y365-W369 PolarHBondContact O-N 3.4Å; G366-W369 WeakPolarHBondContact O-CB 3.29Å; G366-W369 PolarHBondContact O-N 2.91Å; K367-W369 VanDerWaalsContact C-N 3.27Å; K367-W369 PolarHBondContact O-N 3.36Å; W369-N371 VanDerWaalsContact C-N 3.35Å; W369-N371 PolarHBondContact O-N 3.43Å; W369-R372 VanDerWaalsContact C-NH1 3.27Å; W369-R372 VanDerWaalsContact O-CD 3.29Å; W369-R372 WeakPolarHBondContact O-CD 3.17Å; W369-R372 PolarHBondContact O-N 3.31Å; W369-R372 PolarHBondContact O-NH1 3.24Å; W369-V388 HydrophobicContact CH2-CG1 3.76Å; W369-V388 HydrophobicContact CZ3-CG1 4.49Å; W369-L389 VanDerWaalsContact CZ3-O 3.25Å; W369-L389 WeakPolarHBondContact CZ3-O 3.37Å; W369-M465 HydrophobicContact CE3-CB 4.42Å; W369-M465 HydrophobicContact CE3-CE 4.45Å; W369-M465 HydrophobicContact CH2-CB 3.33Å; W369-M465 HydrophobicContact CH2-CE 4.17Å; W369-M465 HydrophobicContact CH2-CG 3.95Å; W369-M465 HydrophobicContact CZ2-CB 3.68Å; W369-M465 HydrophobicContact CZ3-CB 3.75Å; W369-M465 HydrophobicContact CZ3-CE 3.62Å; W369-M465 HydrophobicContact CZ3-CG 4.3Å; W369-Y469 HydrophobicContact CB-CD1 3.73Å; W369-Y469 HydrophobicContact CB-CD2 4.4Å; W369-Y469 HydrophobicContact CB-CE1 4.15Å; W369-Y469 HydrophobicContact CB-CG 3.84Å; W369-Y469 HydrophobicContact CD2-CD2 4.46Å; W369-Y469 HydrophobicContact CD2-CE2 4.47Å; W369-Y469 HydrophobicContact CE3-CD2 4.13Å; W369-Y469 HydrophobicContact CE3-CE1 4.45Å; W369-Y469 AromaticContact CE3-CE2 3.71Å; W369-Y469 HydrophobicContact CE3-CE2 3.71Å; W369-Y469 AromaticContact CE3-CZ 3.87Å; W369-Y469 HydrophobicContact CG-CG 4.47Å; W369-Y469 HydrophobicContact CZ3-CE2 4.27Å
370	E	93.9	Very high	93.8	Very high	131 Å²	131	35.8 Å²	35.8	61%	0.612	17%	0.17	S	C	*	.	H	α-helix	trans	-56.9	-40.7	-174.4	-71.2	171.1	-175.6	0	0	114.3	G366 K367	G366-E370 WeakPolarHBondContact O-CG 3.32Å; G366-E370 PolarHBondContact O-N 3.39Å; K367-E370 PolarHBondContact O-N 3.3Å
371	N	92.6	Very high	94.1	Very high	67 Å²	67	35 Å²	35	36%	0.358	17%	0.165	S	C	.	.	H	α-helix	trans	-81.2	-14.7	-176.5	70.3	21.6	0	0	0	114	K367 L368 W369 Q373	K367-N371 WeakPolarHBondContact O-CB 3.49Å; K367-N371 PolarHBondContact O-N 3.17Å; K367-N371 PolarHBondContact O-ND2 3.42Å; K367-N371 PolarHBondContact O-OD1 3.31Å; L368-N371 WeakPolarHBondContact CA-OD1 3.17Å; L368-N371 PolarHBondContact O-OD1 2.84Å; W369-N371 VanDerWaalsContact C-N 3.35Å; W369-N371 PolarHBondContact O-N 3.43Å; N371-Q373 HydrophobicContact CB-CG 4.22Å; N371-Q373 PolarHBondContact ND2-OE1 3.42Å; N371-Q373 PolarHBondContact O-N 3.33Å; N371-Q373 VanDerWaalsContact O-N 3.11Å; N371-Q373 WeakPolarHBondContact OD1-CB 3.48Å; N371-Q373 PolarHBondContact OD1-N 3.24Å
372	R	92.2	Very high	94	Very high	77 Å²	77	35.7 Å²	35.7	29%	0.291	17%	0.172	S	C	.	.			trans	55.6	23.3	179	-53.1	-70.1	-164.9	-108.7	6.3	114.1	L368 W369 C375 L389 E462	L368-R372 PolarHBondContact O-N 3.46Å; W369-R372 VanDerWaalsContact C-NH1 3.27Å; W369-R372 VanDerWaalsContact O-CD 3.29Å; W369-R372 WeakPolarHBondContact O-CD 3.17Å; W369-R372 PolarHBondContact O-N 3.31Å; W369-R372 PolarHBondContact O-NH1 3.24Å; R372-C375 PolarHBondContact O-SG 2.8Å; R372-L389 HydrophobicContact CB-CD1 4.5Å; R372-E462 IonicContact NH2-OE1 2.67Å
373	Q	90	Very high	94	Very high	57 Å²	57	42.9 Å²	42.9	27%	0.266	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	138.1	-177	-70.9	166.1	-25.5	0	0	110.8	L368 N371 C375 H391 E633 R637	L368-Q373 WeakPolarHBondContact CD1-O 3.15Å; N371-Q373 HydrophobicContact CB-CG 4.22Å; N371-Q373 PolarHBondContact ND2-OE1 3.42Å; N371-Q373 PolarHBondContact O-N 3.33Å; N371-Q373 VanDerWaalsContact O-N 3.11Å; N371-Q373 WeakPolarHBondContact OD1-CB 3.48Å; N371-Q373 PolarHBondContact OD1-N 3.24Å; Q373-C375 VanDerWaalsContact C-N 3.27Å; Q373-C375 PolarHBondContact O-N 3.14Å; Q373-H391 PolarHBondContact O-NE2 2.91Å; Q373-E633 PolarHBondContact OE1-OE1 3.42Å; Q373-R637 VanDerWaalsContact NE2-NH1 3.11Å
374	F	91.4	Very high	93.9	Very high	58 Å²	58	50.3 Å²	50.3	25%	0.254	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	20.4	-177.4	-42.9	-78	0	0	0	115	L368 D376 H391 A626 E633 F636 R637	L368-F374 HydrophobicContact CD1-CD2 4.45Å; F374-D376 PolarHBondContact O-N 3.5Å; F374-H391 VanDerWaalsContact C-CD2 3.49Å; F374-H391 PolarHBondContact O-CD2 3.4Å; F374-A626 HydrophobicContact CD2-CB 3.77Å; F374-A626 HydrophobicContact CE2-CB 3.43Å; F374-A626 VanDerWaalsContact CE2-CB 3.43Å; F374-A626 HydrophobicContact CZ-CB 4.03Å; F374-E633 HydrophobicContact CE2-CG 4.03Å; F374-E633 HydrophobicContact CZ-CG 4.23Å; F374-F636 HydrophobicContact CD1-CB 4.38Å; F374-F636 HydrophobicContact CE1-CB 3.54Å; F374-F636 HydrophobicContact CZ-CB 4.01Å; F374-R637 HydrophobicContact CE1-CG 4.25Å; F374-R637 HydrophobicContact CZ-CG 3.93Å
375	C	95.3	Very high	93.7	Very high	21 Å²	21	56.4 Å²	56.4	14%	0.142	26%	0.26	C	S	.	.			trans	-57.8	136.3	171.6	-70.7	0	0	0	0	110.7	R372 Q373 L389 G390 H391 L448	R372-C375 PolarHBondContact O-SG 2.8Å; Q373-C375 VanDerWaalsContact C-N 3.27Å; Q373-C375 PolarHBondContact O-N 3.14Å; C375-L389 HydrophobicContact CB-CB 4.1Å; C375-G390 VanDerWaalsContact CA-O 3.31Å; C375-G390 WeakPolarHBondContact CA-O 3.18Å; C375-G390 WeakPolarHBondContact CB-O 3.41Å; C375-H391 PolarHBondContact N-NE2 3.23Å; C375-H391 PolarHBondContact SG-CE1 3.49Å; C375-H391 PolarHBondContact SG-NE2 3.18Å; C375-L448 WeakPolarHBondContact O-CD2 3.49Å
376	D	94.8	Very high	93.7	Very high	40 Å²	40	60.7 Å²	60.7	21%	0.214	28%	0.28	C	S	.	.			trans	-129	-0.9	-174.5	60.6	-5.2	0	0	0	112.5	F374 G390 H391 I392 L449	F374-D376 PolarHBondContact O-N 3.5Å; D376-G390 PolarHBondContact N-O 3.38Å; D376-G390 VanDerWaalsContact N-O 3.09Å; D376-H391 WeakPolarHBondContact OD1-CA 3.41Å; D376-I392 HydrophobicContact CB-CD1 4.45Å; D376-I392 WeakPolarHBondContact OD1-CG1 3.48Å; D376-I392 PolarHBondContact OD1-N 3.32Å; D376-I392 WeakPolarHBondContact OD2-CB 3.24Å; D376-L449 PolarHBondContact O-N 3.39Å
377	V	96.6	Very high	93.8	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143	174.5	59.2	0	0	0	0	111.2	F379 G390 I392 L449 V451	V377-F379 HydrophobicContact CG1-CE2 3.75Å; V377-F379 HydrophobicContact CG1-CZ 4.02Å; V377-F379 HydrophobicContact CG2-CD2 4.5Å; V377-F379 HydrophobicContact CG2-CE1 4.18Å; V377-F379 HydrophobicContact CG2-CE2 4.01Å; V377-F379 HydrophobicContact CG2-CZ 3.82Å; V377-G390 VanDerWaalsContact CG1-C 3.47Å; V377-G390 WeakPolarHBondContact CG1-O 3.27Å; V377-G390 PolarHBondContact N-O 2.97Å; V377-G390 PolarHBondContact O-N 2.91Å; V377-I392 HydrophobicContact CB-CD1 4.25Å; V377-I392 HydrophobicContact CB-CG1 3.71Å; V377-I392 HydrophobicContact CG1-CG1 3.81Å; V377-L449 WeakPolarHBondContact CA-O 3.39Å; V377-L449 WeakPolarHBondContact CG2-O 3.27Å; V377-V451 HydrophobicContact CG2-CB 4.45Å; V377-V451 HydrophobicContact CG2-CG2 3.73Å
378	E	96.8	Very high	93.9	Very high	25 Å²	25	62.7 Å²	62.7	12%	0.117	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.2	171.6	-175.3	172.6	-112.7	0	0	109.5	R387 L389 L448 L449 E450 V451	E378-R387 HydrophobicContact CG-CB 4.15Å; E378-R387 HydrophobicContact CG-CG 4.33Å; E378-R387 WeakPolarHBondContact OE1-CD 3.35Å; E378-R387 IonicContact OE1-NH1 3.67Å; E378-R387 IonicContact OE2-CZ 3.24Å; E378-R387 IonicContact OE2-NE 2.84Å; E378-R387 IonicContact OE2-NH1 2.73Å; E378-R387 PolarHBondContact OE2-NH1 3.22Å; E378-L389 HydrophobicContact CB-CD2 4.11Å; E378-L389 HydrophobicContact CG-CD2 4.15Å; E378-L448 HydrophobicContact CB-CB 4.45Å; E378-L448 HydrophobicContact CB-CD1 4.38Å; E378-L449 PolarHBondContact N-O 2.96Å; E378-E450 CarbonylContact O-C 3.6Å; E378-E450 WeakPolarHBondContact O-CA 3.03Å; E378-V451 PolarHBondContact O-N 3.03Å
379	F	97.2	Very high	93.9	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	127	175.8	-62.4	-81.3	0	0	0	110.2	V377 L381 R387 V388 V395 L402 I406 V451 I453 F461 M465	V377-F379 HydrophobicContact CG1-CE2 3.75Å; V377-F379 HydrophobicContact CG1-CZ 4.02Å; V377-F379 HydrophobicContact CG2-CD2 4.5Å; V377-F379 HydrophobicContact CG2-CE1 4.18Å; V377-F379 HydrophobicContact CG2-CE2 4.01Å; V377-F379 HydrophobicContact CG2-CZ 3.82Å; F379-L381 HydrophobicContact CB-CD2 4.05Å; F379-L381 HydrophobicContact CB-CG 4.39Å; F379-R387 WeakPolarHBondContact O-CA 3.31Å; F379-V388 WeakPolarHBondContact CD2-O 3.29Å; F379-V388 PolarHBondContact N-O 2.95Å; F379-V388 PolarHBondContact O-N 3.33Å; F379-V395 HydrophobicContact CE2-CG2 4.4Å; F379-V395 HydrophobicContact CZ-CG1 4.05Å; F379-V395 HydrophobicContact CZ-CG2 4.43Å; F379-L402 HydrophobicContact CE1-CD2 4.04Å; F379-I406 HydrophobicContact CZ-CD1 4.31Å; F379-V451 CarbonylContact C-O 3.52Å; F379-V451 VanDerWaalsContact CA-O 3.29Å; F379-V451 WeakPolarHBondContact CA-O 3.5Å; F379-V451 HydrophobicContact CD1-CB 3.78Å; F379-V451 HydrophobicContact CD1-CG1 3.96Å; F379-V451 HydrophobicContact CE1-CB 3.96Å; F379-V451 HydrophobicContact CE1-CG1 4Å; F379-V451 HydrophobicContact CE1-CG2 4.36Å; F379-I453 HydrophobicContact CD1-CD1 3.73Å; F379-I453 HydrophobicContact CE1-CD1 4.31Å; F379-F461 HydrophobicContact CB-CE1 3.91Å; F379-F461 HydrophobicContact CB-CZ 4.05Å; F379-F461 AromaticContact CD1-CZ 3.96Å; F379-F461 HydrophobicContact CD1-CZ 3.96Å; F379-F461 AromaticContact CD2-CE1 3.89Å; F379-F461 HydrophobicContact CD2-CE1 3.89Å; F379-F461 AromaticContact CD2-CZ 3.98Å; F379-F461 HydrophobicContact CD2-CZ 3.98Å; F379-F461 HydrophobicContact CE1-CZ 4.44Å; F379-F461 HydrophobicContact CE2-CZ 4.45Å; F379-F461 AromaticContact CG-CE1 3.86Å; F379-F461 HydrophobicContact CG-CE1 3.86Å; F379-F461 AromaticContact CG-CZ 3.71Å; F379-F461 HydrophobicContact CG-CZ 3.71Å; F379-M465 HydrophobicContact CD2-CE 4.46Å; F379-M465 HydrophobicContact CE2-CE 4.05Å; F379-M465 HydrophobicContact CE2-SD 4.45Å
380	I	96.6	Very high	94	Very high	21 Å²	21	64.1 Å²	64.1	11%	0.108	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	115.2	178.2	-55.2	172.7	0	0	0	108.3	E385 E386 E450 V451 S452 I453	I380-E385 HydrophobicContact CG2-CB 3.69Å; I380-E385 HydrophobicContact CG2-CG 4.01Å; I380-E386 CarbonylContact C-O 3.53Å; I380-E386 WeakPolarHBondContact CA-O 3.34Å; I380-E450 HydrophobicContact CD1-CB 4.19Å; I380-E450 HydrophobicContact CD1-CG 4.38Å; I380-V451 PolarHBondContact N-O 3.34Å; I380-S452 WeakPolarHBondContact O-CA 3.29Å; I380-I453 PolarHBondContact O-N 3.37Å
381	L	96.1	Very high	94.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.7	-162.2	-56.8	178.3	0	0	0	112.7	F379 E385 E386 V388 I453 A456 A458 F461	F379-L381 HydrophobicContact CB-CD2 4.05Å; F379-L381 HydrophobicContact CB-CG 4.39Å; L381-E385 WeakPolarHBondContact O-CA 3.34Å; L381-E385 PolarHBondContact O-N 2.85Å; L381-E386 PolarHBondContact N-O 3.48Å; L381-E386 PolarHBondContact O-N 3.19Å; L381-V388 HydrophobicContact CD1-CB 4.05Å; L381-V388 HydrophobicContact CD1-CG2 3.52Å; L381-I453 WeakPolarHBondContact CA-O 3.46Å; L381-I453 HydrophobicContact CD2-CB 3.91Å; L381-I453 HydrophobicContact CD2-CD1 4.32Å; L381-A456 HydrophobicContact CD2-CB 4.43Å; L381-A458 HydrophobicContact CD1-CB 4.28Å; L381-F461 HydrophobicContact CD1-CB 3.69Å; L381-F461 HydrophobicContact CD1-CD1 3.44Å; L381-F461 VanDerWaalsContact CD1-CD1 3.44Å; L381-F461 HydrophobicContact CD1-CD2 4.48Å; L381-F461 HydrophobicContact CD1-CE1 4.15Å; L381-F461 HydrophobicContact CD1-CG 3.63Å; L381-F461 HydrophobicContact CD2-CD1 4.15Å; L381-F461 HydrophobicContact CD2-CD2 4.08Å; L381-F461 HydrophobicContact CD2-CE1 4.28Å; L381-F461 HydrophobicContact CD2-CE2 4.23Å; L381-F461 HydrophobicContact CD2-CG 4.03Å; L381-F461 HydrophobicContact CD2-CZ 4.33Å; L381-F461 HydrophobicContact CG-CD1 4.41Å
382	G	91.4	Very high	94.3	Very high	15 Å²	15	54.9 Å²	54.9	16%	0.155	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	-170.4	174.7	0	0	0	0	0	114.3	R384 I453 A456	G382-R384 VanDerWaalsContact C-N 3.29Å; G382-I453 PolarHBondContact N-O 3.17Å; G382-A456 WeakPolarHBondContact CA-O 3.48Å; G382-A456 PolarHBondContact N-O 3.29Å
383	E	88.3	Confident	94.5	Very high	196 Å²	196	51.4 Å²	51.4	92%	0.916	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-20.6	175.4	-61.7	-170.7	160.1	0	0	112.8	E385	E383-E385 VanDerWaalsContact C-N 3.26Å; E383-E385 PolarHBondContact O-N 3.41Å
384	R	89.1	Confident	94.8	Very high	213 Å²	213	48.7 Å²	48.7	80%	0.804	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-2.2	179.1	-65.6	-177.1	-179	178.5	2.4	113.5	G382 E386	G382-R384 VanDerWaalsContact C-N 3.29Å; R384-E386 HydrophobicContact CB-CG 4.1Å; R384-E386 PolarHBondContact O-N 3.19Å
385	E	91.8	Very high	95.1	Very high	131 Å²	131	46 Å²	46	61%	0.612	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	40.8	-178.5	-60.4	-168.2	159.5	0	0	113.1	I380 L381 E383	I380-E385 HydrophobicContact CG2-CB 3.69Å; I380-E385 HydrophobicContact CG2-CG 4.01Å; L381-E385 WeakPolarHBondContact O-CA 3.34Å; L381-E385 PolarHBondContact O-N 2.85Å; E383-E385 VanDerWaalsContact C-N 3.26Å; E383-E385 PolarHBondContact O-N 3.41Å
386	E	95.9	Very high	95.1	Very high	89 Å²	89	45 Å²	45	42%	0.416	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	143.7	176.2	-69.7	-178	100.9	0	0	110.3	I380 L381 R384 A458	I380-E386 CarbonylContact C-O 3.53Å; I380-E386 WeakPolarHBondContact CA-O 3.34Å; L381-E386 PolarHBondContact N-O 3.48Å; L381-E386 PolarHBondContact O-N 3.19Å; R384-E386 HydrophobicContact CB-CG 4.1Å; R384-E386 PolarHBondContact O-N 3.19Å; E386-A458 HydrophobicContact CB-CB 3.77Å; E386-A458 HydrophobicContact CG-CB 4.31Å; E386-A458 WeakPolarHBondContact OE2-CB 3.31Å
387	R	95.1	Very high	95.2	Very high	150 Å²	150	43.6 Å²	43.6	57%	0.566	20%	0.197	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.9	-170.1	-66.8	173.8	179.1	-132	3.1	111.2	E378 F379	E378-R387 HydrophobicContact CG-CB 4.15Å; E378-R387 HydrophobicContact CG-CG 4.33Å; E378-R387 WeakPolarHBondContact OE1-CD 3.35Å; E378-R387 IonicContact OE1-NH1 3.67Å; E378-R387 IonicContact OE2-CZ 3.24Å; E378-R387 IonicContact OE2-NE 2.84Å; E378-R387 IonicContact OE2-NH1 2.73Å; E378-R387 PolarHBondContact OE2-NH1 3.22Å; F379-R387 WeakPolarHBondContact O-CA 3.31Å
388	V	95.8	Very high	95.1	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	122	175.1	176.7	0	0	0	0	109.4	W369 F379 L381 F461 E462 M465	W369-V388 HydrophobicContact CH2-CG1 3.76Å; W369-V388 HydrophobicContact CZ3-CG1 4.49Å; F379-V388 WeakPolarHBondContact CD2-O 3.29Å; F379-V388 PolarHBondContact N-O 2.95Å; F379-V388 PolarHBondContact O-N 3.33Å; L381-V388 HydrophobicContact CD1-CB 4.05Å; L381-V388 HydrophobicContact CD1-CG2 3.52Å; V388-F461 HydrophobicContact CB-CD1 4.19Å; V388-F461 HydrophobicContact CB-CE1 4.28Å; V388-F461 HydrophobicContact CG1-CD1 4.08Å; V388-F461 HydrophobicContact CG1-CE1 4.11Å; V388-F461 HydrophobicContact CG2-CD1 4.35Å; V388-E462 HydrophobicContact CG1-CG 4.34Å; V388-E462 HydrophobicContact CG2-CG 3.97Å; V388-M465 HydrophobicContact CG1-CG 4.48Å
389	L	96.7	Very high	95.1	Very high	51 Å²	51	43.1 Å²	43.1	27%	0.267	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	154.5	178	-64.7	175.6	0	0	0	111.7	W369 R372 C375 E378 L448	W369-L389 VanDerWaalsContact CZ3-O 3.25Å; W369-L389 WeakPolarHBondContact CZ3-O 3.37Å; R372-L389 HydrophobicContact CB-CD1 4.5Å; C375-L389 HydrophobicContact CB-CB 4.1Å; E378-L389 HydrophobicContact CB-CD2 4.11Å; E378-L389 HydrophobicContact CG-CD2 4.15Å; L389-L448 HydrophobicContact CD2-CD1 3.59Å
390	G	96.3	Very high	95	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	-175.4	173.3	0	0	0	0	0	114.3	C375 D376 V377	C375-G390 VanDerWaalsContact CA-O 3.31Å; C375-G390 WeakPolarHBondContact CA-O 3.18Å; C375-G390 WeakPolarHBondContact CB-O 3.41Å; D376-G390 PolarHBondContact N-O 3.38Å; D376-G390 VanDerWaalsContact N-O 3.09Å; V377-G390 VanDerWaalsContact CG1-C 3.47Å; V377-G390 WeakPolarHBondContact CG1-O 3.27Å; V377-G390 PolarHBondContact N-O 2.97Å; V377-G390 PolarHBondContact O-N 2.91Å
391	H	97.1	Very high	94.9	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	23%	0.226	C	C	.	.			trans	-117.9	116.8	-179.7	-56.3	91.2	0	0	0	109.8	Q373 F374 C375 D376 A393 I394 V395 Y469 A623	Q373-H391 PolarHBondContact O-NE2 2.91Å; F374-H391 VanDerWaalsContact C-CD2 3.49Å; F374-H391 PolarHBondContact O-CD2 3.4Å; C375-H391 PolarHBondContact N-NE2 3.23Å; C375-H391 PolarHBondContact SG-CE1 3.49Å; C375-H391 PolarHBondContact SG-NE2 3.18Å; D376-H391 WeakPolarHBondContact OD1-CA 3.41Å; H391-A393 PolarHBondContact O-N 3.46Å; H391-I394 PolarHBondContact O-N 3.44Å; H391-I394 VanDerWaalsContact O-N 3.16Å; H391-V395 WeakPolarHBondContact O-CG2 3.48Å; H391-V395 PolarHBondContact O-N 3.5Å; H391-Y469 WeakPolarHBondContact CB-OH 3.48Å; H391-Y469 PolarHBondContact N-OH 3.43Å; H391-Y469 AromaticContact ND1-CE1 3.44Å; H391-Y469 WeakPolarHBondContact ND1-CE1 3.45Å; H391-Y469 AromaticContact ND1-CZ 3.51Å; H391-Y469 PolarHBondContact ND1-OH 2.99Å; H391-A623 HydrophobicContact CB-CB 4.13Å
392	I	96.7	Very high	95	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-53.9	-44.2	179.8	-68.3	172.9	0	0	0	109.8	D376 V377 I394 V395 T396 I406 L449 F606	D376-I392 HydrophobicContact CB-CD1 4.45Å; D376-I392 WeakPolarHBondContact OD1-CG1 3.48Å; D376-I392 PolarHBondContact OD1-N 3.32Å; D376-I392 WeakPolarHBondContact OD2-CB 3.24Å; V377-I392 HydrophobicContact CB-CD1 4.25Å; V377-I392 HydrophobicContact CB-CG1 3.71Å; V377-I392 HydrophobicContact CG1-CG1 3.81Å; I392-I394 VanDerWaalsContact C-N 3.31Å; I392-I394 PolarHBondContact O-N 2.9Å; I392-V395 PolarHBondContact O-N 3.38Å; I392-T396 HydrophobicContact CG2-CG2 3.65Å; I392-T396 VanDerWaalsContact O-CB 3.27Å; I392-T396 WeakPolarHBondContact O-CB 3.28Å; I392-T396 WeakPolarHBondContact O-CG2 3.31Å; I392-T396 PolarHBondContact O-N 2.98Å; I392-T396 PolarHBondContact O-OG1 3.33Å; I392-I406 HydrophobicContact CD1-CG2 4.39Å; I392-I406 HydrophobicContact CG1-CD1 4.43Å; I392-I406 HydrophobicContact CG1-CG2 4.36Å; I392-I406 HydrophobicContact CG2-CG2 4.09Å; I392-L449 HydrophobicContact CD1-CD2 4.01Å; I392-F606 HydrophobicContact CG2-CB 4.03Å; I392-F606 HydrophobicContact CG2-CD1 3.33Å; I392-F606 HydrophobicContact CG2-CE1 3.94Å; I392-F606 HydrophobicContact CG2-CG 3.76Å
393	A	95.6	Very high	95.2	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.033	23%	0.225	C	C	.	.	H	α-helix	trans	-55.5	-42.2	-178.7	0	0	0	0	0	113.3	H391 A397 H621 I624	H391-A393 PolarHBondContact O-N 3.46Å; A393-A397 WeakPolarHBondContact O-CB 3.26Å; A393-H621 HydrophobicContact CB-CB 3.79Å; A393-I624 HydrophobicContact CB-CD1 4.16Å; A393-I624 HydrophobicContact CB-CG1 4.3Å
394	I	96.8	Very high	95.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-81.1	-47.7	-179.8	-66.1	173.5	0	0	0	110	Y365 L368 H391 I392 T396 A397 R398 Y469	Y365-I394 HydrophobicContact CD1-CD1 4.09Å; Y365-I394 HydrophobicContact CG-CD1 4.3Å; L368-I394 HydrophobicContact CD2-CD1 3.56Å; H391-I394 PolarHBondContact O-N 3.44Å; H391-I394 VanDerWaalsContact O-N 3.16Å; I392-I394 VanDerWaalsContact C-N 3.31Å; I392-I394 PolarHBondContact O-N 2.9Å; I394-T396 VanDerWaalsContact C-N 3.35Å; I394-T396 PolarHBondContact O-N 2.83Å; I394-A397 PolarHBondContact O-N 3.24Å; I394-R398 HydrophobicContact CG2-CG 4.22Å; I394-R398 WeakPolarHBondContact O-CB 3.41Å; I394-R398 WeakPolarHBondContact O-CG 3.42Å; I394-R398 PolarHBondContact O-N 3.41Å; I394-Y469 HydrophobicContact CB-CE1 4.26Å; I394-Y469 HydrophobicContact CD1-CD1 3.55Å; I394-Y469 HydrophobicContact CD1-CE1 3.37Å; I394-Y469 HydrophobicContact CD1-CG 4.48Å; I394-Y469 HydrophobicContact CG1-CE1 4.38Å; I394-Y469 HydrophobicContact CG2-CD1 4.09Å; I394-Y469 HydrophobicContact CG2-CD2 3.96Å; I394-Y469 HydrophobicContact CG2-CE1 4.14Å; I394-Y469 HydrophobicContact CG2-CE2 4Å; I394-Y469 HydrophobicContact CG2-CG 4.03Å
395	V	97	Very high	95.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.5	-43.1	-176.1	174.4	0	0	0	0	111.9	F379 H391 I392 R398 C399 L402 I406 M465 L468	F379-V395 HydrophobicContact CE2-CG2 4.4Å; F379-V395 HydrophobicContact CZ-CG1 4.05Å; F379-V395 HydrophobicContact CZ-CG2 4.43Å; H391-V395 WeakPolarHBondContact O-CG2 3.48Å; H391-V395 PolarHBondContact O-N 3.5Å; I392-V395 PolarHBondContact O-N 3.38Å; V395-R398 PolarHBondContact O-N 3.49Å; V395-C399 PolarHBondContact O-N 2.97Å; V395-L402 HydrophobicContact CG1-CB 3.51Å; V395-L402 HydrophobicContact CG1-CD1 3.54Å; V395-L402 HydrophobicContact CG1-CG 4.11Å; V395-I406 HydrophobicContact CB-CD1 4.36Å; V395-I406 HydrophobicContact CG1-CD1 3.95Å; V395-M465 HydrophobicContact CG2-CE 3.67Å; V395-M465 HydrophobicContact CG2-SD 4.05Å; V395-L468 HydrophobicContact CG1-CD1 4.4Å; V395-L468 HydrophobicContact CG2-CD1 4.47Å
396	T	96.3	Very high	96.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-74.7	-25	-178.3	61.2	0	0	0	0	113.7	I392 I394 R403 I406 F606	I392-T396 HydrophobicContact CG2-CG2 3.65Å; I392-T396 VanDerWaalsContact O-CB 3.27Å; I392-T396 WeakPolarHBondContact O-CB 3.28Å; I392-T396 WeakPolarHBondContact O-CG2 3.31Å; I392-T396 PolarHBondContact O-N 2.98Å; I392-T396 PolarHBondContact O-OG1 3.33Å; I394-T396 VanDerWaalsContact C-N 3.35Å; I394-T396 PolarHBondContact O-N 2.83Å; T396-R403 HydrophobicContact CG2-CB 4.28Å; T396-R403 HydrophobicContact CG2-CG 4.21Å; T396-R403 PolarHBondContact O-NH1 3.13Å; T396-I406 HydrophobicContact CG2-CB 4.4Å; T396-I406 HydrophobicContact CG2-CD1 3.58Å; T396-I406 HydrophobicContact CG2-CG2 4.26Å; T396-F606 HydrophobicContact CG2-CD1 4.33Å; T396-F606 HydrophobicContact CG2-CD2 4.12Å; T396-F606 HydrophobicContact CG2-CE1 4.01Å; T396-F606 HydrophobicContact CG2-CE2 3.74Å; T396-F606 HydrophobicContact CG2-CG 4.41Å; T396-F606 HydrophobicContact CG2-CZ 3.71Å; T396-F606 WeakPolarHBondContact OG1-CD2 3.42Å
397	A	95.9	Very high	96.1	Very high	12 Å²	12	33.2 Å²	33.2	10%	0.099	15%	0.147	C	C	.	.	H	α-helix	trans	-72.6	-40.2	172.2	0	0	0	0	0	111.1	A393 I394 M595 C598	A393-A397 WeakPolarHBondContact O-CB 3.26Å; I394-A397 PolarHBondContact O-N 3.24Å; A397-M595 HydrophobicContact CB-SD 3.87Å; A397-C598 HydrophobicContact CB-CB 3.87Å
398	R	95.5	Very high	96.1	Very high	14 Å²	14	30.4 Å²	30.4	5%	0.053	14%	0.141	C	C	.	.	H	α-helix	trans	-93.7	-20	-170.6	-59	-63.4	-45.4	-85.1	7.7	114.8	I394 V395 L468 D471 L591 D594	I394-R398 HydrophobicContact CG2-CG 4.22Å; I394-R398 WeakPolarHBondContact O-CB 3.41Å; I394-R398 WeakPolarHBondContact O-CG 3.42Å; I394-R398 PolarHBondContact O-N 3.41Å; V395-R398 PolarHBondContact O-N 3.49Å; R398-L468 HydrophobicContact CB-CB 4.13Å; R398-L468 HydrophobicContact CB-CD2 3.75Å; R398-L468 HydrophobicContact CB-CG 4.39Å; R398-L468 HydrophobicContact CG-CB 4.48Å; R398-L468 WeakPolarHBondContact CG-O 3.34Å; R398-L468 PolarHBondContact NH1-O 3.11Å; R398-D471 IonicContact CZ-OD1 3.17Å; R398-D471 IonicContact NH1-OD1 3.98Å; R398-D471 IonicContact NH2-OD1 2.95Å; R398-D471 PolarHBondContact NH2-OD1 3.07Å; R398-L591 VanDerWaalsContact CZ-CA 3.49Å; R398-L591 VanDerWaalsContact NH1-CD1 3.32Å; R398-D594 WeakPolarHBondContact CD-OD2 3.35Å; R398-D594 IonicContact CZ-OD2 3.21Å; R398-D594 IonicContact NE-OD2 2.72Å; R398-D594 PolarHBondContact NE-OD2 2.56Å; R398-D594 IonicContact NH2-OD2 3.42Å
399	C	96.2	Very high	96.1	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.007	14%	0.144	C	C	.	.			trans	-139.5	106	-176.9	-175.7	0	0	0	0	112	V395 W401 L402 R403 L468 L499	V395-C399 PolarHBondContact O-N 2.97Å; C399-W401 PolarHBondContact O-N 3.23Å; C399-L402 HydrophobicContact CB-CB 3.99Å; C399-L402 HydrophobicContact CB-CD1 3.92Å; C399-L402 HydrophobicContact CB-CG 4.15Å; C399-L402 PolarHBondContact O-N 3.49Å; C399-L402 PolarHBondContact SG-N 3.39Å; C399-L402 VanDerWaalsContact SG-N 3.42Å; C399-R403 WeakPolarHBondContact O-CB 3.33Å; C399-R403 PolarHBondContact O-N 3.29Å; C399-L468 HydrophobicContact CB-CD1 4.28Å; C399-L468 HydrophobicContact CB-CD2 4.21Å; C399-L499 HydrophobicContact CB-CD2 4.18Å
400	Q	94.4	Very high	95.9	Very high	120 Å²	120	31.3 Å²	31.3	56%	0.561	14%	0.143	S	C	*	.	H	α-helix	trans	-63.5	-30.2	178.4	-67.7	-61.5	-22	0	0	113.1	R403 K404	Q400-R403 WeakPolarHBondContact O-CB 3.18Å; Q400-K404 WeakPolarHBondContact O-CG 3.22Å; Q400-K404 PolarHBondContact O-N 3.04Å
401	W	96.1	Very high	95.7	Very high	54 Å²	54	35.1 Å²	35.1	21%	0.205	16%	0.163	C	C	.	.	H	α-helix	trans	-68.4	-48.8	176.1	-173	101	0	0	0	111.4	C399 R403 K404 K405 I453 E455 F497	C399-W401 PolarHBondContact O-N 3.23Å; W401-R403 VanDerWaalsContact C-N 3.29Å; W401-R403 PolarHBondContact O-N 3.27Å; W401-K404 WeakPolarHBondContact O-CB 3.15Å; W401-K404 PolarHBondContact O-N 2.97Å; W401-K405 HydrophobicContact CD2-CG 4.37Å; W401-K405 HydrophobicContact CE3-CG 3.96Å; W401-K405 HydrophobicContact CH2-CD 4.22Å; W401-K405 HydrophobicContact CH2-CG 3.92Å; W401-K405 HydrophobicContact CZ2-CD 4.44Å; W401-K405 HydrophobicContact CZ2-CG 4.32Å; W401-K405 HydrophobicContact CZ3-CD 4.5Å; W401-K405 HydrophobicContact CZ3-CG 3.71Å; W401-K405 PolarHBondContact O-N 2.93Å; W401-I453 HydrophobicContact CH2-CG1 4.39Å; W401-I453 HydrophobicContact CH2-CG2 4.06Å; W401-I453 HydrophobicContact CZ3-CD1 4.05Å; W401-I453 HydrophobicContact CZ3-CG1 4.33Å; W401-I453 HydrophobicContact CZ3-CG2 4.48Å; W401-E455 WeakPolarHBondContact CH2-OE1 3.49Å; W401-E455 WeakPolarHBondContact CZ2-OE1 3.3Å; W401-F497 HydrophobicContact CB-CB 4.32Å; W401-F497 WeakPolarHBondContact CB-O 3.32Å; W401-F497 AromaticContact CD2-CD1 3.89Å; W401-F497 HydrophobicContact CD2-CD1 3.89Å; W401-F497 HydrophobicContact CD2-CE1 4.32Å; W401-F497 HydrophobicContact CD2-CG 4.29Å; W401-F497 AromaticContact CE3-CD1 3.77Å; W401-F497 HydrophobicContact CE3-CD1 3.77Å; W401-F497 HydrophobicContact CE3-CD2 4.32Å; W401-F497 AromaticContact CE3-CE1 3.9Å; W401-F497 HydrophobicContact CE3-CE1 3.9Å; W401-F497 HydrophobicContact CE3-CE2 4.43Å; W401-F497 HydrophobicContact CE3-CG 4.03Å; W401-F497 HydrophobicContact CE3-CZ 4.24Å; W401-F497 HydrophobicContact CG-CD1 4.44Å; W401-F497 HydrophobicContact CH2-CD1 4.19Å; W401-F497 AromaticContact CH2-CE1 3.64Å; W401-F497 HydrophobicContact CH2-CE1 3.64Å; W401-F497 HydrophobicContact CH2-CZ 4.13Å; W401-F497 HydrophobicContact CZ2-CD1 4.3Å; W401-F497 HydrophobicContact CZ2-CE1 4.08Å; W401-F497 AromaticContact CZ3-CD1 3.93Å; W401-F497 HydrophobicContact CZ3-CD1 3.93Å; W401-F497 AromaticContact CZ3-CE1 3.55Å; W401-F497 HydrophobicContact CZ3-CE1 3.55Å; W401-F497 HydrophobicContact CZ3-CE2 4.25Å; W401-F497 HydrophobicContact CZ3-CG 4.47Å; W401-F497 AromaticContact CZ3-CZ 3.74Å; W401-F497 HydrophobicContact CZ3-CZ 3.74Å
402	L	96.6	Very high	95.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.3	-34.6	176.7	-70	170.9	0	0	0	111.5	F379 V395 C399 K404 K405 I406 I453 F461 L464 L468 F497	F379-L402 HydrophobicContact CE1-CD2 4.04Å; V395-L402 HydrophobicContact CG1-CB 3.51Å; V395-L402 HydrophobicContact CG1-CD1 3.54Å; V395-L402 HydrophobicContact CG1-CG 4.11Å; C399-L402 HydrophobicContact CB-CB 3.99Å; C399-L402 HydrophobicContact CB-CD1 3.92Å; C399-L402 HydrophobicContact CB-CG 4.15Å; C399-L402 PolarHBondContact O-N 3.49Å; C399-L402 PolarHBondContact SG-N 3.39Å; C399-L402 VanDerWaalsContact SG-N 3.42Å; L402-K404 VanDerWaalsContact C-N 3.33Å; L402-K404 PolarHBondContact O-N 3.05Å; L402-K405 PolarHBondContact O-N 3.11Å; L402-K405 VanDerWaalsContact O-N 3.14Å; L402-I406 WeakPolarHBondContact O-CG1 3.08Å; L402-I406 PolarHBondContact O-N 3.43Å; L402-I453 HydrophobicContact CD2-CD1 3.57Å; L402-F461 HydrophobicContact CD2-CE2 4.32Å; L402-F461 HydrophobicContact CD2-CZ 4.48Å; L402-L464 HydrophobicContact CD1-CD2 4.44Å; L402-L468 HydrophobicContact CD1-CD1 3.89Å; L402-F497 HydrophobicContact CD1-CD2 4.4Å; L402-F497 HydrophobicContact CD1-CE2 4.46Å; L402-F497 HydrophobicContact CD2-CE2 4.21Å; L402-F497 HydrophobicContact CG-CD2 4.36Å; L402-F497 HydrophobicContact CG-CE2 4.43Å
403	R	96.4	Very high	95	Very high	39 Å²	39	45.1 Å²	45.1	15%	0.147	20%	0.203	C	C	.	.	H	α-helix	trans	-52.8	-48.9	170.5	-174.5	-173.2	-172.1	113.8	-9	112.3	T396 C399 Q400 W401 K405 I406 L407 G602 E605 F606	T396-R403 HydrophobicContact CG2-CB 4.28Å; T396-R403 HydrophobicContact CG2-CG 4.21Å; T396-R403 PolarHBondContact O-NH1 3.13Å; C399-R403 WeakPolarHBondContact O-CB 3.33Å; C399-R403 PolarHBondContact O-N 3.29Å; Q400-R403 WeakPolarHBondContact O-CB 3.18Å; W401-R403 VanDerWaalsContact C-N 3.29Å; W401-R403 PolarHBondContact O-N 3.27Å; R403-K405 VanDerWaalsContact C-N 3.33Å; R403-K405 PolarHBondContact O-N 2.89Å; R403-I406 PolarHBondContact O-N 3.3Å; R403-L407 HydrophobicContact CG-CD1 4.27Å; R403-L407 WeakPolarHBondContact O-CG 3.31Å; R403-L407 PolarHBondContact O-N 2.86Å; R403-G602 VanDerWaalsContact CZ-O 3.23Å; R403-G602 PolarHBondContact NH1-O 2.83Å; R403-G602 PolarHBondContact NH2-O 2.84Å; R403-E605 IonicContact CZ-OE1 3.11Å; R403-E605 IonicContact NE-OE1 2.74Å; R403-E605 PolarHBondContact NE-OE1 2.77Å; R403-E605 VanDerWaalsContact NE-OE1 3.15Å; R403-E605 IonicContact NH2-OE1 3.74Å; R403-E605 PolarHBondContact NH2-OE1 2.8Å; R403-F606 HydrophobicContact CG-CE2 4.12Å; R403-F606 HydrophobicContact CG-CZ 4.07Å
404	K	96.2	Very high	94.5	Very high	139 Å²	139	52.7 Å²	52.7	60%	0.604	23%	0.231	S	C	*	.	H	α-helix	trans	-62.1	-40.2	177.9	-70.1	175.4	-177.2	-179.9	0	112.1	Q400 W401 L402 L407 Q408	Q400-K404 WeakPolarHBondContact O-CG 3.22Å; Q400-K404 PolarHBondContact O-N 3.04Å; W401-K404 WeakPolarHBondContact O-CB 3.15Å; W401-K404 PolarHBondContact O-N 2.97Å; L402-K404 VanDerWaalsContact C-N 3.33Å; L402-K404 PolarHBondContact O-N 3.05Å; K404-L407 PolarHBondContact O-N 3.36Å; K404-Q408 VanDerWaalsContact O-CG 3.26Å; K404-Q408 WeakPolarHBondContact O-CG 3.27Å; K404-Q408 PolarHBondContact O-N 3.06Å
405	K	96.1	Very high	94	Very high	55 Å²	55	58.4 Å²	58.4	24%	0.239	26%	0.257	C	S	.	.	H	α-helix	trans	-65.8	-41.6	177.5	-69.4	-72.3	-171.9	155.1	0	112.3	W401 L402 R403 Q408 A409 V451 E455	W401-K405 HydrophobicContact CD2-CG 4.37Å; W401-K405 HydrophobicContact CE3-CG 3.96Å; W401-K405 HydrophobicContact CH2-CD 4.22Å; W401-K405 HydrophobicContact CH2-CG 3.92Å; W401-K405 HydrophobicContact CZ2-CD 4.44Å; W401-K405 HydrophobicContact CZ2-CG 4.32Å; W401-K405 HydrophobicContact CZ3-CD 4.5Å; W401-K405 HydrophobicContact CZ3-CG 3.71Å; W401-K405 PolarHBondContact O-N 2.93Å; L402-K405 PolarHBondContact O-N 3.11Å; L402-K405 VanDerWaalsContact O-N 3.14Å; R403-K405 VanDerWaalsContact C-N 3.33Å; R403-K405 PolarHBondContact O-N 2.89Å; K405-Q408 PolarHBondContact O-N 3.18Å; K405-A409 PolarHBondContact O-N 3.07Å; K405-V451 HydrophobicContact CB-CG1 3.92Å; K405-E455 IonicContact NZ-OE1 2.71Å
406	I	96.3	Very high	93.4	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-45.1	175.9	-73.5	166.5	0	0	0	110.8	F379 I392 V395 T396 L402 R403 Q408 A409 R410 L449 V451 F606	F379-I406 HydrophobicContact CZ-CD1 4.31Å; I392-I406 HydrophobicContact CD1-CG2 4.39Å; I392-I406 HydrophobicContact CG1-CD1 4.43Å; I392-I406 HydrophobicContact CG1-CG2 4.36Å; I392-I406 HydrophobicContact CG2-CG2 4.09Å; V395-I406 HydrophobicContact CB-CD1 4.36Å; V395-I406 HydrophobicContact CG1-CD1 3.95Å; T396-I406 HydrophobicContact CG2-CB 4.4Å; T396-I406 HydrophobicContact CG2-CD1 3.58Å; T396-I406 HydrophobicContact CG2-CG2 4.26Å; L402-I406 WeakPolarHBondContact O-CG1 3.08Å; L402-I406 PolarHBondContact O-N 3.43Å; R403-I406 PolarHBondContact O-N 3.3Å; I406-Q408 PolarHBondContact O-N 3.37Å; I406-A409 PolarHBondContact O-N 3.43Å; I406-R410 PolarHBondContact O-N 2.83Å; I406-L449 HydrophobicContact CG2-CD2 3.81Å; I406-V451 HydrophobicContact CG1-CG2 4.12Å; I406-F606 HydrophobicContact CG2-CE1 4.1Å
407	L	95.4	Very high	92.7	Very high	50 Å²	50	69.9 Å²	69.9	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-60.5	-44.8	176.2	-71.4	171.7	0	0	0	111.7	R403 K404 A409 R410 D411 F606	R403-L407 HydrophobicContact CG-CD1 4.27Å; R403-L407 WeakPolarHBondContact O-CG 3.31Å; R403-L407 PolarHBondContact O-N 2.86Å; K404-L407 PolarHBondContact O-N 3.36Å; L407-A409 VanDerWaalsContact C-N 3.32Å; L407-A409 PolarHBondContact O-N 2.76Å; L407-R410 PolarHBondContact O-N 2.73Å; L407-D411 PolarHBondContact O-N 3.29Å; L407-F606 HydrophobicContact CD2-CE1 3.97Å; L407-F606 HydrophobicContact CD2-CZ 3.8Å; L407-F606 HydrophobicContact CG-CZ 4.1Å
408	Q	95.3	Very high	91.9	Very high	91 Å²	91	73.6 Å²	73.6	43%	0.425	33%	0.327	S	S	.	.	H	α-helix	trans	-60.7	-39.2	175.2	-72.4	171.4	3.3	0	0	112.8	K404 K405 I406 D411 R412	K404-Q408 VanDerWaalsContact O-CG 3.26Å; K404-Q408 WeakPolarHBondContact O-CG 3.27Å; K404-Q408 PolarHBondContact O-N 3.06Å; K405-Q408 PolarHBondContact O-N 3.18Å; I406-Q408 PolarHBondContact O-N 3.37Å; Q408-D411 PolarHBondContact O-N 3.21Å; Q408-R412 VanDerWaalsContact O-CG 3.3Å; Q408-R412 WeakPolarHBondContact O-CG 3.38Å; Q408-R412 PolarHBondContact O-N 3.34Å; Q408-R412 VanDerWaalsContact O-N 3.08Å
409	A	94.4	Very high	91	Very high	13 Å²	13	79.7 Å²	79.7	11%	0.107	35%	0.354	C	S	.	.	H	α-helix	trans	-66.5	-43.3	176.3	0	0	0	0	0	111.6	K405 I406 L407 D411 R412 Q413 L449 V451	K405-A409 PolarHBondContact O-N 3.07Å; I406-A409 PolarHBondContact O-N 3.43Å; L407-A409 VanDerWaalsContact C-N 3.32Å; L407-A409 PolarHBondContact O-N 2.76Å; A409-D411 VanDerWaalsContact C-N 3.33Å; A409-D411 PolarHBondContact O-N 3.1Å; A409-R412 PolarHBondContact O-N 2.93Å; A409-Q413 PolarHBondContact O-N 2.66Å; A409-L449 HydrophobicContact CB-CD1 3.94Å; A409-L449 HydrophobicContact CB-CD2 4.25Å; A409-L449 HydrophobicContact CB-CG 4.14Å; A409-V451 HydrophobicContact CB-CG2 3.84Å
410	R	92.9	Very high	89.9	Confident	60 Å²	60	87.9 Å²	87.9	23%	0.226	39%	0.385	C	S	.	.	H	α-helix	trans	-59.3	-43	174.4	-76.9	-175.2	170.1	-168.8	-4.1	111.8	I406 L407 Q413 R414 L449 E605 F606	I406-R410 PolarHBondContact O-N 2.83Å; L407-R410 PolarHBondContact O-N 2.73Å; R410-Q413 PolarHBondContact O-N 3.11Å; R410-R414 WeakPolarHBondContact O-CG 3.38Å; R410-R414 PolarHBondContact O-N 3.49Å; R410-L449 HydrophobicContact CG-CD1 4.12Å; R410-L449 HydrophobicContact CG-CD2 3.77Å; R410-E605 PolarHBondContact NH1-O 2.85Å; R410-F606 VanDerWaalsContact NH1-CD1 3.26Å
411	D	91.7	Very high	88.7	Confident	80 Å²	80	87.8 Å²	87.8	43%	0.428	38%	0.384	S	S	.	.	H	α-helix	trans	-64.5	-41.4	178.2	-71.7	-22	0	0	0	112.2	L407 Q408 A409 R414 Q415	L407-D411 PolarHBondContact O-N 3.29Å; Q408-D411 PolarHBondContact O-N 3.21Å; A409-D411 VanDerWaalsContact C-N 3.33Å; A409-D411 PolarHBondContact O-N 3.1Å; D411-R414 PolarHBondContact O-N 2.84Å; D411-Q415 VanDerWaalsContact O-CG 3.32Å; D411-Q415 WeakPolarHBondContact O-CG 3.41Å; D411-Q415 PolarHBondContact O-N 3.41Å
412	R	91	Very high	87	Confident	155 Å²	155	88.3 Å²	88.3	59%	0.585	40%	0.397	S	S	*	.	H	α-helix	trans	-62.3	-43.7	174.4	-71.8	171.3	-173.4	179.5	2.8	111.7	Q408 A409 R414 Q415 Q416	Q408-R412 VanDerWaalsContact O-CG 3.3Å; Q408-R412 WeakPolarHBondContact O-CG 3.38Å; Q408-R412 PolarHBondContact O-N 3.34Å; Q408-R412 VanDerWaalsContact O-N 3.08Å; A409-R412 PolarHBondContact O-N 2.93Å; R412-R414 VanDerWaalsContact C-N 3.34Å; R412-R414 PolarHBondContact O-N 2.72Å; R412-Q415 PolarHBondContact O-N 2.74Å; R412-Q416 WeakPolarHBondContact O-CG 3.33Å; R412-Q416 PolarHBondContact O-N 3.06Å
413	Q	88.3	Confident	85.1	Confident	61 Å²	61	91.3 Å²	91.3	29%	0.285	42%	0.417	S	S	.	.	H	α-helix	trans	-63.7	-40.6	178.4	-165.1	-176.8	26.9	0	0	111.4	A409 R410 Q416 R417	A409-Q413 PolarHBondContact O-N 2.66Å; R410-Q413 PolarHBondContact O-N 3.11Å; Q413-Q416 PolarHBondContact O-N 2.93Å; Q413-R417 PolarHBondContact O-N 3.28Å
414	R	86.4	Confident	83.2	Confident	163 Å²	163	96.1 Å²	96.1	62%	0.615	44%	0.442	S	S	*	.	H	α-helix	trans	-60.9	-49.4	173.2	-75.9	175.2	176.5	179.9	-2.4	111.6	R410 D411 R412 Q416 R417 T418	R410-R414 WeakPolarHBondContact O-CG 3.38Å; R410-R414 PolarHBondContact O-N 3.49Å; D411-R414 PolarHBondContact O-N 2.84Å; R412-R414 VanDerWaalsContact C-N 3.34Å; R412-R414 PolarHBondContact O-N 2.72Å; R414-Q416 VanDerWaalsContact C-N 3.29Å; R414-Q416 PolarHBondContact O-N 3.09Å; R414-R417 PolarHBondContact O-N 2.69Å; R414-R417 VanDerWaalsContact O-N 3.15Å; R414-T418 PolarHBondContact O-N 3.13Å; R414-T418 PolarHBondContact O-OG1 3.23Å; R414-T418 VanDerWaalsContact O-OG1 3.08Å
415	Q	86.4	Confident	81.2	Confident	119 Å²	119	97.4 Å²	97.4	56%	0.556	45%	0.45	S	S	*	.	H	α-helix	trans	-60.3	-37.5	177.6	-71.6	173.4	10.3	0	0	112.7	D411 R412 K419	D411-Q415 VanDerWaalsContact O-CG 3.32Å; D411-Q415 WeakPolarHBondContact O-CG 3.41Å; D411-Q415 PolarHBondContact O-N 3.41Å; R412-Q415 PolarHBondContact O-N 2.74Å; Q415-K419 WeakPolarHBondContact O-CB 3.44Å; Q415-K419 VanDerWaalsContact O-CG 3.31Å; Q415-K419 WeakPolarHBondContact O-CG 3.32Å; Q415-K419 PolarHBondContact O-N 3.4Å
416	Q	83.2	Confident	79.1	Confident	116 Å²	116	99.4 Å²	99.4	54%	0.542	47%	0.471	S	S	.	.	H	α-helix	trans	-67.6	-38.9	175.7	-74.3	175.6	3.8	0	0	112.3	R412 Q413 R414 K419 R420	R412-Q416 WeakPolarHBondContact O-CG 3.33Å; R412-Q416 PolarHBondContact O-N 3.06Å; Q413-Q416 PolarHBondContact O-N 2.93Å; R414-Q416 VanDerWaalsContact C-N 3.29Å; R414-Q416 PolarHBondContact O-N 3.09Å; Q416-K419 PolarHBondContact O-N 2.94Å; Q416-R420 WeakPolarHBondContact O-CG 3.15Å; Q416-R420 PolarHBondContact O-N 3.34Å
417	R	82	Confident	76.8	Confident	126 Å²	126	107.5 Å²	107.5	48%	0.475	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-49.9	173.1	-81	-173.2	177.1	178.7	1.4	111.5	Q413 R414 K419 R420 E421	Q413-R417 PolarHBondContact O-N 3.28Å; R414-R417 PolarHBondContact O-N 2.69Å; R414-R417 VanDerWaalsContact O-N 3.15Å; R417-K419 VanDerWaalsContact C-N 3.27Å; R417-K419 PolarHBondContact O-N 2.96Å; R417-R420 PolarHBondContact O-N 3Å; R417-E421 WeakPolarHBondContact O-CG 3.27Å; R417-E421 PolarHBondContact O-N 2.62Å
418	T	79.1	Confident	74.5	Confident	89 Å²	89	108.1 Å²	108.1	55%	0.546	53%	0.526	S	S	.	.	H	α-helix	trans	-60.1	-37.5	178.4	-48.7	0	0	0	0	111.9	R414 S422	R414-T418 PolarHBondContact O-N 3.13Å; R414-T418 PolarHBondContact O-OG1 3.23Å; R414-T418 VanDerWaalsContact O-OG1 3.08Å; T418-S422 WeakPolarHBondContact O-CB 3.46Å; T418-S422 PolarHBondContact O-N 3.19Å; T418-S422 PolarHBondContact O-OG 2.76Å
419	K	76.3	Confident	72.2	Confident	143 Å²	143	108.4 Å²	108.4	62%	0.622	54%	0.544	S	S	*	.	H	α-helix	trans	-66.6	-37.8	174.7	-77	179.9	-178.1	-177.8	0	113.2	Q415 Q416 R417 S422 S423	Q415-K419 WeakPolarHBondContact O-CB 3.44Å; Q415-K419 VanDerWaalsContact O-CG 3.31Å; Q415-K419 WeakPolarHBondContact O-CG 3.32Å; Q415-K419 PolarHBondContact O-N 3.4Å; Q416-K419 PolarHBondContact O-N 2.94Å; R417-K419 VanDerWaalsContact C-N 3.27Å; R417-K419 PolarHBondContact O-N 2.96Å; K419-S422 WeakPolarHBondContact CA-OG 3.36Å; K419-S422 PolarHBondContact O-OG 3.33Å; K419-S423 PolarHBondContact O-N 2.62Å; K419-S423 PolarHBondContact O-OG 3.09Å; K419-S423 VanDerWaalsContact O-OG 3.11Å
420	R	72.5	Confident	69.9	Low	173 Å²	173	112.4 Å²	112.4	65%	0.653	58%	0.578	S	S	*	*	H	α-helix	trans	-67.6	-44.6	176.4	-77.1	-179.9	-179.1	-178	1.5	111.5	Q416 R417 S422 S423 E424	Q416-R420 WeakPolarHBondContact O-CG 3.15Å; Q416-R420 PolarHBondContact O-N 3.34Å; R417-R420 PolarHBondContact O-N 3Å; R420-S422 VanDerWaalsContact C-N 3.33Å; R420-S422 PolarHBondContact O-N 3.44Å; R420-S423 WeakPolarHBondContact CA-OG 3.48Å; R420-S423 PolarHBondContact O-N 2.97Å; R420-S423 PolarHBondContact O-OG 2.77Å; R420-E424 WeakPolarHBondContact O-CG 3.38Å; R420-E424 PolarHBondContact O-N 2.56Å
421	E	69.2	Low	67.3	Low	117 Å²	117	112.9 Å²	112.9	55%	0.547	60%	0.601	S	S	.	*	H	α-helix	trans	-61.2	-41.7	175.3	-70.6	166.6	-179.1	0	0	110.9	R417 S423 E424 E425	R417-E421 WeakPolarHBondContact O-CG 3.27Å; R417-E421 PolarHBondContact O-N 2.62Å; E421-S423 PolarHBondContact O-N 3.4Å; E421-E424 PolarHBondContact O-N 3.16Å; E421-E425 PolarHBondContact O-N 2.97Å; E421-E425 VanDerWaalsContact O-N 3.15Å
422	S	60.8	Low	64.8	Low	66 Å²	66	112.2 Å²	112.2	46%	0.462	61%	0.613	S	S	.	*	H	α-helix	trans	-69.3	-28.6	176	67.4	0	0	0	0	114.5	T418 K419 R420 S426	T418-S422 WeakPolarHBondContact O-CB 3.46Å; T418-S422 PolarHBondContact O-N 3.19Å; T418-S422 PolarHBondContact O-OG 2.76Å; K419-S422 WeakPolarHBondContact CA-OG 3.36Å; K419-S422 PolarHBondContact O-OG 3.33Å; R420-S422 VanDerWaalsContact C-N 3.33Å; R420-S422 PolarHBondContact O-N 3.44Å; S422-S426 PolarHBondContact O-N 2.74Å
423	S	57.9	Low	62.4	Low	62 Å²	62	111.2 Å²	111.2	43%	0.434	63%	0.627	S	S	.	*	H	α-helix	trans	-78	-32.1	175.5	52.4	0	0	0	0	112.6	K419 R420 E421 S426 E427	K419-S423 PolarHBondContact O-N 2.62Å; K419-S423 PolarHBondContact O-OG 3.09Å; K419-S423 VanDerWaalsContact O-OG 3.11Å; R420-S423 WeakPolarHBondContact CA-OG 3.48Å; R420-S423 PolarHBondContact O-N 2.97Å; R420-S423 PolarHBondContact O-OG 2.77Å; E421-S423 PolarHBondContact O-N 3.4Å; S423-S426 PolarHBondContact O-N 3.33Å; S423-E427 PolarHBondContact O-N 3.2Å
424	E	56.1	Low	59.9	Low	141 Å²	141	119.5 Å²	119.5	66%	0.659	66%	0.655	S	S	*	*	H	α-helix	trans	-71.3	-34.7	175.2	-73.3	178.9	-178.9	0	0	111.8	R420 E421 S426 E427 G428	R420-E424 WeakPolarHBondContact O-CG 3.38Å; R420-E424 PolarHBondContact O-N 2.56Å; E421-E424 PolarHBondContact O-N 3.16Å; E424-S426 VanDerWaalsContact C-N 3.32Å; E424-S426 PolarHBondContact O-N 2.81Å; E424-E427 PolarHBondContact O-N 3.01Å; E424-G428 PolarHBondContact O-N 3.01Å
425	E	54.6	Low	57.6	Low	166 Å²	166	119.9 Å²	119.9	78%	0.776	67%	0.67	S	S	*	*	H	α-helix	trans	-67.6	-28.6	171.1	-76.6	-174.3	160.8	0	0	113.2	E421	E421-E425 PolarHBondContact O-N 2.97Å; E421-E425 VanDerWaalsContact O-N 3.15Å
426	S	50.7	Low	55.1	Low	97 Å²	97	120 Å²	120	68%	0.678	68%	0.679	S	S	*	*	H	α-helix	trans	-78.4	-23.5	177.6	-175.5	0	0	0	0	113.7	S422 S423 E424	S422-S426 PolarHBondContact O-N 2.74Å; S423-S426 PolarHBondContact O-N 3.33Å; E424-S426 VanDerWaalsContact C-N 3.32Å; E424-S426 PolarHBondContact O-N 2.81Å
427	E	49.8	Very low	52.8	Low	170 Å²	170	120.1 Å²	120.1	79%	0.794	69%	0.689	S	S	*	*	H	α-helix	trans	-92.1	-13.4	175.3	-71.3	-168	163.1	0	0	112.9	S423 E424 A429	S423-E427 PolarHBondContact O-N 3.2Å; E424-E427 PolarHBondContact O-N 3.01Å; E427-A429 VanDerWaalsContact C-N 3.28Å; E427-A429 PolarHBondContact O-N 3.33Å
428	G	45.2	Very low	50.4	Low	62 Å²	62	119.3 Å²	119.3	64%	0.639	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-2	178.7	0	0	0	0	0	116.5	E424	E424-G428 PolarHBondContact O-N 3.01Å
429	A	47.3	Very low	48	Very low	97 Å²	97	118.2 Å²	118.2	80%	0.802	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	1.4	-178.6	0	0	0	0	0	114.8	E427	E427-A429 VanDerWaalsContact C-N 3.28Å; E427-A429 PolarHBondContact O-N 3.33Å
430	A	46.8	Very low	46	Very low	98 Å²	98	119.3 Å²	119.3	81%	0.81	73%	0.728	S	S	*	*	S	Bend	trans	-139	72.1	-180	0	0	0	0	0	113
431	G	39.2	Very low	43.9	Very low	70 Å²	70	120.4 Å²	120.4	72%	0.722	74%	0.738	S	S	*	*			trans	-176.7	114.6	168.8	0	0	0	0	0	112.7
432	G	38.4	Very low	42.1	Very low	66 Å²	66	120.5 Å²	120.5	68%	0.68	75%	0.749	S	S	*	*			trans	-64	173.8	-176.6	0	0	0	0	0	115.5	R434	G432-R434 PolarHBondContact O-N 3.01Å
433	P	40.8	Very low	40.9	Very low	134 Å²	134	123.5 Å²	123.5	87%	0.87	77%	0.77	S	S	*	*			trans	-70.1	122.9	-166.3	28.9	-32.5	0	0	0	111
434	R	35.6	Very low	39.8	Very low	234 Å²	234	123.6 Å²	123.6	88%	0.883	78%	0.78	S	S	*	*			trans	-125.3	108.6	162.9	-79.3	-172	174.2	179.2	-0.7	109	G432 V436	G432-R434 PolarHBondContact O-N 3.01Å; R434-V436 PolarHBondContact O-N 2.81Å
435	D	37.1	Very low	39.4	Very low	172 Å²	172	123.5 Å²	123.5	92%	0.92	79%	0.79	S	S	*	*			trans	-56.3	117	161.8	-73.3	-51	0	0	0	109.7
436	V	34	Very low	39.6	Very low	122 Å²	122	123 Å²	123	74%	0.739	79%	0.788	S	S	*	*			trans	-135.3	131.5	160.6	-176.2	0	0	0	0	107.5	R434	R434-V436 PolarHBondContact O-N 2.81Å
437	P	35.2	Very low	40.8	Very low	117 Å²	117	123.1 Å²	123.1	76%	0.76	79%	0.786	S	S	*	*			trans	-68	143.1	-173.2	-11.3	26.2	0	0	0	111.4	G439	P437-G439 VanDerWaalsContact C-N 3.35Å; P437-G439 PolarHBondContact O-N 3.44Å
438	A	32	Very low	42.6	Very low	109 Å²	109	118.1 Å²	118.1	90%	0.901	76%	0.764	S	S	*	*			trans	-59.6	92.1	169.9	0	0	0	0	0	110.6
439	G	27.9	Very low	45	Very low	66 Å²	66	115.7 Å²	115.7	68%	0.68	74%	0.736	S	S	*	*			trans	-78.9	121.6	166.2	0	0	0	0	0	109.9	P437 K441	P437-G439 VanDerWaalsContact C-N 3.35Å; P437-G439 PolarHBondContact O-N 3.44Å; G439-K441 PolarHBondContact O-N 3.46Å; G439-K441 VanDerWaalsContact O-N 3.11Å
440	N	35	Very low	47.3	Very low	166 Å²	166	116.4 Å²	116.4	89%	0.888	72%	0.723	S	S	*	*			trans	-37	111.9	168.2	-86.8	-13.2	0	0	0	111.9
441	K	27.8	Very low	49.6	Very low	196 Å²	196	112 Å²	112	85%	0.852	69%	0.686	S	S	*	*			trans	-75.2	131	159.7	-83.9	-177.9	177.4	175.1	0	107.9	G439	G439-K441 PolarHBondContact O-N 3.46Å; G439-K441 VanDerWaalsContact O-N 3.11Å
442	P	32	Very low	52.3	Low	119 Å²	119	111.6 Å²	111.6	77%	0.773	67%	0.672	S	S	*	*			trans	-62.9	144.5	171.2	27.8	-31.7	0	0	0	109.1	G444	P442-G444 VanDerWaalsContact C-N 3.26Å; P442-G444 PolarHBondContact O-N 3.17Å
443	S	35.9	Very low	55	Low	129 Å²	129	108.4 Å²	108.4	90%	0.902	64%	0.64	S	S	*	*			trans	-58.2	81.9	175.3	55.9	0	0	0	0	111.1	T445	S443-T445 PolarHBondContact O-N 3.48Å
444	G	34.9	Very low	57.3	Low	64 Å²	64	111.3 Å²	111.3	66%	0.66	63%	0.633	S	S	*	*			trans	-71.7	121.8	172.3	0	0	0	0	0	109.6	P442 Q446	P442-G444 VanDerWaalsContact C-N 3.26Å; P442-G444 PolarHBondContact O-N 3.17Å; G444-Q446 PolarHBondContact O-N 3.45Å
445	T	46.9	Very low	59.8	Low	140 Å²	140	105.1 Å²	105.1	86%	0.859	61%	0.614	S	S	*	*			trans	-35.8	121.3	167.4	22.6	0	0	0	0	110.7	S443	S443-T445 PolarHBondContact O-N 3.48Å
446	Q	58.2	Low	62.4	Low	156 Å²	156	97 Å²	97	73%	0.729	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-55	137.9	171.6	-75.3	-171.5	-0	0	0	108.9	G444	G444-Q446 PolarHBondContact O-N 3.45Å
447	P	76.4	Confident	65.2	Low	99 Å²	99	97.4 Å²	97.4	64%	0.643	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-62.3	141.3	177.8	25.2	-32.6	0	0	0	110.2
448	L	88.6	Confident	67.9	Low	64 Å²	64	92.3 Å²	92.3	34%	0.335	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-56.8	150.3	176.4	-63	174.7	0	0	0	110.9	C375 E378 L389 E450	C375-L448 WeakPolarHBondContact O-CD2 3.49Å; E378-L448 HydrophobicContact CB-CB 4.45Å; E378-L448 HydrophobicContact CB-CD1 4.38Å; L389-L448 HydrophobicContact CD2-CD1 3.59Å; L448-E450 PolarHBondContact O-N 3.49Å
449	L	94.6	Very high	70.8	Confident	11 Å²	11	93.1 Å²	93.1	6%	0.058	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	118.4	172.6	-178	71.3	0	0	0	109.7	D376 V377 E378 I392 I406 A409 R410 V451	D376-L449 PolarHBondContact O-N 3.39Å; V377-L449 WeakPolarHBondContact CA-O 3.39Å; V377-L449 WeakPolarHBondContact CG2-O 3.27Å; E378-L449 PolarHBondContact N-O 2.96Å; I392-L449 HydrophobicContact CD1-CD2 4.01Å; I406-L449 HydrophobicContact CG2-CD2 3.81Å; A409-L449 HydrophobicContact CB-CD1 3.94Å; A409-L449 HydrophobicContact CB-CD2 4.25Å; A409-L449 HydrophobicContact CB-CG 4.14Å; R410-L449 HydrophobicContact CG-CD1 4.12Å; R410-L449 HydrophobicContact CG-CD2 3.77Å; L449-V451 HydrophobicContact CD2-CG2 4.31Å; L449-V451 HydrophobicContact CG-CG2 4.32Å
450	E	95.4	Very high	74	Confident	112 Å²	112	90.2 Å²	90.2	52%	0.523	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.3	176.8	-66.1	178.8	177.5	0	0	111.5	E378 I380 L448	E378-E450 CarbonylContact O-C 3.6Å; E378-E450 WeakPolarHBondContact O-CA 3.03Å; I380-E450 HydrophobicContact CD1-CB 4.19Å; I380-E450 HydrophobicContact CD1-CG 4.38Å; L448-E450 PolarHBondContact O-N 3.49Å
451	V	96.3	Very high	76.9	Confident	5 Å²	5	82.3 Å²	82.3	3%	0.03	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	112.2	178.6	-177.6	0	0	0	0	110	V377 E378 F379 I380 K405 I406 A409 L449 I453	V377-V451 HydrophobicContact CG2-CB 4.45Å; V377-V451 HydrophobicContact CG2-CG2 3.73Å; E378-V451 PolarHBondContact O-N 3.03Å; F379-V451 CarbonylContact C-O 3.52Å; F379-V451 VanDerWaalsContact CA-O 3.29Å; F379-V451 WeakPolarHBondContact CA-O 3.5Å; F379-V451 HydrophobicContact CD1-CB 3.78Å; F379-V451 HydrophobicContact CD1-CG1 3.96Å; F379-V451 HydrophobicContact CE1-CB 3.96Å; F379-V451 HydrophobicContact CE1-CG1 4Å; F379-V451 HydrophobicContact CE1-CG2 4.36Å; I380-V451 PolarHBondContact N-O 3.34Å; K405-V451 HydrophobicContact CB-CG1 3.92Å; I406-V451 HydrophobicContact CG1-CG2 4.12Å; A409-V451 HydrophobicContact CB-CG2 3.84Å; L449-V451 HydrophobicContact CD2-CG2 4.31Å; L449-V451 HydrophobicContact CG-CG2 4.32Å; V451-I453 HydrophobicContact CG1-CG1 4.43Å
452	S	95	Very high	80.1	Confident	62 Å²	62	77 Å²	77	43%	0.434	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.3	179.4	-178.5	0	0	0	0	112.6	I380	I380-S452 WeakPolarHBondContact O-CA 3.29Å
453	I	94.8	Very high	83	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	95.3	176.7	-54.6	170.6	0	0	0	107.7	F379 I380 L381 G382 W401 L402 V451 E455 A456 F461 F497	F379-I453 HydrophobicContact CD1-CD1 3.73Å; F379-I453 HydrophobicContact CE1-CD1 4.31Å; I380-I453 PolarHBondContact O-N 3.37Å; L381-I453 WeakPolarHBondContact CA-O 3.46Å; L381-I453 HydrophobicContact CD2-CB 3.91Å; L381-I453 HydrophobicContact CD2-CD1 4.32Å; G382-I453 PolarHBondContact N-O 3.17Å; W401-I453 HydrophobicContact CH2-CG1 4.39Å; W401-I453 HydrophobicContact CH2-CG2 4.06Å; W401-I453 HydrophobicContact CZ3-CD1 4.05Å; W401-I453 HydrophobicContact CZ3-CG1 4.33Å; W401-I453 HydrophobicContact CZ3-CG2 4.48Å; L402-I453 HydrophobicContact CD2-CD1 3.57Å; V451-I453 HydrophobicContact CG1-CG1 4.43Å; I453-E455 VanDerWaalsContact C-N 3.32Å; I453-E455 HydrophobicContact CG2-CG 3.83Å; I453-E455 PolarHBondContact O-N 3.4Å; I453-A456 HydrophobicContact CG2-CB 3.77Å; I453-F461 HydrophobicContact CD1-CE2 3.71Å; I453-F461 HydrophobicContact CD1-CZ 4.02Å; I453-F497 HydrophobicContact CG2-CZ 4.24Å
454	R	90.1	Very high	85.8	Confident	194 Å²	194	66.1 Å²	66.1	73%	0.732	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-24.1	-174.5	-66	-174	177.4	-170.7	-4.1	112.8	A456	R454-A456 VanDerWaalsContact C-N 3.31Å; R454-A456 PolarHBondContact O-N 3.04Å
455	E	87.2	Confident	88.7	Confident	104 Å²	104	63.1 Å²	63.1	49%	0.486	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-6	-175.4	58.7	-93	-137.1	0	0	114.5	W401 K405 I453	W401-E455 WeakPolarHBondContact CH2-OE1 3.49Å; W401-E455 WeakPolarHBondContact CZ2-OE1 3.3Å; K405-E455 IonicContact NZ-OE1 2.71Å; I453-E455 VanDerWaalsContact C-N 3.32Å; I453-E455 HydrophobicContact CG2-CG 3.83Å; I453-E455 PolarHBondContact O-N 3.4Å
456	A	91.6	Very high	90.9	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.008	28%	0.284	C	S	.	.			trans	-119.7	135.3	-177.5	0	0	0	0	0	111.4	L381 G382 I453 R454 F461 L493 F497	L381-A456 HydrophobicContact CD2-CB 4.43Å; G382-A456 WeakPolarHBondContact CA-O 3.48Å; G382-A456 PolarHBondContact N-O 3.29Å; I453-A456 HydrophobicContact CG2-CB 3.77Å; R454-A456 VanDerWaalsContact C-N 3.31Å; R454-A456 PolarHBondContact O-N 3.04Å; A456-F461 HydrophobicContact CB-CD2 4.16Å; A456-L493 HydrophobicContact CB-CD1 4.26Å; A456-L493 HydrophobicContact CB-CD2 3.62Å; A456-F497 HydrophobicContact CB-CZ 4.49Å
457	E	92.9	Very high	92.6	Very high	132 Å²	132	50.7 Å²	50.7	62%	0.617	25%	0.25	S	C	*	.			trans	-85.3	157.2	169.8	-63.5	-170.1	174.1	0	0	111.1	P460 F461	E457-P460 HydrophobicContact CB-CG 4.33Å; E457-F461 WeakPolarHBondContact O-CB 3.38Å; E457-F461 PolarHBondContact O-N 3.26Å
458	A	93.4	Very high	93.5	Very high	10 Å²	10	46 Å²	46	8%	0.083	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-49.9	-173.9	0	0	0	0	0	113.3	L381 E386 F461 E462	L381-A458 HydrophobicContact CD1-CB 4.28Å; E386-A458 HydrophobicContact CB-CB 3.77Å; E386-A458 HydrophobicContact CG-CB 4.31Å; E386-A458 WeakPolarHBondContact OE2-CB 3.31Å; A458-F461 CarbonylContact O-C 3.57Å; A458-F461 PolarHBondContact O-N 3.41Å; A458-E462 WeakPolarHBondContact O-CG 3.47Å; A458-E462 PolarHBondContact O-N 3Å
459	Q	92.6	Very high	93.9	Very high	126 Å²	126	42.9 Å²	42.9	59%	0.589	20%	0.203	S	C	*	.	H	α-helix	trans	-64.1	-48.5	-173.2	-171.5	-173.9	0.2	0	0	113.3	F461 E462 V463 L486	Q459-F461 VanDerWaalsContact C-N 3.29Å; Q459-F461 PolarHBondContact O-N 3.31Å; Q459-E462 PolarHBondContact O-N 2.91Å; Q459-V463 PolarHBondContact O-N 3.48Å; Q459-L486 HydrophobicContact CB-CD1 4.38Å; Q459-L486 HydrophobicContact CG-CD1 3.78Å; Q459-L486 HydrophobicContact CG-CD2 4.38Å
460	P	93.9	Very high	93.7	Very high	4 Å²	4	43.2 Å²	43.2	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-34.3	173.3	-19.8	31.9	0	0	0	112.8	E457 V463 L464 L486 D489 V490 L493	E457-P460 HydrophobicContact CB-CG 4.33Å; P460-V463 PolarHBondContact O-N 3.49Å; P460-L464 PolarHBondContact O-N 2.95Å; P460-L486 HydrophobicContact CB-CD1 4.34Å; P460-L486 HydrophobicContact CG-CD1 3.95Å; P460-D489 HydrophobicContact CB-CB 3.88Å; P460-D489 HydrophobicContact CG-CB 3.56Å; P460-V490 HydrophobicContact CB-CG2 3.94Å; P460-L493 HydrophobicContact CB-CD1 3.81Å
461	F	96.1	Very high	93.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68	-36.5	177.6	-171.7	-92.8	0	0	0	112.1	F379 L381 V388 L402 I453 A456 E457 A458 Q459 V463 L464 M465 L493 F497	F379-F461 HydrophobicContact CB-CE1 3.91Å; F379-F461 HydrophobicContact CB-CZ 4.05Å; F379-F461 AromaticContact CD1-CZ 3.96Å; F379-F461 HydrophobicContact CD1-CZ 3.96Å; F379-F461 AromaticContact CD2-CE1 3.89Å; F379-F461 HydrophobicContact CD2-CE1 3.89Å; F379-F461 AromaticContact CD2-CZ 3.98Å; F379-F461 HydrophobicContact CD2-CZ 3.98Å; F379-F461 HydrophobicContact CE1-CZ 4.44Å; F379-F461 HydrophobicContact CE2-CZ 4.45Å; F379-F461 AromaticContact CG-CE1 3.86Å; F379-F461 HydrophobicContact CG-CE1 3.86Å; F379-F461 AromaticContact CG-CZ 3.71Å; F379-F461 HydrophobicContact CG-CZ 3.71Å; L381-F461 HydrophobicContact CD1-CB 3.69Å; L381-F461 HydrophobicContact CD1-CD1 3.44Å; L381-F461 VanDerWaalsContact CD1-CD1 3.44Å; L381-F461 HydrophobicContact CD1-CD2 4.48Å; L381-F461 HydrophobicContact CD1-CE1 4.15Å; L381-F461 HydrophobicContact CD1-CG 3.63Å; L381-F461 HydrophobicContact CD2-CD1 4.15Å; L381-F461 HydrophobicContact CD2-CD2 4.08Å; L381-F461 HydrophobicContact CD2-CE1 4.28Å; L381-F461 HydrophobicContact CD2-CE2 4.23Å; L381-F461 HydrophobicContact CD2-CG 4.03Å; L381-F461 HydrophobicContact CD2-CZ 4.33Å; L381-F461 HydrophobicContact CG-CD1 4.41Å; V388-F461 HydrophobicContact CB-CD1 4.19Å; V388-F461 HydrophobicContact CB-CE1 4.28Å; V388-F461 HydrophobicContact CG1-CD1 4.08Å; V388-F461 HydrophobicContact CG1-CE1 4.11Å; V388-F461 HydrophobicContact CG2-CD1 4.35Å; L402-F461 HydrophobicContact CD2-CE2 4.32Å; L402-F461 HydrophobicContact CD2-CZ 4.48Å; I453-F461 HydrophobicContact CD1-CE2 3.71Å; I453-F461 HydrophobicContact CD1-CZ 4.02Å; A456-F461 HydrophobicContact CB-CD2 4.16Å; E457-F461 WeakPolarHBondContact O-CB 3.38Å; E457-F461 PolarHBondContact O-N 3.26Å; A458-F461 CarbonylContact O-C 3.57Å; A458-F461 PolarHBondContact O-N 3.41Å; Q459-F461 VanDerWaalsContact C-N 3.29Å; Q459-F461 PolarHBondContact O-N 3.31Å; F461-V463 VanDerWaalsContact C-N 3.35Å; F461-V463 PolarHBondContact O-N 3.18Å; F461-L464 WeakPolarHBondContact O-CB 3.34Å; F461-L464 PolarHBondContact O-N 3.01Å; F461-M465 HydrophobicContact CD1-CG 3.7Å; F461-M465 HydrophobicContact CE1-CG 3.45Å; F461-M465 VanDerWaalsContact CE1-CG 3.45Å; F461-M465 HydrophobicContact CE1-SD 3.84Å; F461-M465 HydrophobicContact CZ-CG 4.09Å; F461-M465 HydrophobicContact CZ-SD 3.99Å; F461-M465 WeakPolarHBondContact O-CB 3.21Å; F461-M465 VanDerWaalsContact O-CG 3.25Å; F461-M465 WeakPolarHBondContact O-CG 3.14Å; F461-M465 PolarHBondContact O-N 3.38Å; F461-L493 HydrophobicContact CB-CD1 4.37Å; F461-F497 HydrophobicContact CD2-CE2 4.09Å; F461-F497 HydrophobicContact CD2-CZ 4.38Å; F461-F497 AromaticContact CE2-CE2 3.83Å; F461-F497 HydrophobicContact CE2-CE2 3.83Å; F461-F497 HydrophobicContact CE2-CZ 4.25Å
462	E	94.7	Very high	92.5	Very high	84 Å²	84	41.1 Å²	41.1	39%	0.393	20%	0.195	S	C	.	.	H	α-helix	trans	-63.3	-39.4	173.9	-74.9	-165	153.2	0	0	112.4	R372 V388 A458 Q459 M465 Q466	R372-E462 IonicContact NH2-OE1 2.67Å; V388-E462 HydrophobicContact CG1-CG 4.34Å; V388-E462 HydrophobicContact CG2-CG 3.97Å; A458-E462 WeakPolarHBondContact O-CG 3.47Å; A458-E462 PolarHBondContact O-N 3Å; Q459-E462 PolarHBondContact O-N 2.91Å; E462-M465 PolarHBondContact O-N 3.31Å; E462-Q466 WeakPolarHBondContact O-CB 3.49Å; E462-Q466 PolarHBondContact O-N 3.31Å
463	V	92.9	Very high	91.6	Very high	21 Å²	21	38.6 Å²	38.6	13%	0.127	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-42.9	174.2	178.7	0	0	0	0	110.8	Q459 P460 F461 M465 Q466 F467 I473 L486 I487 V490	Q459-V463 PolarHBondContact O-N 3.48Å; P460-V463 PolarHBondContact O-N 3.49Å; F461-V463 VanDerWaalsContact C-N 3.35Å; F461-V463 PolarHBondContact O-N 3.18Å; V463-M465 VanDerWaalsContact C-N 3.32Å; V463-M465 PolarHBondContact O-N 3.2Å; V463-Q466 PolarHBondContact O-N 3.41Å; V463-F467 PolarHBondContact O-N 3.38Å; V463-I473 HydrophobicContact CG1-CG2 3.9Å; V463-L486 HydrophobicContact CG2-CD2 4.28Å; V463-I487 HydrophobicContact CG1-CD1 4.42Å; V463-V490 HydrophobicContact CB-CG2 3.77Å; V463-V490 HydrophobicContact CG1-CG1 4.29Å; V463-V490 HydrophobicContact CG1-CG2 3.84Å; V463-V490 HydrophobicContact CG2-CG2 4.42Å
464	L	95.7	Very high	90.4	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-44.8	173.3	-178.9	152.4	0	0	0	111	L402 P460 F461 F467 L468 L493 F497 L499 L502	L402-L464 HydrophobicContact CD1-CD2 4.44Å; P460-L464 PolarHBondContact O-N 2.95Å; F461-L464 WeakPolarHBondContact O-CB 3.34Å; F461-L464 PolarHBondContact O-N 3.01Å; L464-F467 WeakPolarHBondContact O-CB 3.29Å; L464-F467 PolarHBondContact O-N 3.46Å; L464-L468 HydrophobicContact CD2-CD1 3.89Å; L464-L468 HydrophobicContact CD2-CG 4.07Å; L464-L468 WeakPolarHBondContact O-CG 3.42Å; L464-L468 PolarHBondContact O-N 3.34Å; L464-L493 HydrophobicContact CD1-CB 3.71Å; L464-L493 HydrophobicContact CD1-CD1 4.35Å; L464-F497 HydrophobicContact CD1-CD2 3.54Å; L464-F497 HydrophobicContact CD1-CE2 3.82Å; L464-F497 HydrophobicContact CD1-CG 4.43Å; L464-F497 HydrophobicContact CD2-CD2 4.2Å; L464-F497 HydrophobicContact CD2-CE2 4.3Å; L464-L499 HydrophobicContact CD1-CD1 3.9Å; L464-L499 HydrophobicContact CD2-CD1 4.31Å; L464-L499 HydrophobicContact CG-CD1 4.05Å; L464-L502 HydrophobicContact CB-CD2 4.3Å; L464-L502 HydrophobicContact CD1-CD2 4Å; L464-L502 HydrophobicContact CG-CD2 3.86Å
465	M	95.9	Very high	89.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-45.4	177.2	-73.3	-68	-73.1	0	0	111	W369 F379 V388 V395 F461 E462 V463 F467 L468 Y469	W369-M465 HydrophobicContact CE3-CB 4.42Å; W369-M465 HydrophobicContact CE3-CE 4.45Å; W369-M465 HydrophobicContact CH2-CB 3.33Å; W369-M465 HydrophobicContact CH2-CE 4.17Å; W369-M465 HydrophobicContact CH2-CG 3.95Å; W369-M465 HydrophobicContact CZ2-CB 3.68Å; W369-M465 HydrophobicContact CZ3-CB 3.75Å; W369-M465 HydrophobicContact CZ3-CE 3.62Å; W369-M465 HydrophobicContact CZ3-CG 4.3Å; F379-M465 HydrophobicContact CD2-CE 4.46Å; F379-M465 HydrophobicContact CE2-CE 4.05Å; F379-M465 HydrophobicContact CE2-SD 4.45Å; V388-M465 HydrophobicContact CG1-CG 4.48Å; V395-M465 HydrophobicContact CG2-CE 3.67Å; V395-M465 HydrophobicContact CG2-SD 4.05Å; F461-M465 HydrophobicContact CD1-CG 3.7Å; F461-M465 HydrophobicContact CE1-CG 3.45Å; F461-M465 VanDerWaalsContact CE1-CG 3.45Å; F461-M465 HydrophobicContact CE1-SD 3.84Å; F461-M465 HydrophobicContact CZ-CG 4.09Å; F461-M465 HydrophobicContact CZ-SD 3.99Å; F461-M465 WeakPolarHBondContact O-CB 3.21Å; F461-M465 VanDerWaalsContact O-CG 3.25Å; F461-M465 WeakPolarHBondContact O-CG 3.14Å; F461-M465 PolarHBondContact O-N 3.38Å; E462-M465 PolarHBondContact O-N 3.31Å; V463-M465 VanDerWaalsContact C-N 3.32Å; V463-M465 PolarHBondContact O-N 3.2Å; M465-F467 PolarHBondContact O-N 2.77Å; M465-L468 WeakPolarHBondContact O-CB 3.42Å; M465-L468 PolarHBondContact O-N 3.11Å; M465-L468 HydrophobicContact SD-CD1 3.95Å; M465-Y469 HydrophobicContact CE-CE2 4Å; M465-Y469 WeakPolarHBondContact O-CD2 3.46Å; M465-Y469 PolarHBondContact O-N 2.92Å
466	Q	93.6	Very high	88	Confident	31 Å²	31	36.4 Å²	36.4	15%	0.145	18%	0.175	C	C	.	.	H	α-helix	trans	-55.1	-40.7	174.2	-173.8	179.9	28	0	0	111.7	E462 V463 Y469 T470 Q474	E462-Q466 WeakPolarHBondContact O-CB 3.49Å; E462-Q466 PolarHBondContact O-N 3.31Å; V463-Q466 PolarHBondContact O-N 3.41Å; Q466-Y469 PolarHBondContact O-N 3.39Å; Q466-T470 WeakPolarHBondContact O-CB 3.49Å; Q466-T470 PolarHBondContact O-N 3.35Å; Q466-T470 PolarHBondContact O-OG1 3.06Å; Q466-Q474 VanDerWaalsContact NE2-CD 3.33Å
467	F	93.5	Very high	86.1	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-42.6	173.5	167.9	-95.5	0	0	0	112.5	V463 L464 M465 Y469 T470 D471 R501 L502 L505	V463-F467 PolarHBondContact O-N 3.38Å; L464-F467 WeakPolarHBondContact O-CB 3.29Å; L464-F467 PolarHBondContact O-N 3.46Å; M465-F467 PolarHBondContact O-N 2.77Å; F467-Y469 PolarHBondContact O-N 2.98Å; F467-T470 PolarHBondContact O-N 2.78Å; F467-D471 WeakPolarHBondContact O-CA 3.45Å; F467-D471 PolarHBondContact O-N 3.27Å; F467-R501 HydrophobicContact CE2-CG 4.44Å; F467-R501 HydrophobicContact CZ-CB 4.12Å; F467-R501 HydrophobicContact CZ-CG 4.21Å; F467-L502 HydrophobicContact CB-CD1 3.96Å; F467-L502 HydrophobicContact CD1-CB 3.95Å; F467-L502 HydrophobicContact CD1-CD1 3.96Å; F467-L502 HydrophobicContact CD1-CD2 4.04Å; F467-L502 HydrophobicContact CD1-CG 4.21Å; F467-L502 HydrophobicContact CD2-CD1 3.9Å; F467-L502 HydrophobicContact CE1-CB 3.74Å; F467-L502 HydrophobicContact CE1-CG 4.5Å; F467-L502 HydrophobicContact CE2-CB 4.44Å; F467-L502 HydrophobicContact CE2-CD1 4.46Å; F467-L502 HydrophobicContact CG-CB 4.4Å; F467-L502 HydrophobicContact CG-CD1 3.64Å; F467-L502 HydrophobicContact CG-CD2 4.46Å; F467-L502 HydrophobicContact CG-CG 4.38Å; F467-L502 HydrophobicContact CZ-CB 4.01Å; F467-L505 HydrophobicContact CD2-CD1 3.7Å; F467-L505 HydrophobicContact CE2-CD1 3.34Å; F467-L505 HydrophobicContact CZ-CD1 4.33Å
468	L	95.8	Very high	84.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-28.5	176.8	-60.1	-176.8	0	0	0	112.5	V395 R398 C399 L402 L464 M465 L499	V395-L468 HydrophobicContact CG1-CD1 4.4Å; V395-L468 HydrophobicContact CG2-CD1 4.47Å; R398-L468 HydrophobicContact CB-CB 4.13Å; R398-L468 HydrophobicContact CB-CD2 3.75Å; R398-L468 HydrophobicContact CB-CG 4.39Å; R398-L468 HydrophobicContact CG-CB 4.48Å; R398-L468 WeakPolarHBondContact CG-O 3.34Å; R398-L468 PolarHBondContact NH1-O 3.11Å; C399-L468 HydrophobicContact CB-CD1 4.28Å; C399-L468 HydrophobicContact CB-CD2 4.21Å; L402-L468 HydrophobicContact CD1-CD1 3.89Å; L464-L468 HydrophobicContact CD2-CD1 3.89Å; L464-L468 HydrophobicContact CD2-CG 4.07Å; L464-L468 WeakPolarHBondContact O-CG 3.42Å; L464-L468 PolarHBondContact O-N 3.34Å; M465-L468 WeakPolarHBondContact O-CB 3.42Å; M465-L468 PolarHBondContact O-N 3.11Å; M465-L468 HydrophobicContact SD-CD1 3.95Å; L468-L499 HydrophobicContact CD2-CD1 4.18Å; L468-L499 HydrophobicContact CD2-CD2 4.24Å
469	Y	95.4	Very high	82.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-89.9	-33.8	179.2	-74.4	-113.3	0	0	0	112.6	Y365 L368 W369 H391 I394 M465 Q466 F467	Y365-Y469 VanDerWaalsContact CB-O 3.32Å; Y365-Y469 WeakPolarHBondContact CB-O 3.29Å; Y365-Y469 VanDerWaalsContact O-CD1 3.29Å; Y365-Y469 WeakPolarHBondContact O-CD1 3.36Å; L368-Y469 HydrophobicContact CD2-CE1 4.17Å; W369-Y469 HydrophobicContact CB-CD1 3.73Å; W369-Y469 HydrophobicContact CB-CD2 4.4Å; W369-Y469 HydrophobicContact CB-CE1 4.15Å; W369-Y469 HydrophobicContact CB-CG 3.84Å; W369-Y469 HydrophobicContact CD2-CD2 4.46Å; W369-Y469 HydrophobicContact CD2-CE2 4.47Å; W369-Y469 HydrophobicContact CE3-CD2 4.13Å; W369-Y469 HydrophobicContact CE3-CE1 4.45Å; W369-Y469 AromaticContact CE3-CE2 3.71Å; W369-Y469 HydrophobicContact CE3-CE2 3.71Å; W369-Y469 AromaticContact CE3-CZ 3.87Å; W369-Y469 HydrophobicContact CG-CG 4.47Å; W369-Y469 HydrophobicContact CZ3-CE2 4.27Å; H391-Y469 WeakPolarHBondContact CB-OH 3.48Å; H391-Y469 PolarHBondContact N-OH 3.43Å; H391-Y469 AromaticContact ND1-CE1 3.44Å; H391-Y469 WeakPolarHBondContact ND1-CE1 3.45Å; H391-Y469 AromaticContact ND1-CZ 3.51Å; H391-Y469 PolarHBondContact ND1-OH 2.99Å; I394-Y469 HydrophobicContact CB-CE1 4.26Å; I394-Y469 HydrophobicContact CD1-CD1 3.55Å; I394-Y469 HydrophobicContact CD1-CE1 3.37Å; I394-Y469 HydrophobicContact CD1-CG 4.48Å; I394-Y469 HydrophobicContact CG1-CE1 4.38Å; I394-Y469 HydrophobicContact CG2-CD1 4.09Å; I394-Y469 HydrophobicContact CG2-CD2 3.96Å; I394-Y469 HydrophobicContact CG2-CE1 4.14Å; I394-Y469 HydrophobicContact CG2-CE2 4Å; I394-Y469 HydrophobicContact CG2-CG 4.03Å; M465-Y469 HydrophobicContact CE-CE2 4Å; M465-Y469 WeakPolarHBondContact O-CD2 3.46Å; M465-Y469 PolarHBondContact O-N 2.92Å; Q466-Y469 PolarHBondContact O-N 3.39Å; F467-Y469 PolarHBondContact O-N 2.98Å
470	T	90.3	Very high	81.7	Confident	17 Å²	17	50.2 Å²	50.2	10%	0.104	23%	0.23	C	C	.	.	H	α-helix	trans	-117.2	-7.7	-165.7	66.9	0	0	0	0	114.7	H362 Q466 F467 K472	H362-T470 PolarHBondContact CD2-O 3.15Å; Q466-T470 WeakPolarHBondContact O-CB 3.49Å; Q466-T470 PolarHBondContact O-N 3.35Å; Q466-T470 PolarHBondContact O-OG1 3.06Å; F467-T470 PolarHBondContact O-N 2.78Å; T470-K472 WeakPolarHBondContact O-CG 3.29Å; T470-K472 PolarHBondContact O-N 2.97Å; T470-K472 VanDerWaalsContact O-N 3.09Å; T470-K472 PolarHBondContact OG1-N 3.32Å; T470-K472 PolarHBondContact OG1-O 3.32Å
471	D	86.9	Confident	81.2	Confident	13 Å²	13	51.8 Å²	51.8	7%	0.07	24%	0.24	C	C	.	.	S	Bend	trans	56.3	19	-173.3	-144.1	39.5	0	0	0	113.9	R398 F467 R501 L591	R398-D471 IonicContact CZ-OD1 3.17Å; R398-D471 IonicContact NH1-OD1 3.98Å; R398-D471 IonicContact NH2-OD1 2.95Å; R398-D471 PolarHBondContact NH2-OD1 3.07Å; F467-D471 WeakPolarHBondContact O-CA 3.45Å; F467-D471 PolarHBondContact O-N 3.27Å; D471-R501 IonicContact OD1-NE 3.33Å; D471-R501 PolarHBondContact OD1-NE 3.29Å; D471-R501 IonicContact OD2-CZ 3.84Å; D471-R501 IonicContact OD2-NE 2.76Å; D471-R501 PolarHBondContact OD2-NE 3.27Å; D471-R501 IonicContact OD2-NH2 3.8Å; D471-R501 PolarHBondContact OD2-NH2 2.94Å; D471-L591 HydrophobicContact CB-CB 3.92Å
472	K	80.2	Confident	80.6	Confident	60 Å²	60	58.3 Å²	58.3	26%	0.261	27%	0.27	S	S	.	.			trans	-135.1	145.2	-173.8	-68.6	173.4	-176	-179.1	0	109.5	T470	T470-K472 WeakPolarHBondContact O-CG 3.29Å; T470-K472 PolarHBondContact O-N 2.97Å; T470-K472 VanDerWaalsContact O-N 3.09Å; T470-K472 PolarHBondContact OG1-N 3.32Å; T470-K472 PolarHBondContact OG1-O 3.32Å
473	I	76.9	Confident	80.1	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.051	26%	0.261	C	S	.	.			trans	-103.2	130.2	163.9	-55.6	177.9	0	0	0	106.7	V463 Y475 I487 L502 L505	V463-I473 HydrophobicContact CG1-CG2 3.9Å; I473-Y475 HydrophobicContact CB-CE1 4.07Å; I473-Y475 HydrophobicContact CG2-CD1 4.22Å; I473-Y475 HydrophobicContact CG2-CE1 4.1Å; I473-Y475 PolarHBondContact O-N 3.13Å; I473-I487 HydrophobicContact CG2-CD1 3.86Å; I473-L502 HydrophobicContact CD1-CD1 3.46Å; I473-L502 VanDerWaalsContact CD1-CD1 3.46Å; I473-L502 HydrophobicContact CG1-CD1 3.85Å; I473-L505 HydrophobicContact CD1-CB 3.82Å; I473-L505 HydrophobicContact CG1-CD1 4.41Å
474	Q	68.5	Low	79.7	Confident	133 Å²	133	55.1 Å²	55.1	62%	0.621	26%	0.255	S	S	*	.			trans	-78.3	111.6	168.6	-70.7	-172.4	10.5	0	0	108.7	Q466 P476	Q466-Q474 VanDerWaalsContact NE2-CD 3.33Å; Q474-P476 WeakPolarHBondContact O-CD 3.47Å
475	Y	66.5	Low	79.4	Confident	77 Å²	77	57.2 Å²	57.2	30%	0.302	27%	0.266	S	S	.	.			trans	-77.7	127.9	177	-58.4	-61.3	0	0	0	110.6	I473 R477 L505 Y509	I473-Y475 HydrophobicContact CB-CE1 4.07Å; I473-Y475 HydrophobicContact CG2-CD1 4.22Å; I473-Y475 HydrophobicContact CG2-CE1 4.1Å; I473-Y475 PolarHBondContact O-N 3.13Å; Y475-R477 PolarHBondContact O-N 3.45Å; Y475-L505 WeakPolarHBondContact OH-CD2 3.37Å; Y475-Y509 HydrophobicContact CD1-CD1 4.22Å; Y475-Y509 AromaticContact CD1-CD2 3Å; Y475-Y509 HydrophobicContact CD1-CD2 3Å; Y475-Y509 AromaticContact CD1-CE2 3.4Å; Y475-Y509 HydrophobicContact CD1-CE2 3.4Å; Y475-Y509 AromaticContact CD1-CG 3.45Å; Y475-Y509 HydrophobicContact CD1-CG 3.45Å; Y475-Y509 VanDerWaalsContact CD1-CG 3.45Å; Y475-Y509 HydrophobicContact CD2-CD2 4.44Å; Y475-Y509 VanDerWaalsContact CE1-CB 3.42Å; Y475-Y509 HydrophobicContact CE1-CD1 4.4Å; Y475-Y509 AromaticContact CE1-CD2 3.41Å; Y475-Y509 HydrophobicContact CE1-CD2 3.41Å; Y475-Y509 VanDerWaalsContact CE1-CD2 3.41Å; Y475-Y509 HydrophobicContact CE1-CE2 4.25Å; Y475-Y509 AromaticContact CE1-CG 3.47Å; Y475-Y509 HydrophobicContact CE1-CG 3.47Å; Y475-Y509 VanDerWaalsContact CE1-CG 3.47Å; Y475-Y509 AromaticContact CG-CD2 3.59Å; Y475-Y509 HydrophobicContact CG-CD2 3.59Å; Y475-Y509 AromaticContact CG-CE2 3.74Å; Y475-Y509 HydrophobicContact CG-CE2 3.74Å; Y475-Y509 HydrophobicContact CG-CG 4.44Å
476	P	60.2	Low	79.1	Confident	41 Å²	41	58.4 Å²	58.4	27%	0.266	27%	0.272	S	S	.	.			trans	-57.8	129.5	167.6	-25.4	37.9	0	0	0	109.5	Q474 R478 D483	Q474-P476 WeakPolarHBondContact O-CD 3.47Å; P476-R478 PolarHBondContact O-N 2.79Å; P476-D483 HydrophobicContact CB-CB 3.68Å; P476-D483 WeakPolarHBondContact CB-OD1 3.36Å; P476-D483 WeakPolarHBondContact CB-OD2 3.2Å; P476-D483 HydrophobicContact CG-CB 3.64Å; P476-D483 VanDerWaalsContact CG-CG 3.43Å; P476-D483 WeakPolarHBondContact CG-OD1 3.46Å
477	R	53.1	Low	79	Confident	250 Å²	250	57.1 Å²	57.1	94%	0.943	27%	0.266	S	S	*	.	S	Bend	trans	-69.7	1.5	-168.9	-65.1	-174.7	-173.7	-179.9	3.4	114.7	Y475	Y475-R477 PolarHBondContact O-N 3.45Å
478	R	54.9	Low	78.9	Confident	177 Å²	177	56.9 Å²	56.9	67%	0.668	27%	0.265	S	S	*	.	S	Bend	trans	-134.8	121.5	-178.4	-67.3	-178.2	179.6	-175.7	-1.5	105.6	P476 H480 D483	P476-R478 PolarHBondContact O-N 2.79Å; R478-H480 WeakPolarHBondContact CB-CD2 3.31Å; R478-H480 WeakPolarHBondContact CB-NE2 3.37Å; R478-H480 WeakPolarHBondContact CD-NE2 3.43Å; R478-H480 PolarHBondContact O-N 3.36Å; R478-D483 VanDerWaalsContact O-OD2 3.1Å
479	G	56.9	Low	78.8	Confident	40 Å²	40	59.2 Å²	59.2	41%	0.412	28%	0.278	S	S	.	.			trans	-65.9	44.8	177	0	0	0	0	0	113.7
480	H	74.6	Confident	78.7	Confident	93 Å²	93	59.2 Å²	59.2	43%	0.431	28%	0.278	S	S	.	.			trans	-59.4	142.3	171.7	-69.5	-66.6	0	0	0	108.7	R478 Q482 D483 V484	R478-H480 WeakPolarHBondContact CB-CD2 3.31Å; R478-H480 WeakPolarHBondContact CB-NE2 3.37Å; R478-H480 WeakPolarHBondContact CD-NE2 3.43Å; R478-H480 PolarHBondContact O-N 3.36Å; H480-Q482 PolarHBondContact O-N 3.27Å; H480-Q482 VanDerWaalsContact O-N 3.13Å; H480-D483 IonicContact CD2-OD2 3.58Å; H480-D483 WeakPolarHBondContact O-CB 3.41Å; H480-D483 PolarHBondContact O-N 3.02Å; H480-V484 PolarHBondContact O-N 3.22Å
481	V	81.6	Confident	78.8	Confident	37 Å²	37	58.7 Å²	58.7	22%	0.224	27%	0.274	C	S	.	.	H	α-helix	trans	-51.8	-42.2	-177.7	-178.7	0	0	0	0	110.8	D483 V484 L485 N518	V481-D483 VanDerWaalsContact C-N 3.31Å; V481-D483 PolarHBondContact O-N 2.71Å; V481-V484 PolarHBondContact O-N 3.22Å; V481-L485 HydrophobicContact CG1-CD1 4Å; V481-L485 HydrophobicContact CG1-CG 4.09Å; V481-L485 VanDerWaalsContact O-CG 3.25Å; V481-L485 WeakPolarHBondContact O-CG 3.49Å; V481-L485 PolarHBondContact O-N 2.76Å; V481-N518 HydrophobicContact CG2-CB 3.64Å
482	Q	84.6	Confident	79.2	Confident	137 Å²	137	62.3 Å²	62.3	64%	0.64	29%	0.289	S	S	*	.	H	α-helix	trans	-58.8	-40.1	180	-71.2	75.5	13.6	0	0	113.1	H480 L485 L486	H480-Q482 PolarHBondContact O-N 3.27Å; H480-Q482 VanDerWaalsContact O-N 3.13Å; Q482-L485 PolarHBondContact O-N 2.84Å; Q482-L486 PolarHBondContact O-N 3.4Å
483	D	83.1	Confident	79.9	Confident	38 Å²	38	59.9 Å²	59.9	20%	0.203	28%	0.279	C	S	.	.	H	α-helix	trans	-69.4	-39.4	179.7	-66.3	-37.3	0	0	0	110.9	P476 R478 H480 V481 L486 I487	P476-D483 HydrophobicContact CB-CB 3.68Å; P476-D483 WeakPolarHBondContact CB-OD1 3.36Å; P476-D483 WeakPolarHBondContact CB-OD2 3.2Å; P476-D483 HydrophobicContact CG-CB 3.64Å; P476-D483 VanDerWaalsContact CG-CG 3.43Å; P476-D483 WeakPolarHBondContact CG-OD1 3.46Å; R478-D483 VanDerWaalsContact O-OD2 3.1Å; H480-D483 IonicContact CD2-OD2 3.58Å; H480-D483 WeakPolarHBondContact O-CB 3.41Å; H480-D483 PolarHBondContact O-N 3.02Å; V481-D483 VanDerWaalsContact C-N 3.31Å; V481-D483 PolarHBondContact O-N 2.71Å; D483-L486 PolarHBondContact O-N 2.89Å; D483-I487 WeakPolarHBondContact O-CG1 3.49Å; D483-I487 PolarHBondContact O-N 3.18Å
484	V	85.4	Confident	80.7	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-44.2	174.6	-175.9	0	0	0	0	110.7	H480 V481 L486 I487 M488 I510 V522	H480-V484 PolarHBondContact O-N 3.22Å; V481-V484 PolarHBondContact O-N 3.22Å; V484-L486 PolarHBondContact O-N 2.96Å; V484-I487 PolarHBondContact O-N 2.95Å; V484-M488 HydrophobicContact CG1-SD 4.49Å; V484-M488 VanDerWaalsContact O-CG 3.31Å; V484-M488 WeakPolarHBondContact O-CG 3.14Å; V484-M488 PolarHBondContact O-N 2.88Å; V484-I510 HydrophobicContact CG1-CB 4.49Å; V484-I510 HydrophobicContact CG1-CG1 4.34Å; V484-I510 HydrophobicContact CG1-CG2 3.81Å; V484-V522 HydrophobicContact CB-CG2 4.41Å; V484-V522 HydrophobicContact CG1-CG1 4.4Å; V484-V522 HydrophobicContact CG1-CG2 3.67Å
485	L	89.6	Confident	81.9	Confident	43 Å²	43	56.4 Å²	56.4	23%	0.225	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-42.8	177.6	-67.5	-177.3	0	0	0	112.1	V481 Q482 I487 M488 D489 N525	V481-L485 HydrophobicContact CG1-CD1 4Å; V481-L485 HydrophobicContact CG1-CG 4.09Å; V481-L485 VanDerWaalsContact O-CG 3.25Å; V481-L485 WeakPolarHBondContact O-CG 3.49Å; V481-L485 PolarHBondContact O-N 2.76Å; Q482-L485 PolarHBondContact O-N 2.84Å; L485-I487 VanDerWaalsContact C-N 3.31Å; L485-I487 PolarHBondContact O-N 3.15Å; L485-M488 HydrophobicContact CD2-SD 3.83Å; L485-M488 WeakPolarHBondContact O-CB 3.29Å; L485-M488 PolarHBondContact O-N 3.45Å; L485-M488 VanDerWaalsContact O-N 3.09Å; L485-D489 PolarHBondContact O-N 2.97Å; L485-D489 VanDerWaalsContact O-N 3.09Å; L485-N525 HydrophobicContact CD2-CB 3.57Å
486	L	90.3	Very high	83.2	Confident	26 Å²	26	55.5 Å²	55.5	14%	0.136	27%	0.269	C	S	.	.	H	α-helix	trans	-56.9	-45.9	174.3	174.7	62.2	0	0	0	111.4	Q459 P460 V463 Q482 D483 V484 M488 D489 V490	Q459-L486 HydrophobicContact CB-CD1 4.38Å; Q459-L486 HydrophobicContact CG-CD1 3.78Å; Q459-L486 HydrophobicContact CG-CD2 4.38Å; P460-L486 HydrophobicContact CB-CD1 4.34Å; P460-L486 HydrophobicContact CG-CD1 3.95Å; V463-L486 HydrophobicContact CG2-CD2 4.28Å; Q482-L486 PolarHBondContact O-N 3.4Å; D483-L486 PolarHBondContact O-N 2.89Å; V484-L486 PolarHBondContact O-N 2.96Å; L486-M488 VanDerWaalsContact C-N 3.28Å; L486-M488 PolarHBondContact O-N 2.95Å; L486-D489 PolarHBondContact O-N 3.28Å; L486-V490 WeakPolarHBondContact O-CG2 3.35Å; L486-V490 PolarHBondContact O-N 3.13Å
487	I	89.9	Confident	84.8	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.015	26%	0.257	C	S	.	.	H	α-helix	trans	-68.2	-27.5	178.8	-60.8	-56.9	0	0	0	112.1	V463 I473 D483 V484 L485 V490 Y491 C506 Y509 I510	V463-I487 HydrophobicContact CG1-CD1 4.42Å; I473-I487 HydrophobicContact CG2-CD1 3.86Å; D483-I487 WeakPolarHBondContact O-CG1 3.49Å; D483-I487 PolarHBondContact O-N 3.18Å; V484-I487 PolarHBondContact O-N 2.95Å; L485-I487 VanDerWaalsContact C-N 3.31Å; L485-I487 PolarHBondContact O-N 3.15Å; I487-V490 PolarHBondContact O-N 2.8Å; I487-Y491 WeakPolarHBondContact O-CB 3.42Å; I487-Y491 PolarHBondContact O-N 3.38Å; I487-C506 HydrophobicContact CG2-CB 3.72Å; I487-Y509 HydrophobicContact CB-CD1 3.85Å; I487-Y509 HydrophobicContact CB-CE1 4.06Å; I487-Y509 HydrophobicContact CG1-CD1 3.7Å; I487-Y509 HydrophobicContact CG1-CE1 3.61Å; I487-Y509 HydrophobicContact CG2-CD1 3.72Å; I487-Y509 HydrophobicContact CG2-CE1 4.44Å; I487-I510 HydrophobicContact CB-CG1 4.35Å; I487-I510 HydrophobicContact CG2-CD1 4.09Å; I487-I510 HydrophobicContact CG2-CG1 3.91Å
488	M	92	Very high	86.7	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-38	170.8	-66.2	173.3	65	0	0	112.4	V484 L485 L486 Y491 K492 I510 V522 N525 A526 L529 L531 L534	V484-M488 HydrophobicContact CG1-SD 4.49Å; V484-M488 VanDerWaalsContact O-CG 3.31Å; V484-M488 WeakPolarHBondContact O-CG 3.14Å; V484-M488 PolarHBondContact O-N 2.88Å; L485-M488 HydrophobicContact CD2-SD 3.83Å; L485-M488 WeakPolarHBondContact O-CB 3.29Å; L485-M488 PolarHBondContact O-N 3.45Å; L485-M488 VanDerWaalsContact O-N 3.09Å; L486-M488 VanDerWaalsContact C-N 3.28Å; L486-M488 PolarHBondContact O-N 2.95Å; M488-Y491 WeakPolarHBondContact O-CB 3.38Å; M488-Y491 PolarHBondContact O-N 3.09Å; M488-K492 PolarHBondContact O-N 2.69Å; M488-I510 HydrophobicContact CB-CD1 4.41Å; M488-I510 HydrophobicContact CG-CD1 3.66Å; M488-I510 HydrophobicContact CG-CG1 4.21Å; M488-V522 HydrophobicContact CE-CG1 4.36Å; M488-V522 WeakPolarHBondContact CE-O 3.31Å; M488-V522 HydrophobicContact SD-CB 4.41Å; M488-V522 HydrophobicContact SD-CG1 3.78Å; M488-N525 HydrophobicContact CE-CB 3.69Å; M488-N525 HydrophobicContact SD-CB 4.25Å; M488-A526 HydrophobicContact CE-CB 3.84Å; M488-L529 HydrophobicContact CB-CD1 4.03Å; M488-L531 HydrophobicContact CB-CD1 4.42Å; M488-L531 HydrophobicContact CE-CD1 4.23Å; M488-L534 HydrophobicContact CE-CD2 3.69Å; M488-L534 HydrophobicContact CG-CD2 3.93Å; M488-L534 HydrophobicContact SD-CD2 4.18Å
489	D	93.1	Very high	88.5	Confident	48 Å²	48	42.3 Å²	42.3	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-67.7	-40.2	173.6	-67.4	-44.3	0	0	0	111.3	P460 L485 L486 Y491 K492 L493	P460-D489 HydrophobicContact CB-CB 3.88Å; P460-D489 HydrophobicContact CG-CB 3.56Å; L485-D489 PolarHBondContact O-N 2.97Å; L485-D489 VanDerWaalsContact O-N 3.09Å; L486-D489 PolarHBondContact O-N 3.28Å; D489-Y491 VanDerWaalsContact C-N 3.32Å; D489-Y491 PolarHBondContact O-N 3.46Å; D489-K492 WeakPolarHBondContact O-CB 3.32Å; D489-K492 PolarHBondContact O-N 3.49Å; D489-L493 PolarHBondContact O-N 2.79Å
490	V	93.6	Very high	90.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-41	172.4	-179.5	0	0	0	0	111	P460 V463 L486 I487 K492 L493 A494 L502	P460-V490 HydrophobicContact CB-CG2 3.94Å; V463-V490 HydrophobicContact CB-CG2 3.77Å; V463-V490 HydrophobicContact CG1-CG1 4.29Å; V463-V490 HydrophobicContact CG1-CG2 3.84Å; V463-V490 HydrophobicContact CG2-CG2 4.42Å; L486-V490 WeakPolarHBondContact O-CG2 3.35Å; L486-V490 PolarHBondContact O-N 3.13Å; I487-V490 PolarHBondContact O-N 2.8Å; V490-K492 PolarHBondContact O-N 2.68Å; V490-L493 WeakPolarHBondContact O-CB 3.39Å; V490-L493 PolarHBondContact O-N 2.98Å; V490-A494 WeakPolarHBondContact O-CB 3.29Å; V490-A494 PolarHBondContact O-N 3.02Å; V490-L502 HydrophobicContact CG1-CD1 4.11Å; V490-L502 HydrophobicContact CG1-CD2 4.05Å; V490-L502 HydrophobicContact CG1-CG 4.28Å
491	Y	93.6	Very high	90.6	Very high	6 Å²	6	38.4 Å²	38.4	2%	0.024	19%	0.194	C	C	.	.	H	α-helix	trans	-59.3	-44.2	175.6	178.2	-129.2	0	0	0	111.9	I487 M488 D489 L493 A494 L495 E503 C506 V507 L531	I487-Y491 WeakPolarHBondContact O-CB 3.42Å; I487-Y491 PolarHBondContact O-N 3.38Å; M488-Y491 WeakPolarHBondContact O-CB 3.38Å; M488-Y491 PolarHBondContact O-N 3.09Å; D489-Y491 VanDerWaalsContact C-N 3.32Å; D489-Y491 PolarHBondContact O-N 3.46Å; Y491-L493 VanDerWaalsContact C-N 3.33Å; Y491-L493 PolarHBondContact O-N 2.71Å; Y491-A494 WeakPolarHBondContact O-CB 3.38Å; Y491-A494 PolarHBondContact O-N 3.15Å; Y491-L495 HydrophobicContact CD1-CD1 4.4Å; Y491-L495 HydrophobicContact CE1-CD1 3.98Å; Y491-L495 HydrophobicContact CE2-CD1 4.14Å; Y491-L495 HydrophobicContact CE2-CD2 4.42Å; Y491-L495 HydrophobicContact CE2-CG 4.16Å; Y491-L495 PolarHBondContact O-N 2.94Å; Y491-E503 HydrophobicContact CD2-CG 4.05Å; Y491-E503 HydrophobicContact CE2-CB 4.38Å; Y491-E503 HydrophobicContact CE2-CG 3.42Å; Y491-E503 VanDerWaalsContact CE2-CG 3.42Å; Y491-C506 HydrophobicContact CD2-CB 3.95Å; Y491-C506 HydrophobicContact CG-CB 4.11Å; Y491-V507 HydrophobicContact CD2-CG2 3.92Å; Y491-V507 HydrophobicContact CE1-CG2 4.31Å; Y491-V507 HydrophobicContact CE2-CG2 3.24Å; Y491-L531 HydrophobicContact CD1-CB 4.49Å; Y491-L531 HydrophobicContact CD1-CD1 3.62Å; Y491-L531 HydrophobicContact CD1-CD2 3.66Å; Y491-L531 HydrophobicContact CD1-CG 4.09Å; Y491-L531 HydrophobicContact CE1-CB 4.12Å; Y491-L531 HydrophobicContact CE1-CD1 4.09Å; Y491-L531 HydrophobicContact CE1-CD2 3.63Å; Y491-L531 HydrophobicContact CE1-CG 4.12Å
492	K	94.9	Very high	91	Very high	90 Å²	90	36.6 Å²	36.6	39%	0.391	18%	0.183	S	C	.	.	H	α-helix	trans	-61.4	-40.8	174.3	178.1	179	170.9	-168.5	0	112.2	M488 D489 V490 S496 L529	M488-K492 PolarHBondContact O-N 2.69Å; D489-K492 WeakPolarHBondContact O-CB 3.32Å; D489-K492 PolarHBondContact O-N 3.49Å; V490-K492 PolarHBondContact O-N 2.68Å; K492-S496 WeakPolarHBondContact O-CB 3.37Å; K492-S496 PolarHBondContact O-N 3.45Å; K492-S496 PolarHBondContact O-OG 3.26Å; K492-L529 HydrophobicContact CD-CB 4.42Å; K492-L529 HydrophobicContact CD-CD2 3.79Å
493	L	95.1	Very high	91.2	Very high	9 Å²	9	32.1 Å²	32.1	5%	0.047	16%	0.162	C	C	.	.	H	α-helix	trans	-64.8	-41.2	174	-68.2	-177.1	0	0	0	111.6	A456 P460 F461 L464 D489 V490 Y491 L495 S496 F497	A456-L493 HydrophobicContact CB-CD1 4.26Å; A456-L493 HydrophobicContact CB-CD2 3.62Å; P460-L493 HydrophobicContact CB-CD1 3.81Å; F461-L493 HydrophobicContact CB-CD1 4.37Å; L464-L493 HydrophobicContact CD1-CB 3.71Å; L464-L493 HydrophobicContact CD1-CD1 4.35Å; D489-L493 PolarHBondContact O-N 2.79Å; V490-L493 WeakPolarHBondContact O-CB 3.39Å; V490-L493 PolarHBondContact O-N 2.98Å; Y491-L493 VanDerWaalsContact C-N 3.33Å; Y491-L493 PolarHBondContact O-N 2.71Å; L493-L495 PolarHBondContact O-N 2.9Å; L493-S496 PolarHBondContact O-N 3.48Å; L493-F497 HydrophobicContact CD2-CE1 4.34Å; L493-F497 HydrophobicContact CD2-CZ 4.18Å; L493-F497 WeakPolarHBondContact O-CB 3.41Å; L493-F497 WeakPolarHBondContact O-CG 3.41Å; L493-F497 PolarHBondContact O-N 3.16Å
494	A	94	Very high	91.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.8	-46	177.7	0	0	0	0	0	111.9	V490 Y491 F497 K498 L499 L502 E503	V490-A494 WeakPolarHBondContact O-CB 3.29Å; V490-A494 PolarHBondContact O-N 3.02Å; Y491-A494 WeakPolarHBondContact O-CB 3.38Å; Y491-A494 PolarHBondContact O-N 3.15Å; A494-F497 PolarHBondContact O-N 3.11Å; A494-K498 WeakPolarHBondContact O-CA 3.35Å; A494-K498 PolarHBondContact O-N 3.3Å; A494-L499 HydrophobicContact CB-CB 4.43Å; A494-L499 PolarHBondContact O-N 2.8Å; A494-L502 HydrophobicContact CB-CB 3.95Å; A494-L502 HydrophobicContact CB-CD2 3.8Å; A494-L502 HydrophobicContact CB-CG 3.73Å; A494-E503 HydrophobicContact CB-CB 4.27Å
495	L	92.5	Very high	90.9	Very high	69 Å²	69	33.1 Å²	33.1	36%	0.361	17%	0.166	S	C	.	.	H	α-helix	trans	-60.4	-46.5	173.7	-71.1	170.4	0	0	0	111.5	Y491 L493 F497 K498 E503 L531	Y491-L495 HydrophobicContact CD1-CD1 4.4Å; Y491-L495 HydrophobicContact CE1-CD1 3.98Å; Y491-L495 HydrophobicContact CE2-CD1 4.14Å; Y491-L495 HydrophobicContact CE2-CD2 4.42Å; Y491-L495 HydrophobicContact CE2-CG 4.16Å; Y491-L495 PolarHBondContact O-N 2.94Å; L493-L495 PolarHBondContact O-N 2.9Å; L495-F497 VanDerWaalsContact C-N 3.34Å; L495-F497 PolarHBondContact O-N 3.32Å; L495-K498 PolarHBondContact O-N 3.38Å; L495-E503 VanDerWaalsContact CD2-CD 3.45Å; L495-E503 HydrophobicContact CD2-CG 3.8Å; L495-E503 HydrophobicContact CG-CG 4.36Å; L495-L531 HydrophobicContact CD1-CD2 3.78Å
496	S	93.4	Very high	90.8	Very high	59 Å²	59	31 Å²	31	41%	0.413	16%	0.155	S	C	.	.	H	α-helix	trans	-64.9	-38.5	-178	-58.6	0	0	0	0	112.3	K492 L493	K492-S496 WeakPolarHBondContact O-CB 3.37Å; K492-S496 PolarHBondContact O-N 3.45Å; K492-S496 PolarHBondContact O-OG 3.26Å; L493-S496 PolarHBondContact O-N 3.48Å
497	F	94.8	Very high	90.4	Very high	3 Å²	3	30.8 Å²	30.8	1%	0.013	15%	0.154	C	C	.	.	H	α-helix	trans	-92.5	-2.3	-177	-65.3	8	0	0	0	112.5	W401 L402 I453 A456 F461 L464 L493 A494 L495 L499	W401-F497 HydrophobicContact CB-CB 4.32Å; W401-F497 WeakPolarHBondContact CB-O 3.32Å; W401-F497 AromaticContact CD2-CD1 3.89Å; W401-F497 HydrophobicContact CD2-CD1 3.89Å; W401-F497 HydrophobicContact CD2-CE1 4.32Å; W401-F497 HydrophobicContact CD2-CG 4.29Å; W401-F497 AromaticContact CE3-CD1 3.77Å; W401-F497 HydrophobicContact CE3-CD1 3.77Å; W401-F497 HydrophobicContact CE3-CD2 4.32Å; W401-F497 AromaticContact CE3-CE1 3.9Å; W401-F497 HydrophobicContact CE3-CE1 3.9Å; W401-F497 HydrophobicContact CE3-CE2 4.43Å; W401-F497 HydrophobicContact CE3-CG 4.03Å; W401-F497 HydrophobicContact CE3-CZ 4.24Å; W401-F497 HydrophobicContact CG-CD1 4.44Å; W401-F497 HydrophobicContact CH2-CD1 4.19Å; W401-F497 AromaticContact CH2-CE1 3.64Å; W401-F497 HydrophobicContact CH2-CE1 3.64Å; W401-F497 HydrophobicContact CH2-CZ 4.13Å; W401-F497 HydrophobicContact CZ2-CD1 4.3Å; W401-F497 HydrophobicContact CZ2-CE1 4.08Å; W401-F497 AromaticContact CZ3-CD1 3.93Å; W401-F497 HydrophobicContact CZ3-CD1 3.93Å; W401-F497 AromaticContact CZ3-CE1 3.55Å; W401-F497 HydrophobicContact CZ3-CE1 3.55Å; W401-F497 HydrophobicContact CZ3-CE2 4.25Å; W401-F497 HydrophobicContact CZ3-CG 4.47Å; W401-F497 AromaticContact CZ3-CZ 3.74Å; W401-F497 HydrophobicContact CZ3-CZ 3.74Å; L402-F497 HydrophobicContact CD1-CD2 4.4Å; L402-F497 HydrophobicContact CD1-CE2 4.46Å; L402-F497 HydrophobicContact CD2-CE2 4.21Å; L402-F497 HydrophobicContact CG-CD2 4.36Å; L402-F497 HydrophobicContact CG-CE2 4.43Å; I453-F497 HydrophobicContact CG2-CZ 4.24Å; A456-F497 HydrophobicContact CB-CZ 4.49Å; F461-F497 HydrophobicContact CD2-CE2 4.09Å; F461-F497 HydrophobicContact CD2-CZ 4.38Å; F461-F497 AromaticContact CE2-CE2 3.83Å; F461-F497 HydrophobicContact CE2-CE2 3.83Å; F461-F497 HydrophobicContact CE2-CZ 4.25Å; L464-F497 HydrophobicContact CD1-CD2 3.54Å; L464-F497 HydrophobicContact CD1-CE2 3.82Å; L464-F497 HydrophobicContact CD1-CG 4.43Å; L464-F497 HydrophobicContact CD2-CD2 4.2Å; L464-F497 HydrophobicContact CD2-CE2 4.3Å; L493-F497 HydrophobicContact CD2-CE1 4.34Å; L493-F497 HydrophobicContact CD2-CZ 4.18Å; L493-F497 WeakPolarHBondContact O-CB 3.41Å; L493-F497 WeakPolarHBondContact O-CG 3.41Å; L493-F497 PolarHBondContact O-N 3.16Å; A494-F497 PolarHBondContact O-N 3.11Å; L495-F497 VanDerWaalsContact C-N 3.34Å; L495-F497 PolarHBondContact O-N 3.32Å; F497-L499 HydrophobicContact CB-CD1 4.2Å; F497-L499 HydrophobicContact CB-CG 4.22Å
498	K	93	Very high	89.7	Confident	172 Å²	172	32.1 Å²	32.1	75%	0.748	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	49.9	179.7	-52.6	-174.2	177	-166.5	0	113.1	A494 L495	A494-K498 WeakPolarHBondContact O-CA 3.35Å; A494-K498 PolarHBondContact O-N 3.3Å; L495-K498 PolarHBondContact O-N 3.38Å
499	L	92.7	Very high	89.1	Confident	16 Å²	16	33 Å²	33	8%	0.084	16%	0.164	C	C	.	.			trans	-101.7	81.5	177.4	-65.1	171.3	0	0	0	109.9	C399 L464 L468 A494 F497 R501 L502 E503	C399-L499 HydrophobicContact CB-CD2 4.18Å; L464-L499 HydrophobicContact CD1-CD1 3.9Å; L464-L499 HydrophobicContact CD2-CD1 4.31Å; L464-L499 HydrophobicContact CG-CD1 4.05Å; L468-L499 HydrophobicContact CD2-CD1 4.18Å; L468-L499 HydrophobicContact CD2-CD2 4.24Å; A494-L499 HydrophobicContact CB-CB 4.43Å; A494-L499 PolarHBondContact O-N 2.8Å; F497-L499 HydrophobicContact CB-CD1 4.2Å; F497-L499 HydrophobicContact CB-CG 4.22Å; L499-R501 VanDerWaalsContact C-N 3.28Å; L499-R501 PolarHBondContact O-N 3.38Å; L499-L502 HydrophobicContact CB-CB 3.83Å; L499-L502 HydrophobicContact CB-CD2 4.48Å; L499-L502 HydrophobicContact CD1-CD2 3.84Å; L499-L502 PolarHBondContact O-N 3.45Å; L499-E503 WeakPolarHBondContact O-CB 3.39Å; L499-E503 PolarHBondContact O-N 3.4Å
500	S	89.7	Confident	88.6	Confident	31 Å²	31	30.7 Å²	30.7	22%	0.217	15%	0.152	C	C	.	.	H	α-helix	trans	-54.5	-40.2	-174.1	-42.5	0	0	0	0	113.2	E503 Q504 D586	S500-E503 WeakPolarHBondContact O-CB 3.22Å; S500-E503 PolarHBondContact O-N 3.34Å; S500-Q504 VanDerWaalsContact O-CG 3.31Å; S500-Q504 WeakPolarHBondContact O-CG 3.23Å; S500-Q504 PolarHBondContact O-N 3.05Å; S500-Q504 VanDerWaalsContact O-N 3.09Å; S500-D586 PolarHBondContact OG-OD2 3.21Å
501	R	86.3	Confident	88	Confident	19 Å²	19	34.3 Å²	34.3	7%	0.072	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-40.9	178.6	-168.2	171.7	175.2	109.8	-13.6	112.5	L258 R259 F467 D471 L499 L505 I587 T589	L258-R501 PolarHBondContact O-NE 2.97Å; L258-R501 PolarHBondContact O-NH1 2.75Å; L258-R501 PolarHBondContact O-NH2 3.3Å; R259-R501 PolarHBondContact O-NH2 3.32Å; F467-R501 HydrophobicContact CE2-CG 4.44Å; F467-R501 HydrophobicContact CZ-CB 4.12Å; F467-R501 HydrophobicContact CZ-CG 4.21Å; D471-R501 IonicContact OD1-NE 3.33Å; D471-R501 PolarHBondContact OD1-NE 3.29Å; D471-R501 IonicContact OD2-CZ 3.84Å; D471-R501 IonicContact OD2-NE 2.76Å; D471-R501 PolarHBondContact OD2-NE 3.27Å; D471-R501 IonicContact OD2-NH2 3.8Å; D471-R501 PolarHBondContact OD2-NH2 2.94Å; L499-R501 VanDerWaalsContact C-N 3.28Å; L499-R501 PolarHBondContact O-N 3.38Å; R501-L505 VanDerWaalsContact O-CG 3.29Å; R501-L505 WeakPolarHBondContact O-CG 3.34Å; R501-L505 PolarHBondContact O-N 3.29Å; R501-L505 VanDerWaalsContact O-N 3.09Å; R501-I587 WeakPolarHBondContact CA-O 3.4Å; R501-I587 VanDerWaalsContact CB-O 3.24Å; R501-I587 WeakPolarHBondContact CB-O 3.35Å; R501-T589 WeakPolarHBondContact CD-O 3.32Å
502	L	89.7	Confident	87	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69.9	-38.1	176.7	-177.5	63.4	0	0	0	111.3	L464 F467 I473 V490 A494 L499 Q504 L505 C506	L464-L502 HydrophobicContact CB-CD2 4.3Å; L464-L502 HydrophobicContact CD1-CD2 4Å; L464-L502 HydrophobicContact CG-CD2 3.86Å; F467-L502 HydrophobicContact CB-CD1 3.96Å; F467-L502 HydrophobicContact CD1-CB 3.95Å; F467-L502 HydrophobicContact CD1-CD1 3.96Å; F467-L502 HydrophobicContact CD1-CD2 4.04Å; F467-L502 HydrophobicContact CD1-CG 4.21Å; F467-L502 HydrophobicContact CD2-CD1 3.9Å; F467-L502 HydrophobicContact CE1-CB 3.74Å; F467-L502 HydrophobicContact CE1-CG 4.5Å; F467-L502 HydrophobicContact CE2-CB 4.44Å; F467-L502 HydrophobicContact CE2-CD1 4.46Å; F467-L502 HydrophobicContact CG-CB 4.4Å; F467-L502 HydrophobicContact CG-CD1 3.64Å; F467-L502 HydrophobicContact CG-CD2 4.46Å; F467-L502 HydrophobicContact CG-CG 4.38Å; F467-L502 HydrophobicContact CZ-CB 4.01Å; I473-L502 HydrophobicContact CD1-CD1 3.46Å; I473-L502 VanDerWaalsContact CD1-CD1 3.46Å; I473-L502 HydrophobicContact CG1-CD1 3.85Å; V490-L502 HydrophobicContact CG1-CD1 4.11Å; V490-L502 HydrophobicContact CG1-CD2 4.05Å; V490-L502 HydrophobicContact CG1-CG 4.28Å; A494-L502 HydrophobicContact CB-CB 3.95Å; A494-L502 HydrophobicContact CB-CD2 3.8Å; A494-L502 HydrophobicContact CB-CG 3.73Å; L499-L502 HydrophobicContact CB-CB 3.83Å; L499-L502 HydrophobicContact CB-CD2 4.48Å; L499-L502 HydrophobicContact CD1-CD2 3.84Å; L499-L502 PolarHBondContact O-N 3.45Å; L502-Q504 PolarHBondContact O-N 3.33Å; L502-L505 WeakPolarHBondContact O-CB 3.17Å; L502-L505 PolarHBondContact O-N 2.88Å; L502-C506 PolarHBondContact O-N 3.34Å; L502-C506 PolarHBondContact O-SG 2.94Å
503	E	89.4	Confident	86.3	Confident	43 Å²	43	33.7 Å²	33.7	20%	0.201	18%	0.18	C	C	.	.	H	α-helix	trans	-54.1	-53.3	174	-177.3	-168.7	150.7	0	0	110.5	Y491 A494 L495 L499 S500 L505 C506 V507	Y491-E503 HydrophobicContact CD2-CG 4.05Å; Y491-E503 HydrophobicContact CE2-CB 4.38Å; Y491-E503 HydrophobicContact CE2-CG 3.42Å; Y491-E503 VanDerWaalsContact CE2-CG 3.42Å; A494-E503 HydrophobicContact CB-CB 4.27Å; L495-E503 VanDerWaalsContact CD2-CD 3.45Å; L495-E503 HydrophobicContact CD2-CG 3.8Å; L495-E503 HydrophobicContact CG-CG 4.36Å; L499-E503 WeakPolarHBondContact O-CB 3.39Å; L499-E503 PolarHBondContact O-N 3.4Å; S500-E503 WeakPolarHBondContact O-CB 3.22Å; S500-E503 PolarHBondContact O-N 3.34Å; E503-L505 PolarHBondContact O-N 2.88Å; E503-C506 PolarHBondContact O-N 3.06Å; E503-V507 WeakPolarHBondContact O-CG2 3.22Å; E503-V507 PolarHBondContact O-N 2.9Å
504	Q	82.1	Confident	85.7	Confident	48 Å²	48	33.8 Å²	33.8	22%	0.224	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-44.2	177.3	-69.6	-71.8	-47	0	0	112.5	L258 S500 L502 C506 V507 Q508 V585	L258-Q504 HydrophobicContact CD2-CB 4.25Å; S500-Q504 VanDerWaalsContact O-CG 3.31Å; S500-Q504 WeakPolarHBondContact O-CG 3.23Å; S500-Q504 PolarHBondContact O-N 3.05Å; S500-Q504 VanDerWaalsContact O-N 3.09Å; L502-Q504 PolarHBondContact O-N 3.33Å; Q504-C506 VanDerWaalsContact C-N 3.32Å; Q504-C506 PolarHBondContact O-N 3.27Å; Q504-V507 PolarHBondContact O-N 3.49Å; Q504-Q508 WeakPolarHBondContact O-CB 3.35Å; Q504-Q508 VanDerWaalsContact O-CG 3.29Å; Q504-Q508 WeakPolarHBondContact O-CG 3.38Å; Q504-Q508 PolarHBondContact O-N 2.98Å; Q504-V585 VanDerWaalsContact CD-CG1 3.41Å; Q504-V585 HydrophobicContact CG-CG1 4.32Å
505	L	79.8	Confident	85.3	Confident	10 Å²	10	36.7 Å²	36.7	5%	0.052	20%	0.197	C	C	.	.	H	α-helix	trans	-58	-43.2	177.7	-80.6	167	0	0	0	112.5	L258 F467 I473 Y475 R501 L502 E503 Y509	L258-L505 HydrophobicContact CB-CD2 3.85Å; L258-L505 HydrophobicContact CD1-CD2 3.52Å; L258-L505 HydrophobicContact CD2-CB 4.36Å; L258-L505 HydrophobicContact CD2-CD2 3.63Å; L258-L505 HydrophobicContact CD2-CG 3.83Å; L258-L505 HydrophobicContact CG-CD2 3.86Å; F467-L505 HydrophobicContact CD2-CD1 3.7Å; F467-L505 HydrophobicContact CE2-CD1 3.34Å; F467-L505 HydrophobicContact CZ-CD1 4.33Å; I473-L505 HydrophobicContact CD1-CB 3.82Å; I473-L505 HydrophobicContact CG1-CD1 4.41Å; Y475-L505 WeakPolarHBondContact OH-CD2 3.37Å; R501-L505 VanDerWaalsContact O-CG 3.29Å; R501-L505 WeakPolarHBondContact O-CG 3.34Å; R501-L505 PolarHBondContact O-N 3.29Å; R501-L505 VanDerWaalsContact O-N 3.09Å; L502-L505 WeakPolarHBondContact O-CB 3.17Å; L502-L505 PolarHBondContact O-N 2.88Å; E503-L505 PolarHBondContact O-N 2.88Å; L505-Y509 WeakPolarHBondContact O-CB 3.36Å; L505-Y509 PolarHBondContact O-N 3.41Å
506	C	86.4	Confident	84.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-71.2	-46.1	179.8	-64.2	0	0	0	0	111.7	I487 Y491 L502 E503 Q504 Q508 Y509 I510	I487-C506 HydrophobicContact CG2-CB 3.72Å; Y491-C506 HydrophobicContact CD2-CB 3.95Å; Y491-C506 HydrophobicContact CG-CB 4.11Å; L502-C506 PolarHBondContact O-N 3.34Å; L502-C506 PolarHBondContact O-SG 2.94Å; E503-C506 PolarHBondContact O-N 3.06Å; Q504-C506 VanDerWaalsContact C-N 3.32Å; Q504-C506 PolarHBondContact O-N 3.27Å; C506-Q508 VanDerWaalsContact C-N 3.32Å; C506-Q508 PolarHBondContact O-N 2.91Å; C506-Y509 PolarHBondContact O-N 3.33Å; C506-I510 HydrophobicContact CB-CD1 4.44Å; C506-I510 WeakPolarHBondContact O-CB 3.22Å; C506-I510 VanDerWaalsContact O-CD1 3.29Å; C506-I510 WeakPolarHBondContact O-CD1 3.28Å; C506-I510 WeakPolarHBondContact O-CG1 3.14Å; C506-I510 PolarHBondContact O-N 2.84Å
507	V	83.4	Confident	84.5	Confident	20 Å²	20	41.3 Å²	41.3	12%	0.121	21%	0.211	C	C	.	.	H	α-helix	trans	-55.5	-50.6	178.6	172.7	0	0	0	0	110.2	Y491 E503 Q504 Y509 I510 E511	Y491-V507 HydrophobicContact CD2-CG2 3.92Å; Y491-V507 HydrophobicContact CE1-CG2 4.31Å; Y491-V507 HydrophobicContact CE2-CG2 3.24Å; E503-V507 WeakPolarHBondContact O-CG2 3.22Å; E503-V507 PolarHBondContact O-N 2.9Å; Q504-V507 PolarHBondContact O-N 3.49Å; V507-Y509 PolarHBondContact O-N 2.82Å; V507-I510 PolarHBondContact O-N 3.44Å; V507-E511 HydrophobicContact CG1-CG 4.08Å; V507-E511 WeakPolarHBondContact O-CB 3.5Å; V507-E511 VanDerWaalsContact O-CG 3.3Å; V507-E511 WeakPolarHBondContact O-CG 3.22Å; V507-E511 PolarHBondContact O-N 3.34Å
508	Q	75.3	Confident	84.2	Confident	32 Å²	32	41.2 Å²	41.2	15%	0.15	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-45.6	-176.8	-70.2	178.5	26.2	0	0	112.3	L258 Q504 C506 I510 E511 A512	L258-Q508 VanDerWaalsContact CD1-OE1 3.24Å; L258-Q508 HydrophobicContact CD2-CG 4.45Å; Q504-Q508 WeakPolarHBondContact O-CB 3.35Å; Q504-Q508 VanDerWaalsContact O-CG 3.29Å; Q504-Q508 WeakPolarHBondContact O-CG 3.38Å; Q504-Q508 PolarHBondContact O-N 2.98Å; C506-Q508 VanDerWaalsContact C-N 3.32Å; C506-Q508 PolarHBondContact O-N 2.91Å; Q508-I510 VanDerWaalsContact C-N 3.33Å; Q508-I510 PolarHBondContact O-N 3.18Å; Q508-E511 PolarHBondContact O-N 2.95Å; Q508-A512 VanDerWaalsContact O-CB 3.27Å; Q508-A512 WeakPolarHBondContact O-CB 3.49Å; Q508-A512 PolarHBondContact O-N 3.2Å
509	Y	78.5	Confident	84.1	Confident	17 Å²	17	33 Å²	33	7%	0.067	18%	0.175	C	C	.	.	H	α-helix	trans	-59.8	-45.9	176.1	173.7	-100.7	0	0	0	112	Y475 I487 L505 C506 V507 A512 S513	Y475-Y509 HydrophobicContact CD1-CD1 4.22Å; Y475-Y509 AromaticContact CD1-CD2 3Å; Y475-Y509 HydrophobicContact CD1-CD2 3Å; Y475-Y509 AromaticContact CD1-CE2 3.4Å; Y475-Y509 HydrophobicContact CD1-CE2 3.4Å; Y475-Y509 AromaticContact CD1-CG 3.45Å; Y475-Y509 HydrophobicContact CD1-CG 3.45Å; Y475-Y509 VanDerWaalsContact CD1-CG 3.45Å; Y475-Y509 HydrophobicContact CD2-CD2 4.44Å; Y475-Y509 VanDerWaalsContact CE1-CB 3.42Å; Y475-Y509 HydrophobicContact CE1-CD1 4.4Å; Y475-Y509 AromaticContact CE1-CD2 3.41Å; Y475-Y509 HydrophobicContact CE1-CD2 3.41Å; Y475-Y509 VanDerWaalsContact CE1-CD2 3.41Å; Y475-Y509 HydrophobicContact CE1-CE2 4.25Å; Y475-Y509 AromaticContact CE1-CG 3.47Å; Y475-Y509 HydrophobicContact CE1-CG 3.47Å; Y475-Y509 VanDerWaalsContact CE1-CG 3.47Å; Y475-Y509 AromaticContact CG-CD2 3.59Å; Y475-Y509 HydrophobicContact CG-CD2 3.59Å; Y475-Y509 AromaticContact CG-CE2 3.74Å; Y475-Y509 HydrophobicContact CG-CE2 3.74Å; Y475-Y509 HydrophobicContact CG-CG 4.44Å; I487-Y509 HydrophobicContact CB-CD1 3.85Å; I487-Y509 HydrophobicContact CB-CE1 4.06Å; I487-Y509 HydrophobicContact CG1-CD1 3.7Å; I487-Y509 HydrophobicContact CG1-CE1 3.61Å; I487-Y509 HydrophobicContact CG2-CD1 3.72Å; I487-Y509 HydrophobicContact CG2-CE1 4.44Å; L505-Y509 WeakPolarHBondContact O-CB 3.36Å; L505-Y509 PolarHBondContact O-N 3.41Å; C506-Y509 PolarHBondContact O-N 3.33Å; V507-Y509 PolarHBondContact O-N 2.82Å; Y509-A512 PolarHBondContact O-N 3.45Å; Y509-S513 WeakPolarHBondContact CE2-OG 3.29Å; Y509-S513 WeakPolarHBondContact O-CB 3.44Å; Y509-S513 PolarHBondContact O-N 3.01Å; Y509-S513 PolarHBondContact O-OG 3.19Å
510	I	82.8	Confident	84	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.2	-50.9	-178.6	-61.8	158.3	0	0	0	109.1	V484 I487 M488 C506 V507 Q508 A512 S513 V514 V522 L534	V484-I510 HydrophobicContact CG1-CB 4.49Å; V484-I510 HydrophobicContact CG1-CG1 4.34Å; V484-I510 HydrophobicContact CG1-CG2 3.81Å; I487-I510 HydrophobicContact CB-CG1 4.35Å; I487-I510 HydrophobicContact CG2-CD1 4.09Å; I487-I510 HydrophobicContact CG2-CG1 3.91Å; M488-I510 HydrophobicContact CB-CD1 4.41Å; M488-I510 HydrophobicContact CG-CD1 3.66Å; M488-I510 HydrophobicContact CG-CG1 4.21Å; C506-I510 HydrophobicContact CB-CD1 4.44Å; C506-I510 WeakPolarHBondContact O-CB 3.22Å; C506-I510 VanDerWaalsContact O-CD1 3.29Å; C506-I510 WeakPolarHBondContact O-CD1 3.28Å; C506-I510 WeakPolarHBondContact O-CG1 3.14Å; C506-I510 PolarHBondContact O-N 2.84Å; V507-I510 PolarHBondContact O-N 3.44Å; Q508-I510 VanDerWaalsContact C-N 3.33Å; Q508-I510 PolarHBondContact O-N 3.18Å; I510-A512 VanDerWaalsContact C-N 3.29Å; I510-A512 PolarHBondContact O-N 3.19Å; I510-S513 CarbonylContact O-C 3.59Å; I510-S513 PolarHBondContact O-N 3.47Å; I510-V514 HydrophobicContact CG2-CG2 4.27Å; I510-V514 WeakPolarHBondContact O-CG2 3.18Å; I510-V514 PolarHBondContact O-N 3.03Å; I510-V522 HydrophobicContact CG2-CG1 3.95Å; I510-L534 HydrophobicContact CB-CD1 4.05Å; I510-L534 HydrophobicContact CD1-CD2 4.05Å; I510-L534 HydrophobicContact CG2-CD1 3.4Å; I510-L534 VanDerWaalsContact CG2-CD1 3.4Å; I510-L534 HydrophobicContact CG2-CD2 3.87Å; I510-L534 HydrophobicContact CG2-CG 4.21Å
511	E	80.4	Confident	84.1	Confident	77 Å²	77	33.2 Å²	33.2	36%	0.36	18%	0.177	S	C	.	.	H	α-helix	trans	-57.1	-39.4	178.6	-70.5	-168.9	146.5	0	0	112.9	V507 Q508 S513 H537	V507-E511 HydrophobicContact CG1-CG 4.08Å; V507-E511 WeakPolarHBondContact O-CB 3.5Å; V507-E511 VanDerWaalsContact O-CG 3.3Å; V507-E511 WeakPolarHBondContact O-CG 3.22Å; V507-E511 PolarHBondContact O-N 3.34Å; Q508-E511 PolarHBondContact O-N 2.95Å; E511-S513 VanDerWaalsContact C-N 3.31Å; E511-H537 WeakPolarHBondContact CG-ND1 3.4Å; E511-H537 IonicContact OE1-CE1 3.63Å; E511-H537 IonicContact OE1-CG 2.7Å; E511-H537 IonicContact OE1-ND1 3.36Å; E511-H537 PolarHBondContact OE1-ND1 2.68Å
512	A	73.6	Confident	84.3	Confident	62 Å²	62	32.3 Å²	32.3	51%	0.512	17%	0.174	S	C	.	.	H	α-helix	trans	-71.8	-25.5	176.2	0	0	0	0	0	113.2	Q508 Y509 I510	Q508-A512 VanDerWaalsContact O-CB 3.27Å; Q508-A512 WeakPolarHBondContact O-CB 3.49Å; Q508-A512 PolarHBondContact O-N 3.2Å; Y509-A512 PolarHBondContact O-N 3.45Å; I510-A512 VanDerWaalsContact C-N 3.29Å; I510-A512 PolarHBondContact O-N 3.19Å
513	S	79.1	Confident	84.4	Confident	20 Å²	20	32.3 Å²	32.3	14%	0.14	17%	0.174	C	C	.	.	H	α-helix	trans	-92.6	-14.1	-178.2	-57.3	0	0	0	0	113.3	Y509 I510 E511 D515 N518	Y509-S513 WeakPolarHBondContact CE2-OG 3.29Å; Y509-S513 WeakPolarHBondContact O-CB 3.44Å; Y509-S513 PolarHBondContact O-N 3.01Å; Y509-S513 PolarHBondContact O-OG 3.19Å; I510-S513 CarbonylContact O-C 3.59Å; I510-S513 PolarHBondContact O-N 3.47Å; E511-S513 VanDerWaalsContact C-N 3.31Å; S513-D515 PolarHBondContact O-N 3.38Å; S513-N518 PolarHBondContact O-ND2 2.98Å
514	V	83.4	Confident	84.5	Confident	11 Å²	11	32.9 Å²	32.9	7%	0.067	18%	0.176	C	C	.	.			trans	-68	122.3	177.6	173.5	0	0	0	0	110.5	I510 N518 V519 V522 F541	I510-V514 HydrophobicContact CG2-CG2 4.27Å; I510-V514 WeakPolarHBondContact O-CG2 3.18Å; I510-V514 PolarHBondContact O-N 3.03Å; V514-N518 WeakPolarHBondContact CA-OD1 3.49Å; V514-V519 HydrophobicContact CG1-CB 3.69Å; V514-V519 HydrophobicContact CG1-CG2 3.62Å; V514-V522 HydrophobicContact CG2-CB 4.48Å; V514-V522 HydrophobicContact CG2-CG1 4.03Å; V514-V522 HydrophobicContact CG2-CG2 4.49Å; V514-F541 HydrophobicContact CG1-CD1 4.27Å; V514-F541 HydrophobicContact CG1-CD2 4.19Å; V514-F541 HydrophobicContact CG1-CE2 4.47Å; V514-F541 HydrophobicContact CG1-CG 4.1Å
515	D	84.6	Confident	85	Confident	62 Å²	62	32.1 Å²	32.1	33%	0.332	17%	0.174	S	C	.	.			trans	-135	-176	177	71.6	19.4	0	0	0	112.2	S513 Q517 N518 V519	S513-D515 PolarHBondContact O-N 3.38Å; D515-Q517 PolarHBondContact O-N 3.2Å; D515-Q517 WeakPolarHBondContact OD1-CA 3.3Å; D515-Q517 WeakPolarHBondContact OD1-CB 3.39Å; D515-Q517 PolarHBondContact OD1-N 3.24Å; D515-N518 PolarHBondContact N-OD1 3.09Å; D515-N518 PolarHBondContact O-OD1 2.78Å; D515-N518 VanDerWaalsContact OD1-CG 3.29Å; D515-N518 PolarHBondContact OD1-N 3.09Å; D515-N518 PolarHBondContact OD1-OD1 2.99Å; D515-V519 WeakPolarHBondContact O-CB 3.37Å; D515-V519 WeakPolarHBondContact O-CG1 3.25Å; D515-V519 PolarHBondContact O-N 3.34Å; D515-V519 VanDerWaalsContact O-N 3.1Å
516	L	84.9	Confident	85.6	Confident	57 Å²	57	31.7 Å²	31.7	30%	0.298	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-23.9	-179.6	-67.7	169.6	0	0	0	113.6	F541 H547 Q550 V551	L516-F541 HydrophobicContact CD2-CE1 4.14Å; L516-H547 HydrophobicContact CD2-CB 3.7Å; L516-Q550 HydrophobicContact CD2-CB 4.42Å; L516-V551 HydrophobicContact CD2-CG2 3.88Å
517	Q	85	Confident	85.9	Confident	167 Å²	167	34.5 Å²	34.5	78%	0.78	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-34.6	-176.4	-59.4	-174.9	-4	0	0	111.8	D515	D515-Q517 PolarHBondContact O-N 3.2Å; D515-Q517 WeakPolarHBondContact OD1-CA 3.3Å; D515-Q517 WeakPolarHBondContact OD1-CB 3.39Å; D515-Q517 PolarHBondContact OD1-N 3.24Å
518	N	88.1	Confident	86.2	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-16.2	-172.2	67.2	26.6	0	0	0	115.1	V481 S513 V514 D515 L520 S521 V522	V481-N518 HydrophobicContact CG2-CB 3.64Å; S513-N518 PolarHBondContact O-ND2 2.98Å; V514-N518 WeakPolarHBondContact CA-OD1 3.49Å; D515-N518 PolarHBondContact N-OD1 3.09Å; D515-N518 PolarHBondContact O-OD1 2.78Å; D515-N518 VanDerWaalsContact OD1-CG 3.29Å; D515-N518 PolarHBondContact OD1-N 3.09Å; D515-N518 PolarHBondContact OD1-OD1 2.99Å; N518-L520 VanDerWaalsContact C-N 3.27Å; N518-L520 PolarHBondContact O-N 3.04Å; N518-L520 VanDerWaalsContact O-N 3.08Å; N518-S521 PolarHBondContact O-N 2.72Å; N518-S521 VanDerWaalsContact O-N 3.09Å; N518-V522 HydrophobicContact CB-CG2 4.43Å; N518-V522 WeakPolarHBondContact O-CG2 3.26Å; N518-V522 PolarHBondContact O-N 2.96Å; N518-V522 VanDerWaalsContact O-N 3.07Å
519	V	90.4	Very high	86.9	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-54.9	-36.1	-168.9	63.3	0	0	0	0	114.7	V514 D515 C523 C538 F541 V542 V551	V514-V519 HydrophobicContact CG1-CB 3.69Å; V514-V519 HydrophobicContact CG1-CG2 3.62Å; D515-V519 WeakPolarHBondContact O-CB 3.37Å; D515-V519 WeakPolarHBondContact O-CG1 3.25Å; D515-V519 PolarHBondContact O-N 3.34Å; D515-V519 VanDerWaalsContact O-N 3.1Å; V519-C523 WeakPolarHBondContact O-CB 3.34Å; V519-C523 PolarHBondContact O-N 3.13Å; V519-C538 HydrophobicContact CG2-CB 4.07Å; V519-F541 HydrophobicContact CB-CD1 4.1Å; V519-F541 HydrophobicContact CB-CE1 4.32Å; V519-F541 HydrophobicContact CG1-CD1 4.26Å; V519-F541 HydrophobicContact CG1-CE1 4.32Å; V519-F541 HydrophobicContact CG2-CB 4.36Å; V519-F541 HydrophobicContact CG2-CD1 3.8Å; V519-F541 HydrophobicContact CG2-CG 4.36Å; V519-V542 HydrophobicContact CB-CG2 4.42Å; V519-V542 HydrophobicContact CG1-CG2 3.92Å; V519-V542 HydrophobicContact CG2-CG2 3.58Å; V519-V551 HydrophobicContact CG1-CG1 4.31Å; V519-V551 HydrophobicContact CG1-CG2 4.12Å
520	L	91.6	Very high	87.5	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.052	24%	0.242	C	C	.	.	H	α-helix	trans	-70.4	-42.7	-179	-66.8	179.2	0	0	0	112.1	N518 C523 E524 V542 V551 T554 E556 F557 L560 I568	N518-L520 VanDerWaalsContact C-N 3.27Å; N518-L520 PolarHBondContact O-N 3.04Å; N518-L520 VanDerWaalsContact O-N 3.08Å; L520-C523 PolarHBondContact O-N 2.89Å; L520-E524 WeakPolarHBondContact O-CB 3.32Å; L520-E524 PolarHBondContact O-N 2.87Å; L520-V542 HydrophobicContact CD2-CG2 4.4Å; L520-V551 HydrophobicContact CD1-CG1 3.79Å; L520-V551 HydrophobicContact CD2-CG1 3.6Å; L520-V551 HydrophobicContact CG-CG1 3.7Å; L520-T554 WeakPolarHBondContact CD1-OG1 3.3Å; L520-E556 HydrophobicContact CD1-CB 3.98Å; L520-F557 HydrophobicContact CD1-CB 3.78Å; L520-F557 HydrophobicContact CD1-CD2 4.07Å; L520-F557 HydrophobicContact CD1-CG 4.45Å; L520-F557 HydrophobicContact CD2-CD2 4.1Å; L520-L560 HydrophobicContact CD2-CD2 4.44Å; L520-I568 HydrophobicContact CD2-CD1 4.37Å
521	S	90.9	Very high	87.9	Confident	41 Å²	41	47 Å²	47	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-64.3	-41.9	175.8	-55.2	0	0	0	0	111.4	N518 E524 N525	N518-S521 PolarHBondContact O-N 2.72Å; N518-S521 VanDerWaalsContact O-N 3.09Å; S521-E524 PolarHBondContact O-N 3.49Å; S521-N525 WeakPolarHBondContact O-CB 3.3Å; S521-N525 PolarHBondContact O-N 2.84Å
522	V	90.6	Very high	88.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-44.6	175.5	-179.3	0	0	0	0	110.4	V484 M488 I510 V514 N518 E524 N525 A526 L534 C538	V484-V522 HydrophobicContact CB-CG2 4.41Å; V484-V522 HydrophobicContact CG1-CG1 4.4Å; V484-V522 HydrophobicContact CG1-CG2 3.67Å; M488-V522 HydrophobicContact CE-CG1 4.36Å; M488-V522 WeakPolarHBondContact CE-O 3.31Å; M488-V522 HydrophobicContact SD-CB 4.41Å; M488-V522 HydrophobicContact SD-CG1 3.78Å; I510-V522 HydrophobicContact CG2-CG1 3.95Å; V514-V522 HydrophobicContact CG2-CB 4.48Å; V514-V522 HydrophobicContact CG2-CG1 4.03Å; V514-V522 HydrophobicContact CG2-CG2 4.49Å; N518-V522 HydrophobicContact CB-CG2 4.43Å; N518-V522 WeakPolarHBondContact O-CG2 3.26Å; N518-V522 PolarHBondContact O-N 2.96Å; N518-V522 VanDerWaalsContact O-N 3.07Å; V522-E524 PolarHBondContact O-N 2.93Å; V522-N525 PolarHBondContact O-N 2.71Å; V522-A526 VanDerWaalsContact O-CB 3.29Å; V522-A526 WeakPolarHBondContact O-CB 3.37Å; V522-A526 PolarHBondContact O-N 3.47Å; V522-L534 HydrophobicContact CG1-CD2 4.36Å; V522-C538 VanDerWaalsContact CG1-SG 3.57Å
523	C	92	Very high	88.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-43	178.6	-170.2	0	0	0	0	112.6	V519 L520 N527 C538	V519-C523 WeakPolarHBondContact O-CB 3.34Å; V519-C523 PolarHBondContact O-N 3.13Å; L520-C523 PolarHBondContact O-N 2.89Å; C523-N527 PolarHBondContact O-N 3.08Å; C523-N527 VanDerWaalsContact O-N 3.17Å; C523-C538 HydrophobicContact CB-CB 3.7Å
524	E	91.9	Very high	89.2	Confident	55 Å²	55	51.5 Å²	51.5	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-65.7	-44.2	178.6	-164.4	-165.1	162.2	0	0	111.4	L520 S521 V522 N527 K528 L560 L564	L520-E524 WeakPolarHBondContact O-CB 3.32Å; L520-E524 PolarHBondContact O-N 2.87Å; S521-E524 PolarHBondContact O-N 3.49Å; V522-E524 PolarHBondContact O-N 2.93Å; E524-N527 WeakPolarHBondContact O-CB 3.27Å; E524-N527 PolarHBondContact O-N 2.97Å; E524-K528 PolarHBondContact O-N 2.84Å; E524-K528 WeakPolarHBondContact OE1-CE 3.38Å; E524-K528 IonicContact OE1-NZ 2.69Å; E524-K528 PolarHBondContact OE1-NZ 3.04Å; E524-K528 IonicContact OE2-NZ 3.6Å; E524-L560 HydrophobicContact CB-CD1 3.89Å; E524-L560 HydrophobicContact CG-CD1 4.13Å; E524-L564 HydrophobicContact CB-CD1 4.15Å; E524-L564 HydrophobicContact CG-CD1 3.96Å
525	N	92.1	Very high	89.6	Confident	33 Å²	33	52 Å²	52	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-38.5	179.1	-163	-66.4	0	0	0	111.5	L485 M488 S521 V522 N527 K528 L529	L485-N525 HydrophobicContact CD2-CB 3.57Å; M488-N525 HydrophobicContact CE-CB 3.69Å; M488-N525 HydrophobicContact SD-CB 4.25Å; S521-N525 WeakPolarHBondContact O-CB 3.3Å; S521-N525 PolarHBondContact O-N 2.84Å; V522-N525 PolarHBondContact O-N 2.71Å; N525-N527 PolarHBondContact O-N 3.32Å; N525-K528 WeakPolarHBondContact O-CB 3.43Å; N525-K528 PolarHBondContact O-N 3.3Å; N525-L529 PolarHBondContact O-N 3.1Å; N525-L529 WeakPolarHBondContact OD1-CD1 3.34Å; N525-L529 WeakPolarHBondContact OD1-CG 3.44Å
526	A	93	Very high	89.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-38.3	175	0	0	0	0	0	111.1	M488 V522 Q530 L531 L534 K535	M488-A526 HydrophobicContact CE-CB 3.84Å; V522-A526 VanDerWaalsContact O-CB 3.29Å; V522-A526 WeakPolarHBondContact O-CB 3.37Å; V522-A526 PolarHBondContact O-N 3.47Å; A526-Q530 PolarHBondContact O-N 2.87Å; A526-L531 HydrophobicContact CB-CB 4.3Å; A526-L531 PolarHBondContact O-N 3.18Å; A526-L534 HydrophobicContact CB-CB 4.35Å; A526-L534 HydrophobicContact CB-CD2 4.11Å; A526-L534 HydrophobicContact CB-CG 4.21Å; A526-K535 HydrophobicContact CB-CB 4.01Å
527	N	92.3	Very high	90	Very high	60 Å²	60	52 Å²	52	32%	0.321	25%	0.253	S	S	.	.	H	α-helix	trans	-67.9	-40.3	173.8	-172.1	76.5	0	0	0	112.7	C523 E524 N525 Q530 K535 L564	C523-N527 PolarHBondContact O-N 3.08Å; C523-N527 VanDerWaalsContact O-N 3.17Å; E524-N527 WeakPolarHBondContact O-CB 3.27Å; E524-N527 PolarHBondContact O-N 2.97Å; N525-N527 PolarHBondContact O-N 3.32Å; N527-Q530 PolarHBondContact O-N 2.9Å; N527-K535 HydrophobicContact CB-CD 4.13Å; N527-K535 PolarHBondContact OD1-NZ 2.85Å; N527-L564 HydrophobicContact CB-CD1 4.12Å; N527-L564 HydrophobicContact CB-CD2 4.07Å
528	K	90.8	Very high	90.2	Very high	133 Å²	133	44.1 Å²	44.1	58%	0.578	22%	0.216	S	C	*	.	H	α-helix	trans	-63.8	-41.7	176.4	-72.7	173.8	-176.4	164.3	0	112.2	E524 N525 Q530	E524-K528 PolarHBondContact O-N 2.84Å; E524-K528 WeakPolarHBondContact OE1-CE 3.38Å; E524-K528 IonicContact OE1-NZ 2.69Å; E524-K528 PolarHBondContact OE1-NZ 3.04Å; E524-K528 IonicContact OE2-NZ 3.6Å; N525-K528 WeakPolarHBondContact O-CB 3.43Å; N525-K528 PolarHBondContact O-N 3.3Å; K528-Q530 VanDerWaalsContact C-N 3.28Å; K528-Q530 PolarHBondContact O-N 3.09Å
529	L	89.5	Confident	90.3	Very high	29 Å²	29	44 Å²	44	15%	0.152	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-2.2	179	-63.2	-179.2	0	0	0	113.5	M488 K492 N525 L531	M488-L529 HydrophobicContact CB-CD1 4.03Å; K492-L529 HydrophobicContact CD-CB 4.42Å; K492-L529 HydrophobicContact CD-CD2 3.79Å; N525-L529 PolarHBondContact O-N 3.1Å; N525-L529 WeakPolarHBondContact OD1-CD1 3.34Å; N525-L529 WeakPolarHBondContact OD1-CG 3.44Å; L529-L531 HydrophobicContact CB-CD1 3.72Å; L529-L531 HydrophobicContact CB-CD2 4.45Å; L529-L531 HydrophobicContact CB-CG 3.68Å; L529-L531 HydrophobicContact CD1-CD1 3.84Å; L529-L531 HydrophobicContact CG-CD1 4.45Å
530	Q	91.3	Very high	90.2	Very high	163 Å²	163	47 Å²	47	76%	0.762	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	42.1	-177.5	-57.4	178.2	-13.3	0	0	113.3	A526 N527 K528 D532	A526-Q530 PolarHBondContact O-N 2.87Å; N527-Q530 PolarHBondContact O-N 2.9Å; K528-Q530 VanDerWaalsContact C-N 3.28Å; K528-Q530 PolarHBondContact O-N 3.09Å; Q530-D532 PolarHBondContact O-N 3.24Å
531	L	90.8	Very high	90.1	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.037	24%	0.235	C	C	.	.			trans	-96.8	75.4	-179.7	-57.6	174.2	0	0	0	110.2	M488 Y491 L495 A526 L529 Q533 L534 K535	M488-L531 HydrophobicContact CB-CD1 4.42Å; M488-L531 HydrophobicContact CE-CD1 4.23Å; Y491-L531 HydrophobicContact CD1-CB 4.49Å; Y491-L531 HydrophobicContact CD1-CD1 3.62Å; Y491-L531 HydrophobicContact CD1-CD2 3.66Å; Y491-L531 HydrophobicContact CD1-CG 4.09Å; Y491-L531 HydrophobicContact CE1-CB 4.12Å; Y491-L531 HydrophobicContact CE1-CD1 4.09Å; Y491-L531 HydrophobicContact CE1-CD2 3.63Å; Y491-L531 HydrophobicContact CE1-CG 4.12Å; L495-L531 HydrophobicContact CD1-CD2 3.78Å; A526-L531 HydrophobicContact CB-CB 4.3Å; A526-L531 PolarHBondContact O-N 3.18Å; L529-L531 HydrophobicContact CB-CD1 3.72Å; L529-L531 HydrophobicContact CB-CD2 4.45Å; L529-L531 HydrophobicContact CB-CG 3.68Å; L529-L531 HydrophobicContact CD1-CD1 3.84Å; L529-L531 HydrophobicContact CG-CD1 4.45Å; L531-Q533 PolarHBondContact O-N 3.49Å; L531-L534 HydrophobicContact CB-CB 4.25Å; L531-L534 HydrophobicContact CD1-CD2 4.33Å; L531-L534 PolarHBondContact O-N 3.06Å; L531-L534 VanDerWaalsContact O-N 3.16Å; L531-K535 PolarHBondContact O-N 2.92Å
532	D	88.1	Confident	90	Very high	120 Å²	120	45.8 Å²	45.8	64%	0.642	22%	0.221	S	C	*	.	H	α-helix	trans	-59.3	-41.8	-168.8	-67.3	-36.2	0	0	0	113.9	Q530 L534 K535 E536	Q530-D532 PolarHBondContact O-N 3.24Å; D532-L534 VanDerWaalsContact C-N 3.32Å; D532-L534 PolarHBondContact O-N 2.99Å; D532-K535 PolarHBondContact O-N 2.85Å; D532-E536 VanDerWaalsContact O-CB 3.3Å; D532-E536 WeakPolarHBondContact O-CB 3.16Å; D532-E536 PolarHBondContact O-N 3.14Å
533	Q	85.8	Confident	89.9	Confident	130 Å²	130	46.8 Å²	46.8	61%	0.607	23%	0.227	S	C	*	.	H	α-helix	trans	-62.4	-39.8	178.5	-67.5	-174.8	5.8	0	0	112.4	L531 E536 H537	L531-Q533 PolarHBondContact O-N 3.49Å; Q533-E536 WeakPolarHBondContact O-CB 3.37Å; Q533-E536 PolarHBondContact O-N 3Å; Q533-H537 PolarHBondContact O-N 2.7Å; Q533-H537 VanDerWaalsContact O-N 3.07Å
534	L	87.4	Confident	89.6	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-75.4	-39.2	-179.7	-178.6	66.6	0	0	0	111.3	M488 I510 V522 A526 L531 D532 E536 H537 C538	M488-L534 HydrophobicContact CE-CD2 3.69Å; M488-L534 HydrophobicContact CG-CD2 3.93Å; M488-L534 HydrophobicContact SD-CD2 4.18Å; I510-L534 HydrophobicContact CB-CD1 4.05Å; I510-L534 HydrophobicContact CD1-CD2 4.05Å; I510-L534 HydrophobicContact CG2-CD1 3.4Å; I510-L534 VanDerWaalsContact CG2-CD1 3.4Å; I510-L534 HydrophobicContact CG2-CD2 3.87Å; I510-L534 HydrophobicContact CG2-CG 4.21Å; V522-L534 HydrophobicContact CG1-CD2 4.36Å; A526-L534 HydrophobicContact CB-CB 4.35Å; A526-L534 HydrophobicContact CB-CD2 4.11Å; A526-L534 HydrophobicContact CB-CG 4.21Å; L531-L534 HydrophobicContact CB-CB 4.25Å; L531-L534 HydrophobicContact CD1-CD2 4.33Å; L531-L534 PolarHBondContact O-N 3.06Å; L531-L534 VanDerWaalsContact O-N 3.16Å; D532-L534 VanDerWaalsContact C-N 3.32Å; D532-L534 PolarHBondContact O-N 2.99Å; L534-E536 VanDerWaalsContact C-N 3.25Å; L534-E536 PolarHBondContact O-N 2.99Å; L534-H537 WeakPolarHBondContact O-CB 3.36Å; L534-H537 PolarHBondContact O-N 3.09Å; L534-C538 PolarHBondContact O-N 3.21Å; L534-C538 PolarHBondContact O-SG 2.94Å
535	K	91.2	Very high	89	Confident	21 Å²	21	57.2 Å²	57.2	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-57.1	-44	171.5	-177.7	-175.8	170.2	-176.7	0	110.3	A526 N527 L531 D532 C538 L539 E567	A526-K535 HydrophobicContact CB-CB 4.01Å; N527-K535 HydrophobicContact CB-CD 4.13Å; N527-K535 PolarHBondContact OD1-NZ 2.85Å; L531-K535 PolarHBondContact O-N 2.92Å; D532-K535 PolarHBondContact O-N 2.85Å; K535-C538 PolarHBondContact O-N 2.98Å; K535-L539 HydrophobicContact CG-CD1 3.98Å; K535-L539 HydrophobicContact CG-CG 4.42Å; K535-L539 WeakPolarHBondContact O-CB 3.39Å; K535-L539 WeakPolarHBondContact O-CG 3.43Å; K535-L539 PolarHBondContact O-N 2.71Å; K535-E567 VanDerWaalsContact CE-OE1 3.24Å; K535-E567 WeakPolarHBondContact CE-OE1 3.22Å; K535-E567 WeakPolarHBondContact CE-OE2 3.22Å; K535-E567 IonicContact NZ-OE1 3.76Å; K535-E567 PolarHBondContact NZ-OE1 3Å; K535-E567 IonicContact NZ-OE2 3.94Å; K535-E567 PolarHBondContact NZ-OE2 2.83Å
536	E	88.9	Confident	88.5	Confident	69 Å²	69	59.2 Å²	59.2	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-57.8	-48	175.4	-178.7	60.7	-152.6	0	0	112.2	D532 Q533 L534 C538 L539 N540 R571	D532-E536 VanDerWaalsContact O-CB 3.3Å; D532-E536 WeakPolarHBondContact O-CB 3.16Å; D532-E536 PolarHBondContact O-N 3.14Å; Q533-E536 WeakPolarHBondContact O-CB 3.37Å; Q533-E536 PolarHBondContact O-N 3Å; L534-E536 VanDerWaalsContact C-N 3.25Å; L534-E536 PolarHBondContact O-N 2.99Å; E536-C538 PolarHBondContact O-N 2.83Å; E536-L539 PolarHBondContact O-N 2.89Å; E536-N540 WeakPolarHBondContact O-CB 3.24Å; E536-N540 VanDerWaalsContact O-CG 3.31Å; E536-N540 PolarHBondContact O-N 2.99Å; E536-N540 PolarHBondContact O-ND2 3.46Å; E536-N540 VanDerWaalsContact O-ND2 3.12Å; E536-N540 PolarHBondContact OE1-ND2 3.34Å; E536-R571 VanDerWaalsContact CD-NH1 3.35Å; E536-R571 IonicContact OE1-CZ 2.72Å; E536-R571 IonicContact OE1-NE 4Å; E536-R571 IonicContact OE1-NH1 3.56Å; E536-R571 PolarHBondContact OE1-NH1 3.42Å; E536-R571 IonicContact OE1-NH2 3.87Å; E536-R571 PolarHBondContact OE1-NH2 3.01Å; E536-R571 IonicContact OE2-CZ 2.75Å; E536-R571 IonicContact OE2-NH1 3.63Å; E536-R571 PolarHBondContact OE2-NH1 3.07Å; E536-R571 IonicContact OE2-NH2 3.74Å; E536-R571 PolarHBondContact OE2-NH2 3.46Å
537	H	87.8	Confident	88.3	Confident	51 Å²	51	61 Å²	61	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-57.6	-49.3	175.8	-174.6	102.6	0	0	0	112.1	E511 Q533 L534 L539 N540 F541	E511-H537 WeakPolarHBondContact CG-ND1 3.4Å; E511-H537 IonicContact OE1-CE1 3.63Å; E511-H537 IonicContact OE1-CG 2.7Å; E511-H537 IonicContact OE1-ND1 3.36Å; E511-H537 PolarHBondContact OE1-ND1 2.68Å; Q533-H537 PolarHBondContact O-N 2.7Å; Q533-H537 VanDerWaalsContact O-N 3.07Å; L534-H537 WeakPolarHBondContact O-CB 3.36Å; L534-H537 PolarHBondContact O-N 3.09Å; H537-L539 PolarHBondContact O-N 3.49Å; H537-N540 PolarHBondContact O-N 2.88Å; H537-F541 PolarHBondContact O-N 3.4Å
538	C	90.6	Very high	88	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-46.2	-179.7	-63.8	0	0	0	0	111.4	V519 V522 C523 L534 K535 E536 N540 F541 V542	V519-C538 HydrophobicContact CG2-CB 4.07Å; V522-C538 VanDerWaalsContact CG1-SG 3.57Å; C523-C538 HydrophobicContact CB-CB 3.7Å; L534-C538 PolarHBondContact O-N 3.21Å; L534-C538 PolarHBondContact O-SG 2.94Å; K535-C538 PolarHBondContact O-N 2.98Å; E536-C538 PolarHBondContact O-N 2.83Å; C538-N540 VanDerWaalsContact C-N 3.33Å; C538-N540 PolarHBondContact O-N 2.79Å; C538-F541 WeakPolarHBondContact O-CB 3.36Å; C538-F541 PolarHBondContact O-N 3.31Å; C538-F541 VanDerWaalsContact O-N 3.14Å; C538-V542 WeakPolarHBondContact O-CG2 3.42Å; C538-V542 PolarHBondContact O-N 2.9Å
539	L	90.3	Very high	87.8	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-42.5	177.6	-71.1	173.8	0	0	0	111.5	K535 E536 H537 F541 V542 V543 E567 I568	K535-L539 HydrophobicContact CG-CD1 3.98Å; K535-L539 HydrophobicContact CG-CG 4.42Å; K535-L539 WeakPolarHBondContact O-CB 3.39Å; K535-L539 WeakPolarHBondContact O-CG 3.43Å; K535-L539 PolarHBondContact O-N 2.71Å; E536-L539 PolarHBondContact O-N 2.89Å; H537-L539 PolarHBondContact O-N 3.49Å; L539-F541 VanDerWaalsContact C-N 3.32Å; L539-F541 PolarHBondContact O-N 3.01Å; L539-V542 PolarHBondContact O-N 2.83Å; L539-V543 WeakPolarHBondContact O-CG1 3.39Å; L539-V543 WeakPolarHBondContact O-CG2 3.48Å; L539-V543 PolarHBondContact O-N 3.4Å; L539-V543 VanDerWaalsContact O-N 3.15Å; L539-E567 HydrophobicContact CD1-CG 4.12Å; L539-E567 WeakPolarHBondContact CD1-OE1 3.46Å; L539-I568 HydrophobicContact CD2-CD1 4.3Å; L539-I568 HydrophobicContact CD2-CG1 3.39Å
540	N	88.5	Confident	87.7	Confident	61 Å²	61	62.4 Å²	62.4	33%	0.326	31%	0.308	S	S	.	.	H	α-helix	trans	-65	-34	175.3	-73.9	-34.4	0	0	0	112.5	E536 H537 C538 R571	E536-N540 WeakPolarHBondContact O-CB 3.24Å; E536-N540 VanDerWaalsContact O-CG 3.31Å; E536-N540 PolarHBondContact O-N 2.99Å; E536-N540 PolarHBondContact O-ND2 3.46Å; E536-N540 VanDerWaalsContact O-ND2 3.12Å; E536-N540 PolarHBondContact OE1-ND2 3.34Å; H537-N540 PolarHBondContact O-N 2.88Å; C538-N540 VanDerWaalsContact C-N 3.33Å; C538-N540 PolarHBondContact O-N 2.79Å; N540-R571 PolarHBondContact OD1-NE 3.28Å
541	F	88.3	Confident	87.5	Confident	27 Å²	27	54.7 Å²	54.7	12%	0.118	27%	0.272	C	S	.	.	H	α-helix	trans	-65.4	-46.3	173.3	-177	-81.2	0	0	0	111.9	V514 L516 V519 H537 C538 L539 H547	V514-F541 HydrophobicContact CG1-CD1 4.27Å; V514-F541 HydrophobicContact CG1-CD2 4.19Å; V514-F541 HydrophobicContact CG1-CE2 4.47Å; V514-F541 HydrophobicContact CG1-CG 4.1Å; L516-F541 HydrophobicContact CD2-CE1 4.14Å; V519-F541 HydrophobicContact CB-CD1 4.1Å; V519-F541 HydrophobicContact CB-CE1 4.32Å; V519-F541 HydrophobicContact CG1-CD1 4.26Å; V519-F541 HydrophobicContact CG1-CE1 4.32Å; V519-F541 HydrophobicContact CG2-CB 4.36Å; V519-F541 HydrophobicContact CG2-CD1 3.8Å; V519-F541 HydrophobicContact CG2-CG 4.36Å; H537-F541 PolarHBondContact O-N 3.4Å; C538-F541 WeakPolarHBondContact O-CB 3.36Å; C538-F541 PolarHBondContact O-N 3.31Å; C538-F541 VanDerWaalsContact O-N 3.14Å; L539-F541 VanDerWaalsContact C-N 3.32Å; L539-F541 PolarHBondContact O-N 3.01Å; F541-H547 AromaticContact CD1-ND1 3.67Å; F541-H547 AromaticContact CE1-CE1 3.96Å; F541-H547 AromaticContact CE1-ND1 3.46Å; F541-H547 WeakPolarHBondContact CE1-ND1 3.34Å; F541-H547 AromaticContact CE2-CE1 3.59Å; F541-H547 AromaticContact CE2-ND1 3.83Å; F541-H547 AromaticContact CG-ND1 3.95Å; F541-H547 AromaticContact CZ-CE1 3.53Å; F541-H547 AromaticContact CZ-ND1 3.53Å; F541-H547 PolarHBondContact O-ND1 3.19Å
542	V	89.2	Confident	87.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-42.3	-178	171.8	0	0	0	0	111.7	V519 L520 C538 L539 K544 F548 V551 I568	V519-V542 HydrophobicContact CB-CG2 4.42Å; V519-V542 HydrophobicContact CG1-CG2 3.92Å; V519-V542 HydrophobicContact CG2-CG2 3.58Å; L520-V542 HydrophobicContact CD2-CG2 4.4Å; C538-V542 WeakPolarHBondContact O-CG2 3.42Å; C538-V542 PolarHBondContact O-N 2.9Å; L539-V542 PolarHBondContact O-N 2.83Å; V542-K544 VanDerWaalsContact C-N 3.3Å; V542-K544 PolarHBondContact O-N 2.78Å; V542-F548 HydrophobicContact CG1-CD2 4.32Å; V542-F548 WeakPolarHBondContact O-CA 3.46Å; V542-F548 WeakPolarHBondContact O-CB 3.37Å; V542-F548 PolarHBondContact O-N 2.83Å; V542-V551 HydrophobicContact CG1-CB 4.39Å; V542-V551 HydrophobicContact CG1-CG1 3.98Å; V542-V551 HydrophobicContact CG2-CG1 4.22Å; V542-I568 HydrophobicContact CG1-CG2 3.9Å
543	V	88.6	Confident	87.2	Confident	20 Å²	20	58.9 Å²	58.9	12%	0.121	29%	0.291	C	S	.	.	H	α-helix	trans	-79.7	-7	-173.3	-60.5	0	0	0	0	115.2	L539 E545 R571 K572	L539-V543 WeakPolarHBondContact O-CG1 3.39Å; L539-V543 WeakPolarHBondContact O-CG2 3.48Å; L539-V543 PolarHBondContact O-N 3.4Å; L539-V543 VanDerWaalsContact O-N 3.15Å; V543-E545 PolarHBondContact O-N 2.92Å; V543-R571 HydrophobicContact CG1-CB 4.09Å; V543-K572 HydrophobicContact CB-CD 4.26Å; V543-K572 HydrophobicContact CG1-CB 4.27Å; V543-K572 PolarHBondContact O-NZ 3.07Å
544	K	85.8	Confident	87.3	Confident	108 Å²	108	54.4 Å²	54.4	47%	0.47	27%	0.272	S	S	.	.	S	Bend	trans	-53.8	135.2	171.1	-77.1	174.1	-177.2	173.6	0	109.9	V542 S546 H547 F548	V542-K544 VanDerWaalsContact C-N 3.3Å; V542-K544 PolarHBondContact O-N 2.78Å; K544-S546 PolarHBondContact O-N 3.3Å; K544-H547 HydrophobicContact CB-CB 4.37Å; K544-H547 PolarHBondContact O-N 2.95Å; K544-F548 PolarHBondContact O-N 2.99Å
545	E	79.3	Confident	87.2	Confident	166 Å²	166	61.7 Å²	61.7	78%	0.776	30%	0.304	S	S	*	.	H	α-helix	trans	-55.3	-37.8	-176.5	-70	-171.7	158.7	0	0	113.2	V543 H547	V543-E545 PolarHBondContact O-N 2.92Å; E545-H547 VanDerWaalsContact C-N 3.28Å; E545-H547 PolarHBondContact O-N 3.01Å
546	S	82.4	Confident	86.9	Confident	76 Å²	76	65.5 Å²	65.5	53%	0.531	32%	0.322	S	S	.	.	H	α-helix	trans	-67.7	-23.2	178.1	51.4	0	0	0	0	114.2	K544 Q550	K544-S546 PolarHBondContact O-N 3.3Å; S546-Q550 PolarHBondContact O-NE2 3.45Å
547	H	86.8	Confident	86.9	Confident	37 Å²	37	63.7 Å²	63.7	17%	0.171	31%	0.313	C	S	.	.	H	α-helix	trans	-107.8	-38.5	-170.6	-57.6	167.8	0	0	0	112.7	L516 F541 K544 E545 N549 Q550 V551	L516-H547 HydrophobicContact CD2-CB 3.7Å; F541-H547 AromaticContact CD1-ND1 3.67Å; F541-H547 AromaticContact CE1-CE1 3.96Å; F541-H547 AromaticContact CE1-ND1 3.46Å; F541-H547 WeakPolarHBondContact CE1-ND1 3.34Å; F541-H547 AromaticContact CE2-CE1 3.59Å; F541-H547 AromaticContact CE2-ND1 3.83Å; F541-H547 AromaticContact CG-ND1 3.95Å; F541-H547 AromaticContact CZ-CE1 3.53Å; F541-H547 AromaticContact CZ-ND1 3.53Å; F541-H547 PolarHBondContact O-ND1 3.19Å; K544-H547 HydrophobicContact CB-CB 4.37Å; K544-H547 PolarHBondContact O-N 2.95Å; E545-H547 VanDerWaalsContact C-N 3.28Å; E545-H547 PolarHBondContact O-N 3.01Å; H547-N549 PolarHBondContact O-N 2.99Å; H547-Q550 WeakPolarHBondContact O-CA 3.48Å; H547-Q550 WeakPolarHBondContact O-CB 3.49Å; H547-Q550 PolarHBondContact O-N 3.2Å; H547-V551 HydrophobicContact CB-CG2 4.49Å; H547-V551 WeakPolarHBondContact O-CG2 3.25Å; H547-V551 PolarHBondContact O-N 2.91Å
548	F	87.9	Confident	86.8	Confident	32 Å²	32	68.5 Å²	68.5	14%	0.14	34%	0.335	C	S	.	.	H	α-helix	trans	-50.7	-51.6	-167.9	-175	-101.4	0	0	0	113.6	V542 K544 Q550 V551 I552 I568 K572	V542-F548 HydrophobicContact CG1-CD2 4.32Å; V542-F548 WeakPolarHBondContact O-CA 3.46Å; V542-F548 WeakPolarHBondContact O-CB 3.37Å; V542-F548 PolarHBondContact O-N 2.83Å; K544-F548 PolarHBondContact O-N 2.99Å; F548-Q550 VanDerWaalsContact C-N 3.26Å; F548-Q550 PolarHBondContact O-N 2.91Å; F548-V551 PolarHBondContact O-N 3.22Å; F548-I552 HydrophobicContact CD1-CD1 4.23Å; F548-I552 HydrophobicContact CD1-CG2 4.4Å; F548-I552 HydrophobicContact CD2-CG2 4.3Å; F548-I552 HydrophobicContact CE1-CD1 3.91Å; F548-I552 HydrophobicContact CE1-CG2 4.06Å; F548-I552 HydrophobicContact CE2-CG2 3.95Å; F548-I552 HydrophobicContact CZ-CG2 3.82Å; F548-I552 WeakPolarHBondContact O-CG1 3.34Å; F548-I552 WeakPolarHBondContact O-CG2 3.43Å; F548-I552 PolarHBondContact O-N 3.09Å; F548-I568 HydrophobicContact CE2-CG2 3.96Å; F548-K572 HydrophobicContact CD2-CD 4.26Å; F548-K572 HydrophobicContact CD2-CG 4.32Å; F548-K572 HydrophobicContact CE1-CG 4.21Å; F548-K572 HydrophobicContact CE2-CB 4.04Å; F548-K572 HydrophobicContact CE2-CD 4.42Å; F548-K572 HydrophobicContact CE2-CG 3.99Å; F548-K572 HydrophobicContact CG-CD 4.33Å; F548-K572 HydrophobicContact CZ-CB 4.24Å; F548-K572 HydrophobicContact CZ-CG 3.93Å
549	N	86.4	Confident	86.6	Confident	110 Å²	110	75.5 Å²	75.5	59%	0.588	37%	0.368	S	S	*	.	H	α-helix	trans	-63.4	-32.4	-179.1	-69	-23.4	0	0	0	112.9	H547 M553	H547-N549 PolarHBondContact O-N 2.99Å; N549-M553 WeakPolarHBondContact O-CG 3.41Å
550	Q	86.5	Confident	86.6	Confident	110 Å²	110	75.9 Å²	75.9	51%	0.514	37%	0.37	S	S	.	.	H	α-helix	trans	-72.9	-42.8	178.2	-59	-175.4	51.5	0	0	110.2	L516 S546 H547 F548 T554	L516-Q550 HydrophobicContact CD2-CB 4.42Å; S546-Q550 PolarHBondContact O-NE2 3.45Å; H547-Q550 WeakPolarHBondContact O-CA 3.48Å; H547-Q550 WeakPolarHBondContact O-CB 3.49Å; H547-Q550 PolarHBondContact O-N 3.2Å; F548-Q550 VanDerWaalsContact C-N 3.26Å; F548-Q550 PolarHBondContact O-N 2.91Å; Q550-T554 WeakPolarHBondContact O-CG2 3.38Å
551	V	87.7	Confident	86.7	Confident	1 Å²	1	75 Å²	75	1%	0.006	37%	0.368	C	S	.	.	H	α-helix	trans	-68.5	-44.2	-177.5	176.6	0	0	0	0	112.2	L516 V519 L520 V542 H547 F548 M553 T554	L516-V551 HydrophobicContact CD2-CG2 3.88Å; V519-V551 HydrophobicContact CG1-CG1 4.31Å; V519-V551 HydrophobicContact CG1-CG2 4.12Å; L520-V551 HydrophobicContact CD1-CG1 3.79Å; L520-V551 HydrophobicContact CD2-CG1 3.6Å; L520-V551 HydrophobicContact CG-CG1 3.7Å; V542-V551 HydrophobicContact CG1-CB 4.39Å; V542-V551 HydrophobicContact CG1-CG1 3.98Å; V542-V551 HydrophobicContact CG2-CG1 4.22Å; H547-V551 HydrophobicContact CB-CG2 4.49Å; H547-V551 WeakPolarHBondContact O-CG2 3.25Å; H547-V551 PolarHBondContact O-N 2.91Å; F548-V551 PolarHBondContact O-N 3.22Å; V551-M553 PolarHBondContact O-N 3.46Å; V551-T554 WeakPolarHBondContact O-CB 3.3Å; V551-T554 WeakPolarHBondContact O-CG2 3.47Å; V551-T554 PolarHBondContact O-N 3.42Å; V551-T554 PolarHBondContact O-OG1 3.42Å
552	I	86.2	Confident	86.7	Confident	52 Å²	52	78.8 Å²	78.8	27%	0.267	39%	0.394	S	S	.	.	H	α-helix	trans	-68.2	-20.4	-178.2	65.8	178.4	0	0	0	113.7	F548 T554 F557	F548-I552 HydrophobicContact CD1-CD1 4.23Å; F548-I552 HydrophobicContact CD1-CG2 4.4Å; F548-I552 HydrophobicContact CD2-CG2 4.3Å; F548-I552 HydrophobicContact CE1-CD1 3.91Å; F548-I552 HydrophobicContact CE1-CG2 4.06Å; F548-I552 HydrophobicContact CE2-CG2 3.95Å; F548-I552 HydrophobicContact CZ-CG2 3.82Å; F548-I552 WeakPolarHBondContact O-CG1 3.34Å; F548-I552 WeakPolarHBondContact O-CG2 3.43Å; F548-I552 PolarHBondContact O-N 3.09Å; I552-T554 VanDerWaalsContact C-N 3.29Å; I552-F557 HydrophobicContact CB-CD1 4.47Å; I552-F557 HydrophobicContact CB-CE1 4.48Å; I552-F557 HydrophobicContact CG2-CD2 4.45Å; I552-F557 HydrophobicContact CG2-CE1 4.4Å; I552-F557 HydrophobicContact CG2-CE2 4.1Å; I552-F557 HydrophobicContact CG2-CZ 4.07Å
553	M	86.1	Confident	86.7	Confident	163 Å²	163	83.1 Å²	83.1	80%	0.803	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-1.5	178.9	-68.1	-64.6	-148.6	0	0	112.6	N549 V551	N549-M553 WeakPolarHBondContact O-CG 3.41Å; V551-M553 PolarHBondContact O-N 3.46Å
554	T	88.2	Confident	86.8	Confident	36 Å²	36	82.1 Å²	82.1	22%	0.221	42%	0.416	C	S	.	.	S	Bend	trans	-78.2	151	177.1	65.9	0	0	0	0	111.1	L520 Q550 V551 I552 E556 F557	L520-T554 WeakPolarHBondContact CD1-OG1 3.3Å; Q550-T554 WeakPolarHBondContact O-CG2 3.38Å; V551-T554 WeakPolarHBondContact O-CB 3.3Å; V551-T554 WeakPolarHBondContact O-CG2 3.47Å; V551-T554 PolarHBondContact O-N 3.42Å; V551-T554 PolarHBondContact O-OG1 3.42Å; I552-T554 VanDerWaalsContact C-N 3.29Å; T554-E556 VanDerWaalsContact CB-OE2 3.29Å; T554-E556 WeakPolarHBondContact CB-OE2 3.32Å; T554-E556 PolarHBondContact O-N 2.94Å; T554-F557 WeakPolarHBondContact O-CB 3.35Å; T554-F557 PolarHBondContact O-N 2.96Å; T554-F557 PolarHBondContact OG1-N 3.44Å
555	K	85.2	Confident	86.9	Confident	155 Å²	155	79.1 Å²	79.1	67%	0.674	41%	0.405	S	S	*	.	H	α-helix	trans	-67.7	-28.8	177.2	-71	-174	176.2	-177.4	0	111.5	F557 E558 H559	K555-F557 PolarHBondContact O-N 3.23Å; K555-E558 WeakPolarHBondContact O-CB 3.35Å; K555-E558 PolarHBondContact O-N 3.06Å; K555-H559 PolarHBondContact O-ND1 3.09Å
556	E	85.1	Confident	87.4	Confident	102 Å²	102	74.1 Å²	74.1	48%	0.477	39%	0.385	S	S	.	.	H	α-helix	trans	-62	-31.5	178.6	-66	71.7	-161.3	0	0	111.1	L520 T554 H559 L560	L520-E556 HydrophobicContact CD1-CB 3.98Å; T554-E556 VanDerWaalsContact CB-OE2 3.29Å; T554-E556 WeakPolarHBondContact CB-OE2 3.32Å; T554-E556 PolarHBondContact O-N 2.94Å; E556-H559 PolarHBondContact O-N 3.2Å; E556-L560 PolarHBondContact O-N 2.97Å
557	F	88	Confident	87.8	Confident	30 Å²	30	73.5 Å²	73.5	13%	0.132	37%	0.374	C	S	.	.	H	α-helix	trans	-66.8	-35.7	176.7	-168.3	-97.6	0	0	0	112.9	L520 I552 T554 K555 H559 L560 I565 I568	L520-F557 HydrophobicContact CD1-CB 3.78Å; L520-F557 HydrophobicContact CD1-CD2 4.07Å; L520-F557 HydrophobicContact CD1-CG 4.45Å; L520-F557 HydrophobicContact CD2-CD2 4.1Å; I552-F557 HydrophobicContact CB-CD1 4.47Å; I552-F557 HydrophobicContact CB-CE1 4.48Å; I552-F557 HydrophobicContact CG2-CD2 4.45Å; I552-F557 HydrophobicContact CG2-CE1 4.4Å; I552-F557 HydrophobicContact CG2-CE2 4.1Å; I552-F557 HydrophobicContact CG2-CZ 4.07Å; T554-F557 WeakPolarHBondContact O-CB 3.35Å; T554-F557 PolarHBondContact O-N 2.96Å; T554-F557 PolarHBondContact OG1-N 3.44Å; K555-F557 PolarHBondContact O-N 3.23Å; F557-H559 PolarHBondContact O-N 3.42Å; F557-L560 WeakPolarHBondContact O-CB 3.37Å; F557-L560 PolarHBondContact O-N 2.95Å; F557-I565 HydrophobicContact CE1-CG2 4.32Å; F557-I565 HydrophobicContact CZ-CG1 4.42Å; F557-I565 HydrophobicContact CZ-CG2 4.1Å; F557-I568 HydrophobicContact CE2-CD1 4.03Å; F557-I568 HydrophobicContact CE2-CG2 4.41Å
558	E	86.6	Confident	87.9	Confident	152 Å²	152	71.8 Å²	71.8	71%	0.71	37%	0.366	S	S	*	.	H	α-helix	trans	-64.5	-28.8	178.1	-59.7	-179.4	172.4	0	0	112.4	K555	K555-E558 WeakPolarHBondContact O-CB 3.35Å; K555-E558 PolarHBondContact O-N 3.06Å
559	H	86.8	Confident	87.9	Confident	147 Å²	147	73 Å²	73	68%	0.681	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-3.7	-177.6	-62.5	84.2	0	0	0	113	K555 E556 F557	K555-H559 PolarHBondContact O-ND1 3.09Å; E556-H559 PolarHBondContact O-N 3.2Å; F557-H559 PolarHBondContact O-N 3.42Å
560	L	89	Confident	88	Confident	9 Å²	9	76 Å²	76	5%	0.047	38%	0.379	C	S	.	.	S	Bend	trans	-69.5	144.3	-178.6	-165.2	71	0	0	0	111	L520 E524 E556 F557 T562 L564 I565 I568	L520-L560 HydrophobicContact CD2-CD2 4.44Å; E524-L560 HydrophobicContact CB-CD1 3.89Å; E524-L560 HydrophobicContact CG-CD1 4.13Å; E556-L560 PolarHBondContact O-N 2.97Å; F557-L560 WeakPolarHBondContact O-CB 3.37Å; F557-L560 PolarHBondContact O-N 2.95Å; L560-T562 PolarHBondContact O-N 2.7Å; L560-L564 HydrophobicContact CD1-CB 4.37Å; L560-L564 HydrophobicContact CD1-CD1 3.95Å; L560-L564 HydrophobicContact CD2-CB 3.78Å; L560-L564 HydrophobicContact CG-CB 3.87Å; L560-L564 HydrophobicContact CG-CD1 4.31Å; L560-I565 HydrophobicContact CB-CD1 4.22Å; L560-I565 HydrophobicContact CB-CG1 3.91Å; L560-I565 HydrophobicContact CD2-CG1 3.96Å; L560-I565 HydrophobicContact CG-CG1 4.23Å; L560-I565 WeakPolarHBondContact O-CD1 3.26Å; L560-I568 HydrophobicContact CD2-CD1 3.56Å
561	S	90.1	Very high	88	Confident	41 Å²	41	72.3 Å²	72.3	29%	0.287	36%	0.361	S	S	.	.			trans	-58	139.4	178	74.3	0	0	0	0	112.1	P563 L564 I565	S561-P563 VanDerWaalsContact C-N 3.3Å; S561-L564 PolarHBondContact O-N 3.36Å; S561-L564 WeakPolarHBondContact OG-CD1 3.47Å; S561-L564 WeakPolarHBondContact OG-CG 3.33Å; S561-I565 PolarHBondContact O-N 3.05Å; S561-I565 VanDerWaalsContact O-N 3.11Å
562	T	88.5	Confident	87.9	Confident	107 Å²	107	75.8 Å²	75.8	66%	0.656	38%	0.376	S	S	*	.	H	α-helix	trans	-51.2	-40.9	-179.9	-44.6	0	0	0	0	113.7	L560 L564 I565 V566	L560-T562 PolarHBondContact O-N 2.7Å; T562-L564 PolarHBondContact O-N 3.45Å; T562-I565 PolarHBondContact O-N 3.29Å; T562-V566 WeakPolarHBondContact O-CG2 3.42Å; T562-V566 PolarHBondContact O-N 2.95Å; T562-V566 VanDerWaalsContact O-N 3.1Å
563	P	90.4	Very high	87.9	Confident	91 Å²	91	80.3 Å²	80.3	59%	0.591	40%	0.396	S	S	*	.	H	α-helix	trans	-59.9	-42.3	176	-24.8	36	0	0	0	113.5	S561 V566 E567	S561-P563 VanDerWaalsContact C-N 3.3Å; P563-V566 PolarHBondContact O-N 2.97Å; P563-E567 WeakPolarHBondContact O-CB 3.27Å; P563-E567 PolarHBondContact O-N 3.43Å
564	L	89.1	Confident	87.8	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-69.9	-37.9	179.7	-76.4	171.9	0	0	0	112.2	E524 N527 L560 S561 T562 V566 E567 I568	E524-L564 HydrophobicContact CB-CD1 4.15Å; E524-L564 HydrophobicContact CG-CD1 3.96Å; N527-L564 HydrophobicContact CB-CD1 4.12Å; N527-L564 HydrophobicContact CB-CD2 4.07Å; L560-L564 HydrophobicContact CD1-CB 4.37Å; L560-L564 HydrophobicContact CD1-CD1 3.95Å; L560-L564 HydrophobicContact CD2-CB 3.78Å; L560-L564 HydrophobicContact CG-CB 3.87Å; L560-L564 HydrophobicContact CG-CD1 4.31Å; S561-L564 PolarHBondContact O-N 3.36Å; S561-L564 WeakPolarHBondContact OG-CD1 3.47Å; S561-L564 WeakPolarHBondContact OG-CG 3.33Å; T562-L564 PolarHBondContact O-N 3.45Å; L564-V566 VanDerWaalsContact C-N 3.35Å; L564-E567 PolarHBondContact O-N 3.39Å; L564-I568 WeakPolarHBondContact O-CG1 3.41Å; L564-I568 PolarHBondContact O-N 2.87Å
565	I	89.5	Confident	87.1	Confident	45 Å²	45	83.2 Å²	83.2	23%	0.231	41%	0.414	C	S	.	.	H	α-helix	trans	-59.8	-48.3	174.2	-65.1	174.8	0	0	0	110.1	F557 L560 S561 T562 E567 I568 V569	F557-I565 HydrophobicContact CE1-CG2 4.32Å; F557-I565 HydrophobicContact CZ-CG1 4.42Å; F557-I565 HydrophobicContact CZ-CG2 4.1Å; L560-I565 HydrophobicContact CB-CD1 4.22Å; L560-I565 HydrophobicContact CB-CG1 3.91Å; L560-I565 HydrophobicContact CD2-CG1 3.96Å; L560-I565 HydrophobicContact CG-CG1 4.23Å; L560-I565 WeakPolarHBondContact O-CD1 3.26Å; S561-I565 PolarHBondContact O-N 3.05Å; S561-I565 VanDerWaalsContact O-N 3.11Å; T562-I565 PolarHBondContact O-N 3.29Å; I565-E567 VanDerWaalsContact C-N 3.27Å; I565-E567 PolarHBondContact O-N 3.33Å; I565-I568 PolarHBondContact O-N 3.42Å; I565-V569 HydrophobicContact CG2-CG2 4.48Å; I565-V569 WeakPolarHBondContact O-CG2 3.33Å; I565-V569 PolarHBondContact O-N 2.81Å
566	V	88.8	Confident	86.3	Confident	60 Å²	60	78.4 Å²	78.4	36%	0.364	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-40.5	178	171.6	0	0	0	0	110.9	T562 P563 L564 V569 R570	T562-V566 WeakPolarHBondContact O-CG2 3.42Å; T562-V566 PolarHBondContact O-N 2.95Å; T562-V566 VanDerWaalsContact O-N 3.1Å; P563-V566 PolarHBondContact O-N 2.97Å; L564-V566 VanDerWaalsContact C-N 3.35Å; V566-V569 PolarHBondContact O-N 2.86Å; V566-R570 HydrophobicContact CG1-CG 4.38Å; V566-R570 WeakPolarHBondContact O-CB 3.27Å; V566-R570 VanDerWaalsContact O-CG 3.28Å; V566-R570 WeakPolarHBondContact O-CG 3.43Å; V566-R570 PolarHBondContact O-N 2.82Å
567	E	90.1	Very high	85.5	Confident	64 Å²	64	79 Å²	79	30%	0.299	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-46.9	177.8	-166.9	170.8	174.8	0	0	112.3	K535 L539 P563 L564 I565 V569 R570 R571	K535-E567 VanDerWaalsContact CE-OE1 3.24Å; K535-E567 WeakPolarHBondContact CE-OE1 3.22Å; K535-E567 WeakPolarHBondContact CE-OE2 3.22Å; K535-E567 IonicContact NZ-OE1 3.76Å; K535-E567 PolarHBondContact NZ-OE1 3Å; K535-E567 IonicContact NZ-OE2 3.94Å; K535-E567 PolarHBondContact NZ-OE2 2.83Å; L539-E567 HydrophobicContact CD1-CG 4.12Å; L539-E567 WeakPolarHBondContact CD1-OE1 3.46Å; P563-E567 WeakPolarHBondContact O-CB 3.27Å; P563-E567 PolarHBondContact O-N 3.43Å; L564-E567 PolarHBondContact O-N 3.39Å; I565-E567 VanDerWaalsContact C-N 3.27Å; I565-E567 PolarHBondContact O-N 3.33Å; E567-V569 PolarHBondContact O-N 3.39Å; E567-R570 PolarHBondContact O-N 3.07Å; E567-R571 WeakPolarHBondContact O-CB 3.31Å; E567-R571 PolarHBondContact O-N 3.32Å
568	I	89.8	Confident	84.1	Confident	0 Å²	0	87.6 Å²	87.6	0%	0	44%	0.442	C	S	.	.	H	α-helix	trans	-58	-47.7	175.5	-70	166.8	0	0	0	111	L520 L539 V542 F548 F557 L560 L564 I565 R571 K572	L520-I568 HydrophobicContact CD2-CD1 4.37Å; L539-I568 HydrophobicContact CD2-CD1 4.3Å; L539-I568 HydrophobicContact CD2-CG1 3.39Å; V542-I568 HydrophobicContact CG1-CG2 3.9Å; F548-I568 HydrophobicContact CE2-CG2 3.96Å; F557-I568 HydrophobicContact CE2-CD1 4.03Å; F557-I568 HydrophobicContact CE2-CG2 4.41Å; L560-I568 HydrophobicContact CD2-CD1 3.56Å; L564-I568 WeakPolarHBondContact O-CG1 3.41Å; L564-I568 PolarHBondContact O-N 2.87Å; I565-I568 PolarHBondContact O-N 3.42Å; I568-R571 PolarHBondContact O-N 3.5Å; I568-K572 PolarHBondContact O-N 3.49Å
569	V	87.9	Confident	82.7	Confident	59 Å²	59	86.7 Å²	86.7	36%	0.358	45%	0.447	S	S	.	.	H	α-helix	trans	-64.2	-44.9	-179.3	172.8	0	0	0	0	111.1	I565 V566 E567 R571 K572 Q573	I565-V569 HydrophobicContact CG2-CG2 4.48Å; I565-V569 WeakPolarHBondContact O-CG2 3.33Å; I565-V569 PolarHBondContact O-N 2.81Å; V566-V569 PolarHBondContact O-N 2.86Å; E567-V569 PolarHBondContact O-N 3.39Å; V569-R571 VanDerWaalsContact C-N 3.33Å; V569-R571 PolarHBondContact O-N 3.03Å; V569-K572 PolarHBondContact O-N 3.09Å; V569-Q573 WeakPolarHBondContact O-CG 3.17Å; V569-Q573 PolarHBondContact O-N 3.47Å; V569-Q573 VanDerWaalsContact O-N 3.13Å
570	R	88.4	Confident	80.9	Confident	171 Å²	171	88 Å²	88	65%	0.645	45%	0.447	S	S	*	.	H	α-helix	trans	-59.5	-44.8	176.4	-78.9	177.7	179.7	169.9	1.7	111.5	V566 E567 K572 Q573 Q574	V566-R570 HydrophobicContact CG1-CG 4.38Å; V566-R570 WeakPolarHBondContact O-CB 3.27Å; V566-R570 VanDerWaalsContact O-CG 3.28Å; V566-R570 WeakPolarHBondContact O-CG 3.43Å; V566-R570 PolarHBondContact O-N 2.82Å; E567-R570 PolarHBondContact O-N 3.07Å; R570-K572 VanDerWaalsContact C-N 3.29Å; R570-K572 PolarHBondContact O-N 3.34Å; R570-Q573 PolarHBondContact O-N 2.94Å; R570-Q574 PolarHBondContact O-N 3.08Å
571	R	86.3	Confident	79.1	Confident	33 Å²	33	92 Å²	92	13%	0.125	48%	0.476	C	S	.	.	H	α-helix	trans	-62.8	-34.7	178.7	-122.6	-154.3	174.6	93.7	38.5	113.2	E536 N540 V543 E567 I568 V569 Q574 P575	E536-R571 VanDerWaalsContact CD-NH1 3.35Å; E536-R571 IonicContact OE1-CZ 2.72Å; E536-R571 IonicContact OE1-NE 4Å; E536-R571 IonicContact OE1-NH1 3.56Å; E536-R571 PolarHBondContact OE1-NH1 3.42Å; E536-R571 IonicContact OE1-NH2 3.87Å; E536-R571 PolarHBondContact OE1-NH2 3.01Å; E536-R571 IonicContact OE2-CZ 2.75Å; E536-R571 IonicContact OE2-NH1 3.63Å; E536-R571 PolarHBondContact OE2-NH1 3.07Å; E536-R571 IonicContact OE2-NH2 3.74Å; E536-R571 PolarHBondContact OE2-NH2 3.46Å; N540-R571 PolarHBondContact OD1-NE 3.28Å; V543-R571 HydrophobicContact CG1-CB 4.09Å; E567-R571 WeakPolarHBondContact O-CB 3.31Å; E567-R571 PolarHBondContact O-N 3.32Å; I568-R571 PolarHBondContact O-N 3.5Å; V569-R571 VanDerWaalsContact C-N 3.33Å; V569-R571 PolarHBondContact O-N 3.03Å; R571-Q574 CarbonylContact O-C 3.5Å; R571-Q574 VanDerWaalsContact O-C 3.26Å; R571-P575 WeakPolarHBondContact O-CA 3.34Å
572	K	86.3	Confident	77.3	Confident	74 Å²	74	97.8 Å²	97.8	32%	0.322	50%	0.503	S	S	.	.	H	α-helix	trans	-69.4	-36.5	175.9	-174.3	57.7	174.7	174.2	0	112.1	V543 F548 I568 V569 R570	V543-K572 HydrophobicContact CB-CD 4.26Å; V543-K572 HydrophobicContact CG1-CB 4.27Å; V543-K572 PolarHBondContact O-NZ 3.07Å; F548-K572 HydrophobicContact CD2-CD 4.26Å; F548-K572 HydrophobicContact CD2-CG 4.32Å; F548-K572 HydrophobicContact CE1-CG 4.21Å; F548-K572 HydrophobicContact CE2-CB 4.04Å; F548-K572 HydrophobicContact CE2-CD 4.42Å; F548-K572 HydrophobicContact CE2-CG 3.99Å; F548-K572 HydrophobicContact CG-CD 4.33Å; F548-K572 HydrophobicContact CZ-CB 4.24Å; F548-K572 HydrophobicContact CZ-CG 3.93Å; I568-K572 PolarHBondContact O-N 3.49Å; V569-K572 PolarHBondContact O-N 3.09Å; R570-K572 VanDerWaalsContact C-N 3.29Å; R570-K572 PolarHBondContact O-N 3.34Å
573	Q	85.4	Confident	75.7	Confident	147 Å²	147	100.1 Å²	100.1	69%	0.687	51%	0.507	S	S	*	.	H	α-helix	trans	-74.5	-37.3	177.5	-69.1	177.7	-3.5	0	0	112.5	V569 R570	V569-Q573 WeakPolarHBondContact O-CG 3.17Å; V569-Q573 PolarHBondContact O-N 3.47Å; V569-Q573 VanDerWaalsContact O-N 3.13Å; R570-Q573 PolarHBondContact O-N 2.94Å
574	Q	83.9	Confident	74.2	Confident	160 Å²	160	101.8 Å²	101.8	75%	0.748	52%	0.518	S	S	*	.	S	Bend	trans	-133.5	88.3	-180	-67.6	-177.3	-2.8	0	0	109.4	R570 R571	R570-Q574 PolarHBondContact O-N 3.08Å; R571-Q574 CarbonylContact O-C 3.5Å; R571-Q574 VanDerWaalsContact O-C 3.26Å
575	P	74.5	Confident	73	Confident	101 Å²	101	106 Å²	106	66%	0.656	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-64.7	133.3	177	23.8	-30.9	0	0	0	109.9	R571	R571-P575 WeakPolarHBondContact O-CA 3.34Å
576	P	68.1	Low	72.1	Confident	54 Å²	54	109 Å²	109	35%	0.351	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-64.3	148.6	179.8	29.1	-38	0	0	0	110.7
577	P	68	Low	71.3	Confident	113 Å²	113	109.2 Å²	109.2	73%	0.734	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-61	139.9	171.8	25.6	-32	0	0	0	110.1	V579	P577-V579 PolarHBondContact O-N 3.04Å; P577-V579 VanDerWaalsContact O-N 3.12Å
578	R	58.1	Low	70.8	Confident	212 Å²	212	107.6 Å²	107.6	80%	0.8	56%	0.558	S	S	*	*			trans	-64.1	114.5	175.3	-73.4	-174	-178.5	178.8	3	109.3	Y580	R578-Y580 HydrophobicContact CB-CE2 4.18Å
579	V	57	Low	70.7	Confident	133 Å²	133	111 Å²	111	81%	0.806	58%	0.579	S	S	*	*			trans	-91.7	112.4	170.3	-175.3	0	0	0	0	107.3	P577	P577-V579 PolarHBondContact O-N 3.04Å; P577-V579 VanDerWaalsContact O-N 3.12Å
580	Y	49.8	Very low	70.7	Confident	175 Å²	175	109.2 Å²	109.2	69%	0.686	57%	0.569	S	S	*	*			trans	-86.1	121.4	167.1	-70.9	-84.7	0	0	0	107.8	R578	R578-Y580 HydrophobicContact CB-CE2 4.18Å
581	S	52.1	Low	70.8	Confident	92 Å²	92	101 Å²	101	64%	0.643	54%	0.539	S	S	*	.			trans	-89.4	115.4	168.7	177.8	0	0	0	0	108.2	Q583	S581-Q583 VanDerWaalsContact C-N 3.25Å; S581-Q583 PolarHBondContact OG-N 3.27Å
582	D	51.7	Low	71.1	Confident	163 Å²	163	102.1 Å²	102.1	87%	0.872	55%	0.549	S	S	*	.			trans	-86.2	8.9	173.7	-78	-22.3	0	0	0	112.5
583	Q	54.3	Low	71.4	Confident	156 Å²	156	103.7 Å²	103.7	73%	0.729	56%	0.557	S	S	*	*	S	Bend	trans	-78.6	133.1	-179.6	-70.9	-171.3	-7.7	0	0	111.5	S581 V585	S581-Q583 VanDerWaalsContact C-N 3.25Å; S581-Q583 PolarHBondContact OG-N 3.27Å; Q583-V585 PolarHBondContact O-N 3.17Å
584	P	58.4	Low	71.9	Confident	126 Å²	126	97.6 Å²	97.6	82%	0.818	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-62.7	128.5	174.1	24.6	-30.4	0	0	0	109.9	D586	P584-D586 PolarHBondContact O-N 3.38Å
585	V	65.7	Low	72.5	Confident	89 Å²	89	90 Å²	90	54%	0.539	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-70.6	126.6	178.2	179.8	0	0	0	0	109.2	Q504 Q583 I587	Q504-V585 VanDerWaalsContact CD-CG1 3.41Å; Q504-V585 HydrophobicContact CG-CG1 4.32Å; Q583-V585 PolarHBondContact O-N 3.17Å; V585-I587 PolarHBondContact O-N 2.8Å
586	D	69.8	Low	73.5	Confident	107 Å²	107	89.3 Å²	89.3	57%	0.572	48%	0.481	S	S	*	.			trans	-72.2	111.4	170.5	176.4	25.8	0	0	0	109.9	S500 P584 G588	S500-D586 PolarHBondContact OG-OD2 3.21Å; P584-D586 PolarHBondContact O-N 3.38Å; D586-G588 VanDerWaalsContact C-N 3.3Å; D586-G588 PolarHBondContact OD1-N 3.33Å
587	I	71.3	Confident	74.8	Confident	64 Å²	64	89.2 Å²	89.2	33%	0.328	49%	0.485	S	S	.	.			trans	-84.8	-8.2	-178.3	-54.8	174.4	0	0	0	111	R501 V585	R501-I587 WeakPolarHBondContact CA-O 3.4Å; R501-I587 VanDerWaalsContact CB-O 3.24Å; R501-I587 WeakPolarHBondContact CB-O 3.35Å; V585-I587 PolarHBondContact O-N 2.8Å
588	G	80.8	Confident	76.1	Confident	30 Å²	30	84.1 Å²	84.1	31%	0.309	45%	0.452	S	S	.	.			trans	67.7	-165.6	-175.7	0	0	0	0	0	113.7	D586	D586-G588 VanDerWaalsContact C-N 3.3Å; D586-G588 PolarHBondContact OD1-N 3.33Å
589	T	86.5	Confident	77.9	Confident	71 Å²	71	74.6 Å²	74.6	44%	0.436	42%	0.416	S	S	.	.			trans	-102.4	151.1	-177.7	52.3	0	0	0	0	112.5	R501 D594	R501-T589 WeakPolarHBondContact CD-O 3.32Å; T589-D594 WeakPolarHBondContact CB-OD1 3.48Å; T589-D594 VanDerWaalsContact OG1-CG 3.32Å; T589-D594 PolarHBondContact OG1-OD1 2.96Å; T589-D594 PolarHBondContact OG1-OD2 3.11Å
590	S	88.3	Confident	79.7	Confident	22 Å²	22	74.6 Å²	74.6	15%	0.154	41%	0.408	C	S	.	.			trans	-87.9	161.7	174.4	61.4	0	0	0	0	112.3	V592 Q593 D594	S590-V592 PolarHBondContact O-N 2.98Å; S590-Q593 PolarHBondContact O-N 2.78Å; S590-Q593 VanDerWaalsContact O-N 3.09Å; S590-Q593 WeakPolarHBondContact OG-CG 3.46Å; S590-Q593 PolarHBondContact OG-N 3.22Å; S590-Q593 PolarHBondContact OG-OE1 3.13Å; S590-D594 PolarHBondContact O-N 3.05Å
591	L	91.3	Very high	81.4	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-48.6	-46.3	171.5	172.4	66.1	0	0	0	112.2	L361 H362 Y365 R398 D471 Q593 D594 M595	L361-L591 HydrophobicContact CD2-CD2 4.08Å; L361-L591 HydrophobicContact CD2-CG 4.27Å; L361-L591 HydrophobicContact CG-CD2 4.18Å; H362-L591 VanDerWaalsContact CD2-CD2 3.4Å; H362-L591 WeakPolarHBondContact CD2-CD2 3.38Å; Y365-L591 HydrophobicContact CD2-CD1 3.92Å; Y365-L591 HydrophobicContact CD2-CD2 4.03Å; Y365-L591 HydrophobicContact CD2-CG 4.45Å; Y365-L591 HydrophobicContact CE2-CD1 4.11Å; R398-L591 VanDerWaalsContact CZ-CA 3.49Å; R398-L591 VanDerWaalsContact NH1-CD1 3.32Å; D471-L591 HydrophobicContact CB-CB 3.92Å; L591-Q593 PolarHBondContact O-N 3.11Å; L591-D594 PolarHBondContact O-N 2.92Å; L591-M595 HydrophobicContact CD1-CG 3.66Å; L591-M595 HydrophobicContact CD1-SD 4.4Å; L591-M595 HydrophobicContact CG-CG 4.33Å; L591-M595 WeakPolarHBondContact O-CB 3.32Å; L591-M595 WeakPolarHBondContact O-CG 3.45Å; L591-M595 PolarHBondContact O-N 3.02Å
592	V	91.7	Very high	82.9	Confident	55 Å²	55	65 Å²	65	33%	0.333	38%	0.376	S	S	.	.	H	α-helix	trans	-61.4	-44.8	-179	176.9	0	0	0	0	111.1	L361 S590 K596 Y669	L361-V592 HydrophobicContact CD2-CG2 3.85Å; S590-V592 PolarHBondContact O-N 2.98Å; V592-K596 VanDerWaalsContact O-CB 3.27Å; V592-K596 WeakPolarHBondContact O-CB 3.38Å; V592-K596 PolarHBondContact O-N 2.93Å; V592-Y669 HydrophobicContact CG1-CD2 3.96Å
593	Q	92.8	Very high	84.5	Confident	107 Å²	107	57.2 Å²	57.2	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-66.1	-44.5	-179.9	-73.6	166	-41.1	0	0	112	S590 L591 K596 A597	S590-Q593 PolarHBondContact O-N 2.78Å; S590-Q593 VanDerWaalsContact O-N 3.09Å; S590-Q593 WeakPolarHBondContact OG-CG 3.46Å; S590-Q593 PolarHBondContact OG-N 3.22Å; S590-Q593 PolarHBondContact OG-OE1 3.13Å; L591-Q593 PolarHBondContact O-N 3.11Å; Q593-K596 PolarHBondContact O-N 2.82Å; Q593-A597 PolarHBondContact O-N 2.74Å
594	D	95.4	Very high	86.3	Confident	20 Å²	20	54.1 Å²	54.1	11%	0.107	32%	0.322	C	S	.	.	H	α-helix	trans	-66	-41.7	-180	-68.5	-21.3	0	0	0	111.6	R398 T589 S590 L591 A597 C598	R398-D594 WeakPolarHBondContact CD-OD2 3.35Å; R398-D594 IonicContact CZ-OD2 3.21Å; R398-D594 IonicContact NE-OD2 2.72Å; R398-D594 PolarHBondContact NE-OD2 2.56Å; R398-D594 IonicContact NH2-OD2 3.42Å; T589-D594 WeakPolarHBondContact CB-OD1 3.48Å; T589-D594 VanDerWaalsContact OG1-CG 3.32Å; T589-D594 PolarHBondContact OG1-OD1 2.96Å; T589-D594 PolarHBondContact OG1-OD2 3.11Å; S590-D594 PolarHBondContact O-N 3.05Å; L591-D594 PolarHBondContact O-N 2.92Å; D594-A597 PolarHBondContact O-N 3.48Å; D594-C598 WeakPolarHBondContact O-CB 3.48Å; D594-C598 PolarHBondContact O-N 2.92Å
595	M	96.9	Very high	87.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-72.5	-31.2	178.7	-63.5	-54.2	-64.6	0	0	112.5	Y365 A397 L591 C598 L599 I624 Y668	Y365-M595 HydrophobicContact CE2-CE 4.16Å; Y365-M595 HydrophobicContact CE2-CG 4.1Å; A397-M595 HydrophobicContact CB-SD 3.87Å; L591-M595 HydrophobicContact CD1-CG 3.66Å; L591-M595 HydrophobicContact CD1-SD 4.4Å; L591-M595 HydrophobicContact CG-CG 4.33Å; L591-M595 WeakPolarHBondContact O-CB 3.32Å; L591-M595 WeakPolarHBondContact O-CG 3.45Å; L591-M595 PolarHBondContact O-N 3.02Å; M595-C598 WeakPolarHBondContact O-CB 3.13Å; M595-C598 PolarHBondContact O-N 3.02Å; M595-L599 PolarHBondContact O-N 3.38Å; M595-L599 VanDerWaalsContact O-N 3.13Å; M595-I624 HydrophobicContact CE-CD1 3.32Å; M595-I624 HydrophobicContact CE-CG1 3.84Å; M595-Y668 VanDerWaalsContact CB-O 3.3Å; M595-Y668 WeakPolarHBondContact CB-O 3.38Å
596	K	96.3	Very high	89.1	Confident	87 Å²	87	48.5 Å²	48.5	38%	0.378	28%	0.28	S	S	.	.	H	α-helix	trans	-60.9	-51.3	167.6	178.3	178.8	175.9	179.6	0	111	V592 Q593 C598 L599 E600 Y669	V592-K596 VanDerWaalsContact O-CB 3.27Å; V592-K596 WeakPolarHBondContact O-CB 3.38Å; V592-K596 PolarHBondContact O-N 2.93Å; Q593-K596 PolarHBondContact O-N 2.82Å; K596-C598 PolarHBondContact O-N 3Å; K596-L599 PolarHBondContact O-N 2.98Å; K596-L599 VanDerWaalsContact O-N 3.09Å; K596-E600 VanDerWaalsContact CE-CD 3.48Å; K596-E600 WeakPolarHBondContact CE-OE1 3.35Å; K596-E600 HydrophobicContact CG-CG 4.39Å; K596-E600 IonicContact NZ-OE1 3.52Å; K596-E600 WeakPolarHBondContact O-CG 3.37Å; K596-E600 PolarHBondContact O-N 3.38Å; K596-Y669 HydrophobicContact CB-CD1 3.86Å; K596-Y669 HydrophobicContact CB-CD2 4.12Å; K596-Y669 HydrophobicContact CB-CE1 4.02Å; K596-Y669 HydrophobicContact CB-CE2 4.24Å; K596-Y669 HydrophobicContact CB-CG 3.93Å; K596-Y669 HydrophobicContact CD-CE2 4.19Å; K596-Y669 HydrophobicContact CG-CD1 4.35Å; K596-Y669 HydrophobicContact CG-CE1 3.99Å; K596-Y669 HydrophobicContact CG-CE2 4.23Å
597	A	95.6	Very high	90.2	Very high	52 Å²	52	45.2 Å²	45.2	43%	0.43	26%	0.264	S	S	.	.	H	α-helix	trans	-60.6	-33.5	177.5	0	0	0	0	0	112.4	Q593 D594 G601 G602	Q593-A597 PolarHBondContact O-N 2.74Å; D594-A597 PolarHBondContact O-N 3.48Å; A597-G601 PolarHBondContact O-N 3.11Å; A597-G602 WeakPolarHBondContact O-CA 3.39Å; A597-G602 PolarHBondContact O-N 3.35Å
598	C	95.4	Very high	91.2	Very high	6 Å²	6	45.2 Å²	45.2	4%	0.041	27%	0.265	C	S	.	.	I	π-helix	trans	-60.7	-47	173.1	-175.5	0	0	0	0	111.9	A397 D594 M595 K596 G603	A397-C598 HydrophobicContact CB-CB 3.87Å; D594-C598 WeakPolarHBondContact O-CB 3.48Å; D594-C598 PolarHBondContact O-N 2.92Å; M595-C598 WeakPolarHBondContact O-CB 3.13Å; M595-C598 PolarHBondContact O-N 3.02Å; K596-C598 PolarHBondContact O-N 3Å; C598-G603 PolarHBondContact O-N 2.77Å
599	L	95.4	Very high	91.9	Very high	11 Å²	11	44 Å²	44	6%	0.058	25%	0.252	C	S	.	.	I	π-helix	trans	-68.6	-37.3	178.3	-175.8	63.2	0	0	0	113.1	M595 K596 G601 R618 L664 R665 Y668 Y669	M595-L599 PolarHBondContact O-N 3.38Å; M595-L599 VanDerWaalsContact O-N 3.13Å; K596-L599 PolarHBondContact O-N 2.98Å; K596-L599 VanDerWaalsContact O-N 3.09Å; L599-G601 PolarHBondContact O-N 3.06Å; L599-R618 PolarHBondContact O-NH2 2.96Å; L599-L664 HydrophobicContact CD1-CB 4.27Å; L599-L664 HydrophobicContact CD2-CB 4.14Å; L599-R665 HydrophobicContact CD2-CG 4.05Å; L599-Y668 HydrophobicContact CB-CD1 3.7Å; L599-Y668 HydrophobicContact CB-CE1 4.18Å; L599-Y668 HydrophobicContact CB-CG 4.09Å; L599-Y668 HydrophobicContact CD1-CD1 4.01Å; L599-Y668 HydrophobicContact CD1-CD2 4.05Å; L599-Y668 HydrophobicContact CD1-CE1 3.91Å; L599-Y668 HydrophobicContact CD1-CE2 4.01Å; L599-Y668 HydrophobicContact CD1-CG 4.06Å; L599-Y668 HydrophobicContact CD2-CG 4.27Å; L599-Y668 HydrophobicContact CG-CD1 4.33Å; L599-Y668 HydrophobicContact CG-CG 4.36Å; L599-Y669 HydrophobicContact CD2-CE1 4.06Å
600	E	93.6	Very high	92.3	Very high	134 Å²	134	43.5 Å²	43.5	63%	0.626	25%	0.245	S	C	*	.	I	π-helix	trans	-76.7	1.3	-176.6	-71	-179.9	163.7	0	0	114.2	K596	K596-E600 VanDerWaalsContact CE-CD 3.48Å; K596-E600 WeakPolarHBondContact CE-OE1 3.35Å; K596-E600 HydrophobicContact CG-CG 4.39Å; K596-E600 IonicContact NZ-OE1 3.52Å; K596-E600 WeakPolarHBondContact O-CG 3.37Å; K596-E600 PolarHBondContact O-N 3.38Å
601	G	87	Confident	92.6	Very high	32 Å²	32	42.5 Å²	42.5	33%	0.33	24%	0.238	S	C	.	.	I	π-helix	trans	140.1	-22	170.8	0	0	0	0	0	114.2	A597 L599 G603 L604	A597-G601 PolarHBondContact O-N 3.11Å; L599-G601 PolarHBondContact O-N 3.06Å; G601-G603 PolarHBondContact O-N 2.82Å; G601-G603 VanDerWaalsContact O-N 3.15Å; G601-L604 PolarHBondContact O-N 3.36Å
602	G	82.6	Confident	92.7	Very high	32 Å²	32	43.6 Å²	43.6	33%	0.33	24%	0.244	S	C	.	.	I	π-helix	trans	-64.3	-18.2	-178.3	0	0	0	0	0	114.5	R403 A597	R403-G602 VanDerWaalsContact CZ-O 3.23Å; R403-G602 PolarHBondContact NH1-O 2.83Å; R403-G602 PolarHBondContact NH2-O 2.84Å; A597-G602 WeakPolarHBondContact O-CA 3.39Å; A597-G602 PolarHBondContact O-N 3.35Å
603	G	86.3	Confident	92.7	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.01	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-5.2	-179	0	0	0	0	0	115.8	C598 G601 E605 F606 H621	C598-G603 PolarHBondContact O-N 2.77Å; G601-G603 PolarHBondContact O-N 2.82Å; G601-G603 VanDerWaalsContact O-N 3.15Å; G603-E605 PolarHBondContact O-N 2.84Å; G603-F606 PolarHBondContact O-N 2.99Å; G603-H621 PolarHBondContact O-NE2 2.88Å; G603-H621 VanDerWaalsContact O-NE2 3.07Å
604	L	90.5	Very high	92.4	Very high	90 Å²	90	42.9 Å²	42.9	47%	0.471	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-56.7	-33.4	-166.9	-73	170.1	0	0	0	114.4	G601 F606 C607 P619	G601-L604 PolarHBondContact O-N 3.36Å; L604-F606 PolarHBondContact O-N 3.02Å; L604-C607 PolarHBondContact O-N 3.01Å; L604-P619 HydrophobicContact CD2-CB 4.42Å
605	E	91	Very high	91.8	Very high	94 Å²	94	44.8 Å²	44.8	44%	0.439	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-72.1	-9.6	179.2	68.4	177.6	162.6	0	0	114.6	R403 R410 G603	R403-E605 IonicContact CZ-OE1 3.11Å; R403-E605 IonicContact NE-OE1 2.74Å; R403-E605 PolarHBondContact NE-OE1 2.77Å; R403-E605 VanDerWaalsContact NE-OE1 3.15Å; R403-E605 IonicContact NH2-OE1 3.74Å; R403-E605 PolarHBondContact NH2-OE1 2.8Å; R410-E605 PolarHBondContact NH1-O 2.85Å; G603-E605 PolarHBondContact O-N 2.84Å
606	F	93	Very high	91.5	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.018	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-112.8	1.9	-179.9	-56.2	-65.7	0	0	0	113.2	I392 T396 R403 I406 L407 R410 G603 L604 D608 H621	I392-F606 HydrophobicContact CG2-CB 4.03Å; I392-F606 HydrophobicContact CG2-CD1 3.33Å; I392-F606 HydrophobicContact CG2-CE1 3.94Å; I392-F606 HydrophobicContact CG2-CG 3.76Å; T396-F606 HydrophobicContact CG2-CD1 4.33Å; T396-F606 HydrophobicContact CG2-CD2 4.12Å; T396-F606 HydrophobicContact CG2-CE1 4.01Å; T396-F606 HydrophobicContact CG2-CE2 3.74Å; T396-F606 HydrophobicContact CG2-CG 4.41Å; T396-F606 HydrophobicContact CG2-CZ 3.71Å; T396-F606 WeakPolarHBondContact OG1-CD2 3.42Å; R403-F606 HydrophobicContact CG-CE2 4.12Å; R403-F606 HydrophobicContact CG-CZ 4.07Å; I406-F606 HydrophobicContact CG2-CE1 4.1Å; L407-F606 HydrophobicContact CD2-CE1 3.97Å; L407-F606 HydrophobicContact CD2-CZ 3.8Å; L407-F606 HydrophobicContact CG-CZ 4.1Å; R410-F606 VanDerWaalsContact NH1-CD1 3.26Å; G603-F606 PolarHBondContact O-N 2.99Å; L604-F606 PolarHBondContact O-N 3.02Å; F606-D608 PolarHBondContact O-N 2.86Å; F606-H621 PolarHBondContact O-CD2 2.86Å
607	C	93.3	Very high	91.4	Very high	37 Å²	37	51.4 Å²	51.4	25%	0.25	31%	0.306	C	S	.	.			trans	-62.3	134.7	174.4	-67.9	0	0	0	0	110.9	L604 P619 A620	L604-C607 PolarHBondContact O-N 3.01Å; C607-P619 HydrophobicContact CB-CB 3.69Å; C607-A620 VanDerWaalsContact CA-O 3.25Å; C607-A620 WeakPolarHBondContact CA-O 3.42Å; C607-A620 VanDerWaalsContact CB-O 3.28Å; C607-A620 WeakPolarHBondContact CB-O 3.28Å
608	D	92.6	Very high	91.3	Very high	65 Å²	65	51.2 Å²	51.2	35%	0.348	29%	0.294	S	S	.	.			trans	-125.8	4.6	-173.9	66	-22.8	0	0	0	112.6	F606 A620 H621 K622	F606-D608 PolarHBondContact O-N 2.86Å; D608-A620 PolarHBondContact N-O 3.35Å; D608-A620 VanDerWaalsContact N-O 3.12Å; D608-H621 VanDerWaalsContact OD1-CA 3.27Å; D608-H621 WeakPolarHBondContact OD1-CA 3.16Å; D608-K622 WeakPolarHBondContact O-CE 3.43Å; D608-K622 PolarHBondContact OD1-N 2.96Å; D608-K622 WeakPolarHBondContact OD2-CB 3.49Å; D608-K622 WeakPolarHBondContact OD2-CD 3.47Å; D608-K622 WeakPolarHBondContact OD2-CG 3.36Å
609	I	94.3	Very high	91.3	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	153.1	174.8	-163.3	168.4	0	0	0	111.5	A620 K622 L625 F636 M640 G644 V646	I609-A620 HydrophobicContact CG2-CB 3.99Å; I609-A620 PolarHBondContact N-O 2.87Å; I609-A620 PolarHBondContact O-N 3.25Å; I609-K622 HydrophobicContact CB-CG 3.85Å; I609-K622 HydrophobicContact CD1-CG 4.11Å; I609-K622 HydrophobicContact CG2-CG 3.96Å; I609-L625 HydrophobicContact CG2-CD1 3.92Å; I609-F636 HydrophobicContact CD1-CD1 4.06Å; I609-F636 HydrophobicContact CD1-CE1 3.15Å; I609-F636 HydrophobicContact CD1-CZ 3.45Å; I609-F636 VanDerWaalsContact CD1-CZ 3.45Å; I609-M640 HydrophobicContact CD1-CE 3.91Å; I609-M640 HydrophobicContact CG1-CE 4.24Å; I609-G644 WeakPolarHBondContact CG1-O 3.44Å; I609-V646 HydrophobicContact CD1-CG2 3.58Å; I609-V646 HydrophobicContact CG1-CG2 4.22Å
610	I	95.4	Very high	91.3	Very high	60 Å²	60	52.8 Å²	52.8	31%	0.308	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.4	175.6	-60.1	173.5	0	0	0	109	L612 P617 G644 Q645 V646	I610-L612 HydrophobicContact CG2-CD2 4.28Å; I610-P617 HydrophobicContact CG2-CB 3.56Å; I610-G644 PolarHBondContact N-O 3.5Å; I610-Q645 HydrophobicContact CB-CG 4.22Å; I610-Q645 CarbonylContact O-C 3.57Å; I610-Q645 WeakPolarHBondContact O-CA 3.46Å; I610-V646 PolarHBondContact O-N 2.64Å
611	L	94.8	Very high	91.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.4	172.7	-53	-176.4	0	0	0	108.9	P617 R618 A620 L625 V646 I648 F660 L664	L611-P617 CarbonylContact O-C 3.56Å; L611-R618 HydrophobicContact CB-CB 4.45Å; L611-R618 PolarHBondContact N-O 2.71Å; L611-R618 PolarHBondContact O-N 2.82Å; L611-A620 HydrophobicContact CD1-CB 3.81Å; L611-A620 HydrophobicContact CG-CB 3.88Å; L611-L625 HydrophobicContact CD1-CD1 4.23Å; L611-L625 HydrophobicContact CD1-CD2 4.31Å; L611-L625 HydrophobicContact CD2-CD1 4.02Å; L611-V646 CarbonylContact C-O 3.19Å; L611-V646 WeakPolarHBondContact CA-O 3.49Å; L611-V646 HydrophobicContact CD2-CB 4.07Å; L611-I648 HydrophobicContact CB-CD1 4.06Å; L611-I648 HydrophobicContact CB-CG1 3.84Å; L611-I648 HydrophobicContact CD1-CD1 4.27Å; L611-I648 HydrophobicContact CD2-CD1 4.07Å; L611-I648 HydrophobicContact CG-CD1 4.34Å; L611-F660 HydrophobicContact CB-CZ 3.86Å; L611-F660 HydrophobicContact CD1-CE2 4.26Å; L611-F660 HydrophobicContact CD1-CZ 3.82Å; L611-L664 HydrophobicContact CD1-CD2 3.9Å
612	L	93	Very high	91.7	Very high	23 Å²	23	47.3 Å²	47.3	12%	0.12	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	114.7	179.9	-66.9	175.2	0	0	0	109.9	I610 P617 Q645 V646 N647 I648	I610-L612 HydrophobicContact CG2-CD2 4.28Å; L612-P617 HydrophobicContact CD2-CB 4.02Å; L612-Q645 HydrophobicContact CD1-CB 3.86Å; L612-Q645 HydrophobicContact CG-CB 4.24Å; L612-V646 PolarHBondContact N-O 3.18Å; L612-N647 WeakPolarHBondContact CB-OD1 3.45Å; L612-N647 VanDerWaalsContact CD1-OD1 3.29Å; L612-N647 WeakPolarHBondContact CD1-OD1 3.32Å; L612-I648 PolarHBondContact O-N 3.46Å
613	L	91.1	Very high	92.3	Very high	12 Å²	12	46 Å²	46	6%	0.063	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	105.8	171.2	-175.1	77.6	0	0	0	109	G615 H616 I648 V654 P655 K657 F660	L613-G615 PolarHBondContact O-N 2.82Å; L613-H616 PolarHBondContact N-O 2.81Å; L613-H616 VanDerWaalsContact O-CB 3.28Å; L613-H616 WeakPolarHBondContact O-CB 3.3Å; L613-H616 PolarHBondContact O-N 2.94Å; L613-I648 HydrophobicContact CD1-CB 4.32Å; L613-I648 HydrophobicContact CD1-CG2 4.14Å; L613-V654 HydrophobicContact CD1-CG1 3.81Å; L613-V654 HydrophobicContact CG-CG1 4.42Å; L613-P655 HydrophobicContact CD1-CG 3.88Å; L613-K657 HydrophobicContact CD2-CB 4.17Å; L613-F660 HydrophobicContact CB-CD1 4.2Å; L613-F660 HydrophobicContact CB-CE1 4.39Å; L613-F660 HydrophobicContact CD1-CB 4.14Å; L613-F660 HydrophobicContact CD1-CG 4.15Å; L613-F660 HydrophobicContact CD2-CB 3.75Å; L613-F660 HydrophobicContact CD2-CD1 3.89Å; L613-F660 HydrophobicContact CD2-CG 4.01Å; L613-F660 HydrophobicContact CG-CD1 4.45Å; L613-F660 HydrophobicContact CG-CG 4.5Å
614	D	86.6	Confident	92.8	Very high	136 Å²	136	45.9 Å²	45.9	73%	0.727	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	44.9	-176.7	-160	22.3	0	0	0	112.8	H616 V654	D614-H616 PolarHBondContact O-N 2.82Å; D614-V654 HydrophobicContact CB-CG1 4.33Å
615	G	83.6	Confident	93.1	Very high	59 Å²	59	41.6 Å²	41.6	61%	0.608	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.2	-3.6	-176.9	0	0	0	0	0	115.5	L613 P617	L613-G615 PolarHBondContact O-N 2.82Å; G615-P617 WeakPolarHBondContact O-CD 3.12Å
616	H	90.1	Very high	93.3	Very high	138 Å²	138	37.4 Å²	37.4	64%	0.639	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	118.1	173.7	-65.5	-65.4	0	0	0	111.5	L613 D614	L613-H616 PolarHBondContact N-O 2.81Å; L613-H616 VanDerWaalsContact O-CB 3.28Å; L613-H616 WeakPolarHBondContact O-CB 3.3Å; L613-H616 PolarHBondContact O-N 2.94Å; D614-H616 PolarHBondContact O-N 2.82Å
617	P	93.5	Very high	93.5	Very high	89 Å²	89	38 Å²	38	58%	0.578	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78	134.4	-178.8	30.7	-34.4	0	0	0	112.6	I610 L611 L612 G615	I610-P617 HydrophobicContact CG2-CB 3.56Å; L611-P617 CarbonylContact O-C 3.56Å; L612-P617 HydrophobicContact CD2-CB 4.02Å; G615-P617 WeakPolarHBondContact O-CD 3.12Å
618	R	94.3	Very high	93.6	Very high	47 Å²	47	36.3 Å²	36.3	18%	0.177	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	109	173.8	-176.2	66.5	169.4	104.7	-4	110	L599 L611 F660 E661 L664	L599-R618 PolarHBondContact O-NH2 2.96Å; L611-R618 HydrophobicContact CB-CB 4.45Å; L611-R618 PolarHBondContact N-O 2.71Å; L611-R618 PolarHBondContact O-N 2.82Å; R618-F660 HydrophobicContact CB-CE1 3.92Å; R618-F660 HydrophobicContact CB-CZ 4.47Å; R618-F660 HydrophobicContact CG-CE1 3.95Å; R618-F660 HydrophobicContact CG-CZ 4.5Å; R618-E661 IonicContact CZ-OE1 3.53Å; R618-E661 IonicContact NE-OE1 3.93Å; R618-E661 PolarHBondContact NE-OE1 2.7Å; R618-E661 IonicContact NE-OE2 2.72Å; R618-E661 IonicContact NH2-OE2 3.86Å; R618-L664 HydrophobicContact CG-CD1 3.97Å
619	P	94.7	Very high	93.8	Very high	51 Å²	51	33.3 Å²	33.3	33%	0.331	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	140.3	174.6	-22.6	33.5	0	0	0	112.1	L604 C607	L604-P619 HydrophobicContact CD2-CB 4.42Å; C607-P619 HydrophobicContact CB-CB 3.69Å
620	A	95.8	Very high	93.8	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	-179.4	179.4	0	0	0	0	0	112.1	C607 D608 I609 L611 L625 Y668	C607-A620 VanDerWaalsContact CA-O 3.25Å; C607-A620 WeakPolarHBondContact CA-O 3.42Å; C607-A620 VanDerWaalsContact CB-O 3.28Å; C607-A620 WeakPolarHBondContact CB-O 3.28Å; D608-A620 PolarHBondContact N-O 3.35Å; D608-A620 VanDerWaalsContact N-O 3.12Å; I609-A620 HydrophobicContact CG2-CB 3.99Å; I609-A620 PolarHBondContact N-O 2.87Å; I609-A620 PolarHBondContact O-N 3.25Å; L611-A620 HydrophobicContact CD1-CB 3.81Å; L611-A620 HydrophobicContact CG-CB 3.88Å; A620-L625 HydrophobicContact CB-CD1 3.96Å; A620-Y668 WeakPolarHBondContact CA-OH 3.42Å
621	H	95.6	Very high	93.7	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.014	21%	0.212	C	C	.	.			trans	-117.3	123.9	-179.9	-50.6	92.3	0	0	0	111.7	A393 G603 F606 D608 A623 I624 L625 Y668	A393-H621 HydrophobicContact CB-CB 3.79Å; G603-H621 PolarHBondContact O-NE2 2.88Å; G603-H621 VanDerWaalsContact O-NE2 3.07Å; F606-H621 PolarHBondContact O-CD2 2.86Å; D608-H621 VanDerWaalsContact OD1-CA 3.27Å; D608-H621 WeakPolarHBondContact OD1-CA 3.16Å; H621-A623 PolarHBondContact O-N 3.45Å; H621-I624 HydrophobicContact CB-CB 4.19Å; H621-I624 HydrophobicContact CB-CD1 3.82Å; H621-I624 HydrophobicContact CB-CG1 4.04Å; H621-I624 PolarHBondContact O-N 2.92Å; H621-L625 WeakPolarHBondContact O-CG 3.25Å; H621-L625 PolarHBondContact O-N 2.82Å; H621-L625 VanDerWaalsContact O-N 3.08Å; H621-Y668 PolarHBondContact N-OH 3.06Å; H621-Y668 VanDerWaalsContact N-OH 3.14Å; H621-Y668 AromaticContact ND1-CE1 3.48Å; H621-Y668 WeakPolarHBondContact ND1-CE1 3.25Å; H621-Y668 AromaticContact ND1-CZ 3.56Å; H621-Y668 PolarHBondContact ND1-OH 3.12Å
622	K	94	Very high	93.7	Very high	48 Å²	48	37.1 Å²	37.1	21%	0.209	21%	0.212	C	C	.	.	H	α-helix	trans	-58.5	-46.9	-179.5	-67.9	179.4	-157.5	176.1	0	112.6	D608 I609 I624 L625 A626 F636 M640	D608-K622 WeakPolarHBondContact O-CE 3.43Å; D608-K622 PolarHBondContact OD1-N 2.96Å; D608-K622 WeakPolarHBondContact OD2-CB 3.49Å; D608-K622 WeakPolarHBondContact OD2-CD 3.47Å; D608-K622 WeakPolarHBondContact OD2-CG 3.36Å; I609-K622 HydrophobicContact CB-CG 3.85Å; I609-K622 HydrophobicContact CD1-CG 4.11Å; I609-K622 HydrophobicContact CG2-CG 3.96Å; K622-I624 VanDerWaalsContact C-N 3.29Å; K622-I624 PolarHBondContact O-N 2.89Å; K622-L625 PolarHBondContact O-N 3.21Å; K622-A626 VanDerWaalsContact O-CB 3.29Å; K622-A626 WeakPolarHBondContact O-CB 3.46Å; K622-A626 PolarHBondContact O-N 2.92Å; K622-F636 HydrophobicContact CB-CD2 3.93Å; K622-F636 HydrophobicContact CB-CE2 3.86Å; K622-F636 HydrophobicContact CG-CD2 4.17Å; K622-F636 HydrophobicContact CG-CE2 4.01Å; K622-F636 HydrophobicContact CG-CZ 4.26Å; K622-M640 HydrophobicContact CD-CE 4.32Å; K622-M640 HydrophobicContact CD-SD 4.36Å; K622-M640 VanDerWaalsContact CE-CE 3.47Å
623	A	95	Very high	93.8	Very high	3 Å²	3	38.5 Å²	38.5	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-42	-178.5	0	0	0	0	0	112	L368 H391 H621 A627	L368-A623 HydrophobicContact CD2-CB 4.16Å; H391-A623 HydrophobicContact CB-CB 4.13Å; H621-A623 PolarHBondContact O-N 3.45Å; A623-A627 VanDerWaalsContact O-CB 3.28Å; A623-A627 WeakPolarHBondContact O-CB 3.25Å; A623-A627 PolarHBondContact O-N 3.03Å
624	I	96.9	Very high	93.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.3	-46.7	178.5	-64.7	172.9	0	0	0	110.8	Y365 A393 M595 H621 K622 A627 R628 I667 Y668	Y365-I624 HydrophobicContact CE1-CG2 4.36Å; Y365-I624 WeakPolarHBondContact OH-CG2 3.24Å; A393-I624 HydrophobicContact CB-CD1 4.16Å; A393-I624 HydrophobicContact CB-CG1 4.3Å; M595-I624 HydrophobicContact CE-CD1 3.32Å; M595-I624 HydrophobicContact CE-CG1 3.84Å; H621-I624 HydrophobicContact CB-CB 4.19Å; H621-I624 HydrophobicContact CB-CD1 3.82Å; H621-I624 HydrophobicContact CB-CG1 4.04Å; H621-I624 PolarHBondContact O-N 2.92Å; K622-I624 VanDerWaalsContact C-N 3.29Å; K622-I624 PolarHBondContact O-N 2.89Å; I624-A627 PolarHBondContact O-N 3.29Å; I624-R628 WeakPolarHBondContact O-CB 3.46Å; I624-R628 WeakPolarHBondContact O-CG 3.43Å; I624-R628 PolarHBondContact O-N 2.87Å; I624-I667 HydrophobicContact CG2-CG2 4.08Å; I624-Y668 HydrophobicContact CD1-CD1 3.85Å; I624-Y668 HydrophobicContact CD1-CE1 3.54Å; I624-Y668 HydrophobicContact CG2-CD1 4.18Å; I624-Y668 HydrophobicContact CG2-CD2 3.72Å; I624-Y668 HydrophobicContact CG2-CE1 4.33Å; I624-Y668 HydrophobicContact CG2-CE2 3.83Å; I624-Y668 HydrophobicContact CG2-CG 3.91Å
625	L	96.6	Very high	94.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.5	-49	179.1	-70.2	167.8	0	0	0	111.3	I609 L611 A620 H621 K622 A627 R628 S629 F632 F636 I667	I609-L625 HydrophobicContact CG2-CD1 3.92Å; L611-L625 HydrophobicContact CD1-CD1 4.23Å; L611-L625 HydrophobicContact CD1-CD2 4.31Å; L611-L625 HydrophobicContact CD2-CD1 4.02Å; A620-L625 HydrophobicContact CB-CD1 3.96Å; H621-L625 WeakPolarHBondContact O-CG 3.25Å; H621-L625 PolarHBondContact O-N 2.82Å; H621-L625 VanDerWaalsContact O-N 3.08Å; K622-L625 PolarHBondContact O-N 3.21Å; L625-A627 PolarHBondContact O-N 3.5Å; L625-R628 PolarHBondContact O-N 2.68Å; L625-S629 WeakPolarHBondContact O-CB 3.35Å; L625-S629 PolarHBondContact O-N 3.16Å; L625-F632 HydrophobicContact CB-CB 3.99Å; L625-F632 HydrophobicContact CB-CD2 3.96Å; L625-F632 HydrophobicContact CB-CG 3.97Å; L625-F632 HydrophobicContact CD2-CD2 3.94Å; L625-F632 HydrophobicContact CD2-CE2 3.84Å; L625-F632 HydrophobicContact CD2-CZ 4.34Å; L625-F632 HydrophobicContact CG-CD2 4.47Å; L625-F636 HydrophobicContact CB-CE2 3.96Å; L625-F636 HydrophobicContact CB-CZ 4.28Å; L625-F636 HydrophobicContact CD1-CE2 4.43Å; L625-F636 HydrophobicContact CD1-CZ 4.06Å; L625-I667 HydrophobicContact CD2-CD1 4.11Å; L625-I667 HydrophobicContact CD2-CG2 4.08Å
626	A	95.4	Very high	94.5	Very high	5 Å²	5	33.2 Å²	33.2	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-37.8	-179.9	0	0	0	0	0	112.8	F374 K622 R628 E633 F636	F374-A626 HydrophobicContact CD2-CB 3.77Å; F374-A626 HydrophobicContact CE2-CB 3.43Å; F374-A626 VanDerWaalsContact CE2-CB 3.43Å; F374-A626 HydrophobicContact CZ-CB 4.03Å; K622-A626 VanDerWaalsContact O-CB 3.29Å; K622-A626 WeakPolarHBondContact O-CB 3.46Å; K622-A626 PolarHBondContact O-N 2.92Å; A626-R628 PolarHBondContact O-N 3.39Å; A626-E633 HydrophobicContact CB-CB 4.14Å; A626-E633 HydrophobicContact CB-CG 4.49Å; A626-F636 HydrophobicContact CB-CD2 4.1Å; A626-F636 HydrophobicContact CB-CE2 4.41Å
627	A	96.1	Very high	94.4	Very high	16 Å²	16	32.3 Å²	32.3	13%	0.132	17%	0.172	C	C	.	.	H	α-helix	trans	-61.7	-31.1	176.1	0	0	0	0	0	112.7	D364 Y365 L368 A623 I624 L625	D364-A627 WeakPolarHBondContact CB-O 3.18Å; Y365-A627 HydrophobicContact CD1-CB 3.73Å; Y365-A627 HydrophobicContact CE1-CB 3.99Å; L368-A627 HydrophobicContact CB-CB 3.86Å; L368-A627 HydrophobicContact CD1-CB 4.26Å; L368-A627 HydrophobicContact CD2-CB 3.94Å; L368-A627 HydrophobicContact CG-CB 4.2Å; A623-A627 VanDerWaalsContact O-CB 3.28Å; A623-A627 WeakPolarHBondContact O-CB 3.25Å; A623-A627 PolarHBondContact O-N 3.03Å; I624-A627 PolarHBondContact O-N 3.29Å; L625-A627 PolarHBondContact O-N 3.5Å
628	R	96.2	Very high	94.2	Very high	3 Å²	3	31.6 Å²	31.6	1%	0.011	17%	0.17	C	C	.	.	H	α-helix	trans	-106.6	-6.3	-167.5	-60.6	-69.7	-65.4	139.3	4.4	113.2	T360 D364 Y365 I624 L625 A626 Y666 I667 F691	T360-R628 PolarHBondContact OG1-NH1 2.61Å; D364-R628 IonicContact OD2-CZ 2.87Å; D364-R628 IonicContact OD2-NH1 3.54Å; D364-R628 PolarHBondContact OD2-NH1 3.21Å; Y365-R628 HydrophobicContact CE1-CG 3.89Å; I624-R628 WeakPolarHBondContact O-CB 3.46Å; I624-R628 WeakPolarHBondContact O-CG 3.43Å; I624-R628 PolarHBondContact O-N 2.87Å; L625-R628 PolarHBondContact O-N 2.68Å; A626-R628 PolarHBondContact O-N 3.39Å; R628-Y666 PolarHBondContact NH2-O 2.9Å; R628-I667 HydrophobicContact CB-CG2 3.91Å; R628-I667 HydrophobicContact CG-CG2 4.26Å; R628-I667 VanDerWaalsContact CG-O 3.29Å; R628-I667 WeakPolarHBondContact CG-O 3.42Å; R628-I667 PolarHBondContact NE-O 3.42Å; R628-F691 WeakPolarHBondContact O-CD1 3.48Å
629	S	95.9	Very high	93.6	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.007	20%	0.196	C	C	.	.			trans	-150.8	116	-175.2	166.8	0	0	0	0	110.2	L625 Y631 F632 E633 Y689	L625-S629 WeakPolarHBondContact O-CB 3.35Å; L625-S629 PolarHBondContact O-N 3.16Å; S629-Y631 PolarHBondContact O-N 3.33Å; S629-Y631 PolarHBondContact OG-N 3.04Å; S629-F632 PolarHBondContact O-N 2.76Å; S629-F632 VanDerWaalsContact OG-CD2 3.3Å; S629-F632 WeakPolarHBondContact OG-CD2 3.38Å; S629-F632 PolarHBondContact OG-N 3.07Å; S629-E633 PolarHBondContact O-N 3.44Å; S629-Y689 WeakPolarHBondContact CB-O 3.26Å; S629-Y689 PolarHBondContact OG-O 3.49Å
630	S	94.8	Very high	93.1	Very high	63 Å²	63	38 Å²	38	44%	0.441	20%	0.195	S	C	.	.	H	α-helix	trans	-64	-26.4	174.7	55.9	0	0	0	0	112.5	A634 G690	S630-A634 VanDerWaalsContact O-CB 3.28Å; S630-A634 WeakPolarHBondContact O-CB 3.38Å; S630-A634 PolarHBondContact O-N 3.16Å; S630-G690 PolarHBondContact N-O 3.48Å; S630-G690 WeakPolarHBondContact OG-CA 3.5Å; S630-G690 PolarHBondContact OG-O 2.6Å
631	Y	94.3	Very high	92.4	Very high	82 Å²	82	39.8 Å²	39.8	32%	0.322	21%	0.207	S	C	.	.	H	α-helix	trans	-62.4	-52.2	171.9	175.2	-98.4	0	0	0	111.9	S629 E633 A634 M635 Y689	S629-Y631 PolarHBondContact O-N 3.33Å; S629-Y631 PolarHBondContact OG-N 3.04Å; Y631-E633 VanDerWaalsContact C-N 3.33Å; Y631-E633 PolarHBondContact O-N 3.29Å; Y631-A634 PolarHBondContact O-N 3.44Å; Y631-M635 HydrophobicContact CD1-CE 3.85Å; Y631-M635 HydrophobicContact CE1-CE 3.06Å; Y631-M635 HydrophobicContact CE2-CE 4.36Å; Y631-M635 WeakPolarHBondContact O-CB 3.37Å; Y631-M635 PolarHBondContact O-N 2.86Å; Y631-M635 WeakPolarHBondContact OH-CE 3.3Å; Y631-Y689 WeakPolarHBondContact CB-O 3.48Å; Y631-Y689 AromaticContact CD1-CD1 3.6Å; Y631-Y689 HydrophobicContact CD1-CD1 3.6Å; Y631-Y689 AromaticContact CD1-CE1 3.88Å; Y631-Y689 HydrophobicContact CD1-CE1 3.88Å; Y631-Y689 HydrophobicContact CE1-CD1 4.16Å; Y631-Y689 AromaticContact CE1-CE1 3.96Å; Y631-Y689 HydrophobicContact CE1-CE1 3.96Å; Y631-Y689 HydrophobicContact CG-CD1 4.25Å; Y631-Y689 PolarHBondContact N-O 2.92Å
632	F	94.8	Very high	91.8	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-65.1	-38.6	176.9	-73.5	-58.3	0	0	0	111.6	L625 S629 M635 F636 V646 I648 I667 Y689	L625-F632 HydrophobicContact CB-CB 3.99Å; L625-F632 HydrophobicContact CB-CD2 3.96Å; L625-F632 HydrophobicContact CB-CG 3.97Å; L625-F632 HydrophobicContact CD2-CD2 3.94Å; L625-F632 HydrophobicContact CD2-CE2 3.84Å; L625-F632 HydrophobicContact CD2-CZ 4.34Å; L625-F632 HydrophobicContact CG-CD2 4.47Å; S629-F632 PolarHBondContact O-N 2.76Å; S629-F632 VanDerWaalsContact OG-CD2 3.3Å; S629-F632 WeakPolarHBondContact OG-CD2 3.38Å; S629-F632 PolarHBondContact OG-N 3.07Å; F632-M635 HydrophobicContact CD1-CE 4.21Å; F632-M635 HydrophobicContact CE1-CE 4.4Å; F632-M635 PolarHBondContact O-N 2.96Å; F632-F636 HydrophobicContact CB-CD2 4.49Å; F632-F636 HydrophobicContact CB-CE2 3.84Å; F632-F636 HydrophobicContact CB-CZ 3.97Å; F632-F636 HydrophobicContact CD1-CE1 4.28Å; F632-F636 AromaticContact CD1-CZ 3.83Å; F632-F636 HydrophobicContact CD1-CZ 3.83Å; F632-F636 HydrophobicContact CG-CZ 4.22Å; F632-F636 WeakPolarHBondContact O-CD2 3.35Å; F632-F636 WeakPolarHBondContact O-CG 3.5Å; F632-F636 PolarHBondContact O-N 3.1Å; F632-V646 HydrophobicContact CE1-CG1 4.24Å; F632-I648 HydrophobicContact CE1-CD1 4.35Å; F632-I648 HydrophobicContact CZ-CD1 4.05Å; F632-I667 HydrophobicContact CE2-CD1 4.37Å; F632-Y689 HydrophobicContact CD2-CD1 4.24Å; F632-Y689 HydrophobicContact CE1-CE1 4.29Å; F632-Y689 AromaticContact CE2-CD1 3.59Å; F632-Y689 HydrophobicContact CE2-CD1 3.59Å; F632-Y689 AromaticContact CE2-CE1 3.71Å; F632-Y689 HydrophobicContact CE2-CE1 3.71Å; F632-Y689 AromaticContact CZ-CD1 3.86Å; F632-Y689 HydrophobicContact CZ-CD1 3.86Å; F632-Y689 AromaticContact CZ-CE1 3.49Å; F632-Y689 HydrophobicContact CZ-CE1 3.49Å; F632-Y689 VanDerWaalsContact CZ-CE1 3.49Å
633	E	94.3	Very high	91.4	Very high	52 Å²	52	52.1 Å²	52.1	24%	0.243	27%	0.269	C	S	.	.	H	α-helix	trans	-56.1	-52.1	173.7	-171.3	-166.9	169.7	0	0	111.8	Q373 F374 A626 S629 Y631 F636 R637	Q373-E633 PolarHBondContact OE1-OE1 3.42Å; F374-E633 HydrophobicContact CE2-CG 4.03Å; F374-E633 HydrophobicContact CZ-CG 4.23Å; A626-E633 HydrophobicContact CB-CB 4.14Å; A626-E633 HydrophobicContact CB-CG 4.49Å; S629-E633 PolarHBondContact O-N 3.44Å; Y631-E633 VanDerWaalsContact C-N 3.33Å; Y631-E633 PolarHBondContact O-N 3.29Å; E633-F636 PolarHBondContact O-N 3.27Å; E633-R637 VanDerWaalsContact CG-NH2 3.31Å; E633-R637 WeakPolarHBondContact O-CG 3.46Å; E633-R637 PolarHBondContact O-N 3.2Å; E633-R637 IonicContact OE1-CZ 3.14Å; E633-R637 IonicContact OE1-NH1 2.81Å; E633-R637 PolarHBondContact OE1-NH1 2.95Å; E633-R637 IonicContact OE1-NH2 2.71Å; E633-R637 PolarHBondContact OE1-NH2 2.98Å
634	A	92.6	Very high	91	Very high	52 Å²	52	52.8 Å²	52.8	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-64.6	-41	-179.8	0	0	0	0	0	111.9	S630 Y631 R637 S638	S630-A634 VanDerWaalsContact O-CB 3.28Å; S630-A634 WeakPolarHBondContact O-CB 3.38Å; S630-A634 PolarHBondContact O-N 3.16Å; Y631-A634 PolarHBondContact O-N 3.44Å; A634-R637 PolarHBondContact O-N 3.33Å; A634-S638 VanDerWaalsContact O-CB 3.29Å; A634-S638 WeakPolarHBondContact O-CB 3.41Å; A634-S638 PolarHBondContact O-N 2.79Å; A634-S638 PolarHBondContact O-OG 2.87Å
635	M	91.6	Very high	90.7	Very high	26 Å²	26	56.1 Å²	56.1	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-51.4	176.9	-176.5	-168	-56.6	0	0	111.4	Y631 F632 R637 S638 F639 M640 V646	Y631-M635 HydrophobicContact CD1-CE 3.85Å; Y631-M635 HydrophobicContact CE1-CE 3.06Å; Y631-M635 HydrophobicContact CE2-CE 4.36Å; Y631-M635 WeakPolarHBondContact O-CB 3.37Å; Y631-M635 PolarHBondContact O-N 2.86Å; Y631-M635 WeakPolarHBondContact OH-CE 3.3Å; F632-M635 HydrophobicContact CD1-CE 4.21Å; F632-M635 HydrophobicContact CE1-CE 4.4Å; F632-M635 PolarHBondContact O-N 2.96Å; M635-R637 PolarHBondContact O-N 3.39Å; M635-S638 PolarHBondContact O-N 3.42Å; M635-F639 CarbonylContact O-C 3.51Å; M635-F639 WeakPolarHBondContact O-CA 3.42Å; M635-F639 PolarHBondContact O-N 2.87Å; M635-M640 PolarHBondContact O-N 2.86Å; M635-V646 HydrophobicContact CE-CG1 3.92Å; M635-V646 HydrophobicContact SD-CB 4.43Å; M635-V646 HydrophobicContact SD-CG1 3.68Å; M635-V646 HydrophobicContact SD-CG2 3.78Å
636	F	91.9	Very high	90.4	Very high	17 Å²	17	56.5 Å²	56.5	8%	0.075	29%	0.294	C	S	.	.	H	α-helix	trans	-68.7	-22.5	-177.2	-58	-25.4	0	0	0	113.2	F374 I609 K622 L625 A626 F632 E633 M640 V646	F374-F636 HydrophobicContact CD1-CB 4.38Å; F374-F636 HydrophobicContact CE1-CB 3.54Å; F374-F636 HydrophobicContact CZ-CB 4.01Å; I609-F636 HydrophobicContact CD1-CD1 4.06Å; I609-F636 HydrophobicContact CD1-CE1 3.15Å; I609-F636 HydrophobicContact CD1-CZ 3.45Å; I609-F636 VanDerWaalsContact CD1-CZ 3.45Å; K622-F636 HydrophobicContact CB-CD2 3.93Å; K622-F636 HydrophobicContact CB-CE2 3.86Å; K622-F636 HydrophobicContact CG-CD2 4.17Å; K622-F636 HydrophobicContact CG-CE2 4.01Å; K622-F636 HydrophobicContact CG-CZ 4.26Å; L625-F636 HydrophobicContact CB-CE2 3.96Å; L625-F636 HydrophobicContact CB-CZ 4.28Å; L625-F636 HydrophobicContact CD1-CE2 4.43Å; L625-F636 HydrophobicContact CD1-CZ 4.06Å; A626-F636 HydrophobicContact CB-CD2 4.1Å; A626-F636 HydrophobicContact CB-CE2 4.41Å; F632-F636 HydrophobicContact CB-CD2 4.49Å; F632-F636 HydrophobicContact CB-CE2 3.84Å; F632-F636 HydrophobicContact CB-CZ 3.97Å; F632-F636 HydrophobicContact CD1-CE1 4.28Å; F632-F636 AromaticContact CD1-CZ 3.83Å; F632-F636 HydrophobicContact CD1-CZ 3.83Å; F632-F636 HydrophobicContact CG-CZ 4.22Å; F632-F636 WeakPolarHBondContact O-CD2 3.35Å; F632-F636 WeakPolarHBondContact O-CG 3.5Å; F632-F636 PolarHBondContact O-N 3.1Å; E633-F636 PolarHBondContact O-N 3.27Å; F636-M640 HydrophobicContact CB-SD 4.47Å; F636-M640 HydrophobicContact CD1-SD 3.72Å; F636-M640 HydrophobicContact CE1-SD 4.45Å; F636-M640 HydrophobicContact CG-SD 4.36Å; F636-V646 HydrophobicContact CE1-CG2 4.39Å
637	R	88.9	Confident	90.1	Very high	119 Å²	119	61.9 Å²	61.9	45%	0.449	32%	0.323	S	S	.	.	H	α-helix	trans	-78.8	-40.1	172.1	-76.4	-164.5	176.5	120.8	50.3	114	Q373 F374 E633 A634 M635	Q373-R637 VanDerWaalsContact NE2-NH1 3.11Å; F374-R637 HydrophobicContact CE1-CG 4.25Å; F374-R637 HydrophobicContact CZ-CG 3.93Å; E633-R637 VanDerWaalsContact CG-NH2 3.31Å; E633-R637 WeakPolarHBondContact O-CG 3.46Å; E633-R637 PolarHBondContact O-N 3.2Å; E633-R637 IonicContact OE1-CZ 3.14Å; E633-R637 IonicContact OE1-NH1 2.81Å; E633-R637 PolarHBondContact OE1-NH1 2.95Å; E633-R637 IonicContact OE1-NH2 2.71Å; E633-R637 PolarHBondContact OE1-NH2 2.98Å; A634-R637 PolarHBondContact O-N 3.33Å; M635-R637 PolarHBondContact O-N 3.39Å
638	S	87.8	Confident	89.9	Confident	75 Å²	75	61.4 Å²	61.4	52%	0.524	32%	0.318	S	S	.	.	H	α-helix	trans	-106.3	-36.6	-162.8	-46.2	0	0	0	0	112.6	A634 M635	A634-S638 VanDerWaalsContact O-CB 3.29Å; A634-S638 WeakPolarHBondContact O-CB 3.41Å; A634-S638 PolarHBondContact O-N 2.79Å; A634-S638 PolarHBondContact O-OG 2.87Å; M635-S638 PolarHBondContact O-N 3.42Å
639	F	82.8	Confident	89.5	Confident	167 Å²	167	62.9 Å²	62.9	73%	0.732	33%	0.328	S	S	*	.			trans	-144.9	57.3	-168.5	-57.6	-73	0	0	0	111.1	M635 P641	M635-F639 CarbonylContact O-C 3.51Å; M635-F639 WeakPolarHBondContact O-CA 3.42Å; M635-F639 PolarHBondContact O-N 2.87Å; F639-P641 WeakPolarHBondContact O-CD 3.21Å
640	M	83.9	Confident	88.8	Confident	64 Å²	64	63.3 Å²	63.3	32%	0.315	33%	0.331	S	S	.	.			trans	-69	123.2	175.7	-174.4	70.8	-153.7	0	0	110	I609 K622 M635 F636	I609-M640 HydrophobicContact CD1-CE 3.91Å; I609-M640 HydrophobicContact CG1-CE 4.24Å; K622-M640 HydrophobicContact CD-CE 4.32Å; K622-M640 HydrophobicContact CD-SD 4.36Å; K622-M640 VanDerWaalsContact CE-CE 3.47Å; M635-M640 PolarHBondContact O-N 2.86Å; F636-M640 HydrophobicContact CB-SD 4.47Å; F636-M640 HydrophobicContact CD1-SD 3.72Å; F636-M640 HydrophobicContact CE1-SD 4.45Å; F636-M640 HydrophobicContact CG-SD 4.36Å
641	P	82.1	Confident	88.2	Confident	39 Å²	39	62 Å²	62	25%	0.253	33%	0.327	S	S	.	.			trans	-61.1	136.6	175.7	-24.3	35.5	0	0	0	112	F639 D643 G644 Q645 V646	F639-P641 WeakPolarHBondContact O-CD 3.21Å; P641-D643 VanDerWaalsContact C-N 3.27Å; P641-D643 WeakPolarHBondContact CB-OD1 3.42Å; P641-D643 PolarHBondContact O-N 2.72Å; P641-G644 PolarHBondContact O-N 3.21Å; P641-G644 VanDerWaalsContact O-N 3.09Å; P641-Q645 WeakPolarHBondContact CB-O 3.49Å; P641-Q645 VanDerWaalsContact CG-O 3.28Å; P641-Q645 WeakPolarHBondContact CG-O 3.32Å; P641-V646 HydrophobicContact CG-CG2 4.05Å
642	E	82.3	Confident	87.4	Confident	205 Å²	205	67.9 Å²	67.9	96%	0.958	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-32.1	-177.8	-65.9	-171.8	169.6	0	0	112.8	G644	E642-G644 VanDerWaalsContact C-N 3.32Å
643	D	85.3	Confident	86.9	Confident	104 Å²	104	69.7 Å²	69.7	56%	0.556	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-4	177.7	66.5	-7.4	0	0	0	113.4	P641 Q645	P641-D643 VanDerWaalsContact C-N 3.27Å; P641-D643 WeakPolarHBondContact CB-OD1 3.42Å; P641-D643 PolarHBondContact O-N 2.72Å; D643-Q645 VanDerWaalsContact C-N 3.25Å; D643-Q645 HydrophobicContact CB-CG 4.47Å; D643-Q645 PolarHBondContact O-N 3.3Å; D643-Q645 PolarHBondContact OD1-N 3.34Å
644	G	86.1	Confident	86.5	Confident	18 Å²	18	70.8 Å²	70.8	19%	0.186	38%	0.376	C	S	.	.	S	Bend	trans	68.7	19.3	-177.3	0	0	0	0	0	114.5	I609 I610 P641 E642	I609-G644 WeakPolarHBondContact CG1-O 3.44Å; I610-G644 PolarHBondContact N-O 3.5Å; P641-G644 PolarHBondContact O-N 3.21Å; P641-G644 VanDerWaalsContact O-N 3.09Å; E642-G644 VanDerWaalsContact C-N 3.32Å
645	Q	91.1	Very high	86.3	Confident	70 Å²	70	68.5 Å²	68.5	33%	0.327	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.3	-179	-57.6	-176.4	56.4	0	0	111.5	I610 L612 P641 D643	I610-Q645 HydrophobicContact CB-CG 4.22Å; I610-Q645 CarbonylContact O-C 3.57Å; I610-Q645 WeakPolarHBondContact O-CA 3.46Å; L612-Q645 HydrophobicContact CD1-CB 3.86Å; L612-Q645 HydrophobicContact CG-CB 4.24Å; P641-Q645 WeakPolarHBondContact CB-O 3.49Å; P641-Q645 VanDerWaalsContact CG-O 3.28Å; P641-Q645 WeakPolarHBondContact CG-O 3.32Å; D643-Q645 VanDerWaalsContact C-N 3.25Å; D643-Q645 HydrophobicContact CB-CG 4.47Å; D643-Q645 PolarHBondContact O-N 3.3Å; D643-Q645 PolarHBondContact OD1-N 3.34Å
646	V	90.4	Very high	86.2	Confident	7 Å²	7	68.9 Å²	68.9	4%	0.042	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	118.7	-179.2	177.7	0	0	0	0	109.9	I609 I610 L611 L612 F632 M635 F636 P641 I648	I609-V646 HydrophobicContact CD1-CG2 3.58Å; I609-V646 HydrophobicContact CG1-CG2 4.22Å; I610-V646 PolarHBondContact O-N 2.64Å; L611-V646 CarbonylContact C-O 3.19Å; L611-V646 WeakPolarHBondContact CA-O 3.49Å; L611-V646 HydrophobicContact CD2-CB 4.07Å; L612-V646 PolarHBondContact N-O 3.18Å; F632-V646 HydrophobicContact CE1-CG1 4.24Å; M635-V646 HydrophobicContact CE-CG1 3.92Å; M635-V646 HydrophobicContact SD-CB 4.43Å; M635-V646 HydrophobicContact SD-CG1 3.68Å; M635-V646 HydrophobicContact SD-CG2 3.78Å; F636-V646 HydrophobicContact CE1-CG2 4.39Å; P641-V646 HydrophobicContact CG-CG2 4.05Å; V646-I648 HydrophobicContact CG1-CD1 4.4Å
647	N	89.8	Confident	86.2	Confident	119 Å²	119	75.5 Å²	75.5	64%	0.636	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	135	173.3	-68.2	-42.6	0	0	0	111	L612	L612-N647 WeakPolarHBondContact CB-OD1 3.45Å; L612-N647 VanDerWaalsContact CD1-OD1 3.29Å; L612-N647 WeakPolarHBondContact CD1-OD1 3.32Å
648	I	91.7	Very high	86.3	Confident	6 Å²	6	76 Å²	76	3%	0.031	40%	0.398	C	S	.	.			trans	-102.2	120.9	-178.4	-60.9	-56.5	0	0	0	110.5	L611 L612 L613 F632 V646 P655 F660 M663 Y689	L611-I648 HydrophobicContact CB-CD1 4.06Å; L611-I648 HydrophobicContact CB-CG1 3.84Å; L611-I648 HydrophobicContact CD1-CD1 4.27Å; L611-I648 HydrophobicContact CD2-CD1 4.07Å; L611-I648 HydrophobicContact CG-CD1 4.34Å; L612-I648 PolarHBondContact O-N 3.46Å; L613-I648 HydrophobicContact CD1-CB 4.32Å; L613-I648 HydrophobicContact CD1-CG2 4.14Å; F632-I648 HydrophobicContact CE1-CD1 4.35Å; F632-I648 HydrophobicContact CZ-CD1 4.05Å; V646-I648 HydrophobicContact CG1-CD1 4.4Å; I648-P655 HydrophobicContact CG2-CG 4.33Å; I648-F660 HydrophobicContact CB-CE2 4.18Å; I648-F660 HydrophobicContact CD1-CE2 4.26Å; I648-F660 HydrophobicContact CG1-CE2 3.72Å; I648-F660 HydrophobicContact CG1-CZ 3.98Å; I648-F660 HydrophobicContact CG2-CD2 3.68Å; I648-F660 HydrophobicContact CG2-CE2 3.65Å; I648-M663 HydrophobicContact CG2-CE 4.26Å; I648-Y689 WeakPolarHBondContact CG2-OH 3.43Å
649	S	87	Confident	86.6	Confident	34 Å²	34	72.4 Å²	72.4	24%	0.238	37%	0.373	C	S	.	.			trans	-143	163.1	169.2	69	0	0	0	0	110.4	G651 M653 Y688 Y689	S649-G651 PolarHBondContact OG-O 3Å; S649-G651 VanDerWaalsContact OG-O 3.13Å; S649-M653 CarbonylContact C-O 3.56Å; S649-M653 WeakPolarHBondContact CA-O 3.34Å; S649-M653 WeakPolarHBondContact CB-O 3.43Å; S649-Y688 WeakPolarHBondContact O-CE1 3.45Å; S649-Y688 PolarHBondContact OG-OH 3.41Å; S649-Y689 PolarHBondContact O-OH 3.34Å
650	I	81.6	Confident	87.1	Confident	10 Å²	10	64.6 Å²	64.6	5%	0.051	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-120.3	99.9	168.2	-62.8	169.3	0	0	0	106.2	E652 M653 P655 Y681 L682 A684 A685 Y688 Y689	I650-E652 PolarHBondContact O-N 3.27Å; I650-M653 HydrophobicContact CB-CE 3.93Å; I650-M653 HydrophobicContact CD1-CE 4.26Å; I650-M653 HydrophobicContact CG2-CE 4.35Å; I650-M653 PolarHBondContact N-O 3.45Å; I650-M653 PolarHBondContact O-N 3.45Å; I650-M653 VanDerWaalsContact O-N 3.14Å; I650-P655 HydrophobicContact CD1-CB 4.31Å; I650-P655 HydrophobicContact CD1-CG 4.33Å; I650-Y681 WeakPolarHBondContact CD1-O 3.39Å; I650-L682 HydrophobicContact CD1-CD2 4.11Å; I650-A684 HydrophobicContact CG2-CB 4.01Å; I650-A685 HydrophobicContact CD1-CB 4.06Å; I650-Y688 HydrophobicContact CG2-CG 4.42Å; I650-Y689 HydrophobicContact CD1-CE2 4.46Å; I650-Y689 HydrophobicContact CG1-CE2 3.71Å
651	G	81	Confident	87.6	Confident	35 Å²	35	64 Å²	64	36%	0.361	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	-127.4	-164.8	0	0	0	0	0	110.6	S649 M653 Y688	S649-G651 PolarHBondContact OG-O 3Å; S649-G651 VanDerWaalsContact OG-O 3.13Å; G651-M653 VanDerWaalsContact C-N 3.34Å; G651-Y688 VanDerWaalsContact CA-CE2 3.47Å
652	E	78.9	Confident	88.3	Confident	206 Å²	206	62.4 Å²	62.4	96%	0.963	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.7	177.7	-59.1	-172.3	166.2	0	0	113.6	I650	I650-E652 PolarHBondContact O-N 3.27Å
653	M	84.5	Confident	88.9	Confident	39 Å²	39	52.7 Å²	52.7	19%	0.192	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-101.1	138	-174.3	173.9	-83.4	-73.3	0	0	111.4	S649 I650 G651 P655 Y681 T723	S649-M653 CarbonylContact C-O 3.56Å; S649-M653 WeakPolarHBondContact CA-O 3.34Å; S649-M653 WeakPolarHBondContact CB-O 3.43Å; I650-M653 HydrophobicContact CB-CE 3.93Å; I650-M653 HydrophobicContact CD1-CE 4.26Å; I650-M653 HydrophobicContact CG2-CE 4.35Å; I650-M653 PolarHBondContact N-O 3.45Å; I650-M653 PolarHBondContact O-N 3.45Å; I650-M653 VanDerWaalsContact O-N 3.14Å; G651-M653 VanDerWaalsContact C-N 3.34Å; M653-P655 VanDerWaalsContact SD-CA 3.58Å; M653-P655 HydrophobicContact SD-CB 4.19Å; M653-P655 VanDerWaalsContact SD-N 3.36Å; M653-Y681 HydrophobicContact CE-CD1 3.74Å; M653-Y681 HydrophobicContact CE-CG 4.48Å; M653-Y681 HydrophobicContact SD-CD1 3.56Å; M653-Y681 VanDerWaalsContact SD-CD1 3.56Å; M653-Y681 HydrophobicContact SD-CE1 4.14Å; M653-T723 HydrophobicContact CE-CG2 4.19Å
654	V	85.1	Confident	89.4	Confident	74 Å²	74	47.8 Å²	47.8	45%	0.448	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-95.2	119.1	170.1	-178.4	0	0	0	0	108.6	L613 D614	L613-V654 HydrophobicContact CD1-CG1 3.81Å; L613-V654 HydrophobicContact CG-CG1 4.42Å; D614-V654 HydrophobicContact CB-CG1 4.33Å
655	P	88.9	Confident	90	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.032	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-68.2	158.1	-177.6	26.5	-32.8	0	0	0	111.5	L613 I648 I650 M653 A659 F660	L613-P655 HydrophobicContact CD1-CG 3.88Å; I648-P655 HydrophobicContact CG2-CG 4.33Å; I650-P655 HydrophobicContact CD1-CB 4.31Å; I650-P655 HydrophobicContact CD1-CG 4.33Å; M653-P655 VanDerWaalsContact SD-CA 3.58Å; M653-P655 HydrophobicContact SD-CB 4.19Å; M653-P655 VanDerWaalsContact SD-N 3.36Å; P655-A659 HydrophobicContact CB-CB 4.15Å; P655-F660 HydrophobicContact CG-CB 4.46Å
656	S	89.3	Confident	90.2	Very high	34 Å²	34	46 Å²	46	24%	0.238	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-60.8	156.5	170.6	82.9	0	0	0	0	110.6	Q658 A659 F660	S656-Q658 PolarHBondContact O-N 2.91Å; S656-Q658 PolarHBondContact OG-N 2.88Å; S656-A659 PolarHBondContact O-N 3.31Å; S656-A659 WeakPolarHBondContact OG-CB 3.47Å; S656-A659 PolarHBondContact OG-N 2.85Å; S656-F660 WeakPolarHBondContact O-CB 3.47Å; S656-F660 PolarHBondContact O-N 2.84Å
657	K	91.4	Very high	90.5	Very high	156 Å²	156	45.7 Å²	45.7	68%	0.678	24%	0.236	S	C	*	.	H	α-helix	trans	-55.2	-38.5	174.8	-176.6	179.4	177.5	-179.8	0	112.4	L613 E661	L613-K657 HydrophobicContact CD2-CB 4.17Å; K657-E661 WeakPolarHBondContact O-CG 3.47Å; K657-E661 PolarHBondContact O-N 3.41Å
658	Q	92.2	Very high	90.9	Very high	128 Å²	128	40.1 Å²	40.1	60%	0.598	21%	0.206	S	C	*	.	H	α-helix	trans	-68.6	-46.6	178.8	-71.8	170.4	-29.2	0	0	111.2	S656 F660 E661 S662 D678	S656-Q658 PolarHBondContact O-N 2.91Å; S656-Q658 PolarHBondContact OG-N 2.88Å; Q658-F660 VanDerWaalsContact C-N 3.3Å; Q658-F660 PolarHBondContact O-N 2.83Å; Q658-E661 PolarHBondContact O-N 3.43Å; Q658-S662 WeakPolarHBondContact O-CB 3.38Å; Q658-S662 PolarHBondContact O-N 2.88Å; Q658-S662 PolarHBondContact O-OG 3.02Å; Q658-S662 VanDerWaalsContact O-OG 3.06Å; Q658-D678 VanDerWaalsContact C-OD2 3.28Å
659	A	92.5	Very high	91.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.8	-39.4	175.4	0	0	0	0	0	111.8	P655 S656 S662 M663 D678 Y681 L682	P655-A659 HydrophobicContact CB-CB 4.15Å; S656-A659 PolarHBondContact O-N 3.31Å; S656-A659 WeakPolarHBondContact OG-CB 3.47Å; S656-A659 PolarHBondContact OG-N 2.85Å; A659-S662 WeakPolarHBondContact O-CB 3.38Å; A659-S662 PolarHBondContact O-N 2.77Å; A659-M663 PolarHBondContact O-N 2.87Å; A659-D678 HydrophobicContact CB-CB 4.18Å; A659-D678 PolarHBondContact N-OD1 3.33Å; A659-D678 PolarHBondContact N-OD2 3.49Å; A659-Y681 HydrophobicContact CB-CD2 4.04Å; A659-Y681 HydrophobicContact CB-CG 4.05Å; A659-L682 HydrophobicContact CB-CD2 4.45Å; A659-L682 HydrophobicContact CB-CG 4.38Å
660	F	94.5	Very high	91.4	Very high	3 Å²	3	39.5 Å²	39.5	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-45.7	175.1	178.2	-121.3	0	0	0	112.5	L611 L613 R618 I648 P655 S656 Q658 S662 M663 L664	L611-F660 HydrophobicContact CB-CZ 3.86Å; L611-F660 HydrophobicContact CD1-CE2 4.26Å; L611-F660 HydrophobicContact CD1-CZ 3.82Å; L613-F660 HydrophobicContact CB-CD1 4.2Å; L613-F660 HydrophobicContact CB-CE1 4.39Å; L613-F660 HydrophobicContact CD1-CB 4.14Å; L613-F660 HydrophobicContact CD1-CG 4.15Å; L613-F660 HydrophobicContact CD2-CB 3.75Å; L613-F660 HydrophobicContact CD2-CD1 3.89Å; L613-F660 HydrophobicContact CD2-CG 4.01Å; L613-F660 HydrophobicContact CG-CD1 4.45Å; L613-F660 HydrophobicContact CG-CG 4.5Å; R618-F660 HydrophobicContact CB-CE1 3.92Å; R618-F660 HydrophobicContact CB-CZ 4.47Å; R618-F660 HydrophobicContact CG-CE1 3.95Å; R618-F660 HydrophobicContact CG-CZ 4.5Å; I648-F660 HydrophobicContact CB-CE2 4.18Å; I648-F660 HydrophobicContact CD1-CE2 4.26Å; I648-F660 HydrophobicContact CG1-CE2 3.72Å; I648-F660 HydrophobicContact CG1-CZ 3.98Å; I648-F660 HydrophobicContact CG2-CD2 3.68Å; I648-F660 HydrophobicContact CG2-CE2 3.65Å; P655-F660 HydrophobicContact CG-CB 4.46Å; S656-F660 WeakPolarHBondContact O-CB 3.47Å; S656-F660 PolarHBondContact O-N 2.84Å; Q658-F660 VanDerWaalsContact C-N 3.3Å; Q658-F660 PolarHBondContact O-N 2.83Å; F660-S662 VanDerWaalsContact C-N 3.31Å; F660-S662 PolarHBondContact O-N 2.89Å; F660-M663 HydrophobicContact CD2-CE 3.71Å; F660-M663 HydrophobicContact CE2-CE 3.77Å; F660-M663 WeakPolarHBondContact O-CB 3.46Å; F660-M663 PolarHBondContact O-N 2.86Å; F660-L664 HydrophobicContact CD1-CD1 4.39Å; F660-L664 HydrophobicContact CE1-CD1 3.83Å; F660-L664 HydrophobicContact CE1-CG 4.49Å; F660-L664 HydrophobicContact CE2-CD1 4.34Å; F660-L664 HydrophobicContact CE2-CD2 4.28Å; F660-L664 HydrophobicContact CE2-CG 4.17Å; F660-L664 HydrophobicContact CZ-CD1 3.8Å; F660-L664 HydrophobicContact CZ-CD2 4.3Å; F660-L664 HydrophobicContact CZ-CG 4.13Å; F660-L664 PolarHBondContact O-N 2.88Å
661	E	94.6	Very high	92	Very high	53 Å²	53	40.3 Å²	40.3	25%	0.248	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-38.7	173.7	-69.3	-68.5	164.8	0	0	111.1	R618 K657 Q658 M663 L664 R665	R618-E661 IonicContact CZ-OE1 3.53Å; R618-E661 IonicContact NE-OE1 3.93Å; R618-E661 PolarHBondContact NE-OE1 2.7Å; R618-E661 IonicContact NE-OE2 2.72Å; R618-E661 IonicContact NH2-OE2 3.86Å; K657-E661 WeakPolarHBondContact O-CG 3.47Å; K657-E661 PolarHBondContact O-N 3.41Å; Q658-E661 PolarHBondContact O-N 3.43Å; E661-M663 VanDerWaalsContact C-N 3.32Å; E661-M663 PolarHBondContact O-N 2.88Å; E661-L664 PolarHBondContact O-N 3.41Å; E661-R665 VanDerWaalsContact O-CG 3.29Å; E661-R665 WeakPolarHBondContact O-CG 3.45Å; E661-R665 PolarHBondContact O-N 3.32Å
662	S	96	Very high	92.5	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.028	19%	0.193	C	C	.	.	H	α-helix	trans	-58.4	-40.4	172.2	-64.9	0	0	0	0	112.6	Q658 A659 F660 R665 Y666 D678	Q658-S662 WeakPolarHBondContact O-CB 3.38Å; Q658-S662 PolarHBondContact O-N 2.88Å; Q658-S662 PolarHBondContact O-OG 3.02Å; Q658-S662 VanDerWaalsContact O-OG 3.06Å; A659-S662 WeakPolarHBondContact O-CB 3.38Å; A659-S662 PolarHBondContact O-N 2.77Å; F660-S662 VanDerWaalsContact C-N 3.31Å; F660-S662 PolarHBondContact O-N 2.89Å; S662-R665 PolarHBondContact O-N 2.93Å; S662-R665 PolarHBondContact OG-NH2 2.82Å; S662-Y666 PolarHBondContact O-N 3.04Å; S662-Y666 VanDerWaalsContact O-N 3.15Å; S662-D678 PolarHBondContact OG-OD2 2.79Å
663	M	95.6	Very high	93	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-64.6	-44	173.3	-170	176.4	75.1	0	0	112.1	I648 A659 F660 E661 R665 Y666 I667 L682 Y689 F691	I648-M663 HydrophobicContact CG2-CE 4.26Å; A659-M663 PolarHBondContact O-N 2.87Å; F660-M663 HydrophobicContact CD2-CE 3.71Å; F660-M663 HydrophobicContact CE2-CE 3.77Å; F660-M663 WeakPolarHBondContact O-CB 3.46Å; F660-M663 PolarHBondContact O-N 2.86Å; E661-M663 VanDerWaalsContact C-N 3.32Å; E661-M663 PolarHBondContact O-N 2.88Å; M663-R665 PolarHBondContact O-N 2.95Å; M663-Y666 WeakPolarHBondContact O-CB 3.34Å; M663-Y666 PolarHBondContact O-N 2.98Å; M663-I667 HydrophobicContact CG-CD1 4.13Å; M663-I667 WeakPolarHBondContact O-CG1 3.47Å; M663-I667 PolarHBondContact O-N 2.81Å; M663-L682 HydrophobicContact CB-CD1 4.42Å; M663-L682 HydrophobicContact CB-CD2 3.79Å; M663-L682 HydrophobicContact CG-CD2 4.28Å; M663-L682 HydrophobicContact SD-CD2 4.4Å; M663-Y689 HydrophobicContact CE-CE2 3.92Å; M663-Y689 HydrophobicContact SD-CD2 3.74Å; M663-Y689 HydrophobicContact SD-CE2 3.41Å; M663-Y689 WeakPolarHBondContact SD-CE2 3.31Å; M663-F691 HydrophobicContact CG-CZ 4.28Å
664	L	96.1	Very high	93.2	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-64.4	-39.2	177.7	-69.1	-179.1	0	0	0	112.1	L599 L611 R618 F660 E661 Y666 I667 Y668	L599-L664 HydrophobicContact CD1-CB 4.27Å; L599-L664 HydrophobicContact CD2-CB 4.14Å; L611-L664 HydrophobicContact CD1-CD2 3.9Å; R618-L664 HydrophobicContact CG-CD1 3.97Å; F660-L664 HydrophobicContact CD1-CD1 4.39Å; F660-L664 HydrophobicContact CE1-CD1 3.83Å; F660-L664 HydrophobicContact CE1-CG 4.49Å; F660-L664 HydrophobicContact CE2-CD1 4.34Å; F660-L664 HydrophobicContact CE2-CD2 4.28Å; F660-L664 HydrophobicContact CE2-CG 4.17Å; F660-L664 HydrophobicContact CZ-CD1 3.8Å; F660-L664 HydrophobicContact CZ-CD2 4.3Å; F660-L664 HydrophobicContact CZ-CG 4.13Å; F660-L664 PolarHBondContact O-N 2.88Å; E661-L664 PolarHBondContact O-N 3.41Å; L664-Y666 VanDerWaalsContact C-N 3.32Å; L664-Y666 PolarHBondContact O-N 3.09Å; L664-I667 PolarHBondContact O-N 2.96Å; L664-Y668 WeakPolarHBondContact O-CB 3.29Å; L664-Y668 WeakPolarHBondContact O-CD2 3.35Å; L664-Y668 PolarHBondContact O-N 3.47Å
665	R	97.1	Very high	93.5	Very high	50 Å²	50	33.2 Å²	33.2	19%	0.189	17%	0.167	C	C	.	.	H	α-helix	trans	-58.8	-43.4	173.4	-69.5	-177	-60.6	115.1	-6.9	111.5	L599 E661 S662 M663 Y669 G670 D671 N673	L599-R665 HydrophobicContact CD2-CG 4.05Å; E661-R665 VanDerWaalsContact O-CG 3.29Å; E661-R665 WeakPolarHBondContact O-CG 3.45Å; E661-R665 PolarHBondContact O-N 3.32Å; S662-R665 PolarHBondContact O-N 2.93Å; S662-R665 PolarHBondContact OG-NH2 2.82Å; M663-R665 PolarHBondContact O-N 2.95Å; R665-Y669 HydrophobicContact CB-CE1 3.74Å; R665-Y669 WeakPolarHBondContact CB-OH 3.26Å; R665-Y669 WeakPolarHBondContact CD-OH 3.46Å; R665-Y669 HydrophobicContact CG-CE1 3.81Å; R665-Y669 WeakPolarHBondContact CG-OH 3.35Å; R665-Y669 WeakPolarHBondContact O-CD1 3.45Å; R665-Y669 PolarHBondContact O-N 3.25Å; R665-G670 PolarHBondContact O-N 3.4Å; R665-D671 HydrophobicContact CB-CB 4.2Å; R665-D671 IonicContact CZ-OD2 3.16Å; R665-D671 IonicContact NH1-OD2 3.89Å; R665-D671 PolarHBondContact NH1-OD2 2.9Å; R665-N673 PolarHBondContact NH1-O 3.31Å; R665-N673 PolarHBondContact NH2-O 3.36Å
666	Y	96.6	Very high	93.4	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-44.2	174.8	178.8	-98.8	0	0	0	112.9	R628 S662 M663 L664 G670 D671 V672 F691 R695 L696	R628-Y666 PolarHBondContact NH2-O 2.9Å; S662-Y666 PolarHBondContact O-N 3.04Å; S662-Y666 VanDerWaalsContact O-N 3.15Å; M663-Y666 WeakPolarHBondContact O-CB 3.34Å; M663-Y666 PolarHBondContact O-N 2.98Å; L664-Y666 VanDerWaalsContact C-N 3.32Å; L664-Y666 PolarHBondContact O-N 3.09Å; Y666-G670 WeakPolarHBondContact O-CA 3.49Å; Y666-G670 PolarHBondContact O-N 2.8Å; Y666-D671 WeakPolarHBondContact CA-O 3.42Å; Y666-D671 WeakPolarHBondContact CB-O 3.47Å; Y666-V672 HydrophobicContact CD2-CG1 3.9Å; Y666-V672 HydrophobicContact CE2-CG1 4.03Å; Y666-F691 HydrophobicContact CD1-CD2 4.08Å; Y666-F691 AromaticContact CD1-CE2 3.88Å; Y666-F691 HydrophobicContact CD1-CE2 3.88Å; Y666-F691 HydrophobicContact CD1-CZ 4.32Å; Y666-F691 AromaticContact CE1-CD2 3.56Å; Y666-F691 HydrophobicContact CE1-CD2 3.56Å; Y666-F691 AromaticContact CE1-CE2 3.86Å; Y666-F691 HydrophobicContact CE1-CE2 3.86Å; Y666-F691 HydrophobicContact CE1-CG 4.05Å; Y666-R695 HydrophobicContact CE2-CG 4.46Å; Y666-L696 HydrophobicContact CD1-CB 4.28Å; Y666-L696 HydrophobicContact CD1-CD2 4.06Å; Y666-L696 HydrophobicContact CD2-CB 4.08Å; Y666-L696 HydrophobicContact CD2-CD1 4.02Å; Y666-L696 HydrophobicContact CD2-CG 4.5Å; Y666-L696 HydrophobicContact CE1-CB 4.02Å; Y666-L696 HydrophobicContact CE1-CD2 4.45Å; Y666-L696 HydrophobicContact CE2-CB 3.8Å; Y666-L696 HydrophobicContact CG-CB 4.3Å; Y666-L696 HydrophobicContact CG-CD1 4.11Å; Y666-L696 HydrophobicContact CG-CD2 4.2Å; Y666-L696 HydrophobicContact CG-CG 4.45Å
667	I	96.8	Very high	93.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.9	-55	178.5	-72.6	172.3	0	0	0	109.8	I624 L625 R628 F632 M663 L664 F691	I624-I667 HydrophobicContact CG2-CG2 4.08Å; L625-I667 HydrophobicContact CD2-CD1 4.11Å; L625-I667 HydrophobicContact CD2-CG2 4.08Å; R628-I667 HydrophobicContact CB-CG2 3.91Å; R628-I667 HydrophobicContact CG-CG2 4.26Å; R628-I667 VanDerWaalsContact CG-O 3.29Å; R628-I667 WeakPolarHBondContact CG-O 3.42Å; R628-I667 PolarHBondContact NE-O 3.42Å; F632-I667 HydrophobicContact CE2-CD1 4.37Å; M663-I667 HydrophobicContact CG-CD1 4.13Å; M663-I667 WeakPolarHBondContact O-CG1 3.47Å; M663-I667 PolarHBondContact O-N 2.81Å; L664-I667 PolarHBondContact O-N 2.96Å; I667-F691 HydrophobicContact CD1-CE1 4.21Å; I667-F691 HydrophobicContact CD1-CZ 4.25Å; I667-F691 HydrophobicContact CG1-CE1 4.06Å; I667-F691 HydrophobicContact CG1-CZ 4.11Å
668	Y	97.3	Very high	93.3	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-70.9	-41.7	-170.7	-86.8	-119.6	0	0	0	113.4	Y365 M595 L599 A620 H621 I624 L664	Y365-Y668 PolarHBondContact OH-O 2.88Å; M595-Y668 VanDerWaalsContact CB-O 3.3Å; M595-Y668 WeakPolarHBondContact CB-O 3.38Å; L599-Y668 HydrophobicContact CB-CD1 3.7Å; L599-Y668 HydrophobicContact CB-CE1 4.18Å; L599-Y668 HydrophobicContact CB-CG 4.09Å; L599-Y668 HydrophobicContact CD1-CD1 4.01Å; L599-Y668 HydrophobicContact CD1-CD2 4.05Å; L599-Y668 HydrophobicContact CD1-CE1 3.91Å; L599-Y668 HydrophobicContact CD1-CE2 4.01Å; L599-Y668 HydrophobicContact CD1-CG 4.06Å; L599-Y668 HydrophobicContact CD2-CG 4.27Å; L599-Y668 HydrophobicContact CG-CD1 4.33Å; L599-Y668 HydrophobicContact CG-CG 4.36Å; A620-Y668 WeakPolarHBondContact CA-OH 3.42Å; H621-Y668 PolarHBondContact N-OH 3.06Å; H621-Y668 VanDerWaalsContact N-OH 3.14Å; H621-Y668 AromaticContact ND1-CE1 3.48Å; H621-Y668 WeakPolarHBondContact ND1-CE1 3.25Å; H621-Y668 AromaticContact ND1-CZ 3.56Å; H621-Y668 PolarHBondContact ND1-OH 3.12Å; I624-Y668 HydrophobicContact CD1-CD1 3.85Å; I624-Y668 HydrophobicContact CD1-CE1 3.54Å; I624-Y668 HydrophobicContact CG2-CD1 4.18Å; I624-Y668 HydrophobicContact CG2-CD2 3.72Å; I624-Y668 HydrophobicContact CG2-CE1 4.33Å; I624-Y668 HydrophobicContact CG2-CE2 3.83Å; I624-Y668 HydrophobicContact CG2-CG 3.91Å; L664-Y668 WeakPolarHBondContact O-CB 3.29Å; L664-Y668 WeakPolarHBondContact O-CD2 3.35Å; L664-Y668 PolarHBondContact O-N 3.47Å
669	Y	95.6	Very high	93.2	Very high	18 Å²	18	20.2 Å²	20.2	7%	0.071	11%	0.106	C	C	.	.	H	α-helix	trans	-142.3	14.5	-172.1	67.1	-90.7	0	0	0	114.7	V592 K596 L599 R665 D671	V592-Y669 HydrophobicContact CG1-CD2 3.96Å; K596-Y669 HydrophobicContact CB-CD1 3.86Å; K596-Y669 HydrophobicContact CB-CD2 4.12Å; K596-Y669 HydrophobicContact CB-CE1 4.02Å; K596-Y669 HydrophobicContact CB-CE2 4.24Å; K596-Y669 HydrophobicContact CB-CG 3.93Å; K596-Y669 HydrophobicContact CD-CE2 4.19Å; K596-Y669 HydrophobicContact CG-CD1 4.35Å; K596-Y669 HydrophobicContact CG-CE1 3.99Å; K596-Y669 HydrophobicContact CG-CE2 4.23Å; L599-Y669 HydrophobicContact CD2-CE1 4.06Å; R665-Y669 HydrophobicContact CB-CE1 3.74Å; R665-Y669 WeakPolarHBondContact CB-OH 3.26Å; R665-Y669 WeakPolarHBondContact CD-OH 3.46Å; R665-Y669 HydrophobicContact CG-CE1 3.81Å; R665-Y669 WeakPolarHBondContact CG-OH 3.35Å; R665-Y669 WeakPolarHBondContact O-CD1 3.45Å; R665-Y669 PolarHBondContact O-N 3.25Å; Y669-D671 VanDerWaalsContact C-N 3.34Å; Y669-D671 HydrophobicContact CD2-CB 3.8Å; Y669-D671 HydrophobicContact CE2-CB 3.27Å; Y669-D671 PolarHBondContact O-N 3.17Å; Y669-D671 PolarHBondContact OH-OD2 2.75Å; Y669-D671 VanDerWaalsContact OH-OD2 3.11Å
670	G	93.6	Very high	92.9	Very high	8 Å²	8	20.5 Å²	20.5	8%	0.082	11%	0.107	C	C	.	.			trans	75.9	16.2	167.3	0	0	0	0	0	115.7	R665 Y666	R665-G670 PolarHBondContact O-N 3.4Å; Y666-G670 WeakPolarHBondContact O-CA 3.49Å; Y666-G670 PolarHBondContact O-N 2.8Å
671	D	94	Very high	92.5	Very high	27 Å²	27	21.4 Å²	21.4	14%	0.144	11%	0.11	C	C	.	.			trans	-72.4	136.1	-179.3	-171.9	16.6	0	0	0	112.1	R665 Y666 Y669 N673	R665-D671 HydrophobicContact CB-CB 4.2Å; R665-D671 IonicContact CZ-OD2 3.16Å; R665-D671 IonicContact NH1-OD2 3.89Å; R665-D671 PolarHBondContact NH1-OD2 2.9Å; Y666-D671 WeakPolarHBondContact CA-O 3.42Å; Y666-D671 WeakPolarHBondContact CB-O 3.47Å; Y669-D671 VanDerWaalsContact C-N 3.34Å; Y669-D671 HydrophobicContact CD2-CB 3.8Å; Y669-D671 HydrophobicContact CE2-CB 3.27Å; Y669-D671 PolarHBondContact O-N 3.17Å; Y669-D671 PolarHBondContact OH-OD2 2.75Å; Y669-D671 VanDerWaalsContact OH-OD2 3.11Å; D671-N673 WeakPolarHBondContact OD1-CB 3.45Å; D671-N673 PolarHBondContact OD1-N 3.26Å; D671-N673 PolarHBondContact OD1-ND2 3.38Å
672	V	91.2	Very high	92.3	Very high	17 Å²	17	18.9 Å²	18.9	10%	0.103	10%	0.099	C	C	.	.			trans	-121.2	0.2	-177.4	-65.3	0	0	0	0	111.6	Y666 M674 R695 Y699	Y666-V672 HydrophobicContact CD2-CG1 3.9Å; Y666-V672 HydrophobicContact CE2-CG1 4.03Å; V672-M674 VanDerWaalsContact C-CE 3.5Å; V672-M674 HydrophobicContact CB-CE 4.48Å; V672-M674 WeakPolarHBondContact O-CE 3.38Å; V672-M674 PolarHBondContact O-N 2.98Å; V672-R695 HydrophobicContact CG1-CG 4.47Å; V672-Y699 HydrophobicContact CB-CD1 4.08Å; V672-Y699 HydrophobicContact CB-CD2 4.01Å; V672-Y699 HydrophobicContact CB-CG 3.7Å; V672-Y699 HydrophobicContact CG1-CD2 3.85Å; V672-Y699 HydrophobicContact CG1-CE2 4.42Å; V672-Y699 HydrophobicContact CG1-CG 4.05Å; V672-Y699 HydrophobicContact CG2-CD1 3.59Å; V672-Y699 HydrophobicContact CG2-CD2 3.94Å; V672-Y699 HydrophobicContact CG2-CE1 3.75Å; V672-Y699 HydrophobicContact CG2-CE2 4.11Å; V672-Y699 HydrophobicContact CG2-CG 3.68Å
673	N	89.6	Confident	91.9	Very high	121 Å²	121	19.6 Å²	19.6	65%	0.647	10%	0.101	S	C	*	.			trans	-75.7	118.1	175.3	-59.9	-60.2	0	0	0	108.8	R665 D671	R665-N673 PolarHBondContact NH1-O 3.31Å; R665-N673 PolarHBondContact NH2-O 3.36Å; D671-N673 WeakPolarHBondContact OD1-CB 3.45Å; D671-N673 PolarHBondContact OD1-N 3.26Å; D671-N673 PolarHBondContact OD1-ND2 3.38Å
674	M	90.4	Very high	91.4	Very high	20 Å²	20	21 Å²	21	10%	0.099	11%	0.113	C	C	.	.			trans	-153.1	160.2	178.5	61.8	-159.7	77.3	0	0	110.2	V672 D678 S679 L682 L696 N703	V672-M674 VanDerWaalsContact C-CE 3.5Å; V672-M674 HydrophobicContact CB-CE 4.48Å; V672-M674 WeakPolarHBondContact O-CE 3.38Å; V672-M674 PolarHBondContact O-N 2.98Å; M674-D678 HydrophobicContact CB-CB 4.17Å; M674-D678 HydrophobicContact CG-CB 4.38Å; M674-S679 WeakPolarHBondContact CG-OG 3.42Å; M674-L682 HydrophobicContact CE-CD1 4.5Å; M674-L682 HydrophobicContact SD-CD1 3.8Å; M674-L696 HydrophobicContact CE-CD1 3.48Å; M674-L696 VanDerWaalsContact CE-CD1 3.48Å; M674-L696 HydrophobicContact SD-CD1 4.35Å; M674-N703 PolarHBondContact O-ND2 3.29Å
675	P	90.1	Very high	91.1	Very high	48 Å²	48	20.9 Å²	20.9	31%	0.312	11%	0.112	S	C	.	.			trans	-61.3	153.7	168.5	-21.7	33.9	0	0	0	111.9	E677 D678 S679 N703	P675-E677 VanDerWaalsContact C-N 3.29Å; P675-E677 HydrophobicContact CB-CG 4.02Å; P675-E677 WeakPolarHBondContact CB-OE1 3.38Å; P675-E677 WeakPolarHBondContact CB-OE2 3.28Å; P675-E677 PolarHBondContact O-N 3.42Å; P675-D678 PolarHBondContact O-N 3Å; P675-S679 PolarHBondContact O-N 2.71Å; P675-S679 PolarHBondContact O-OG 3.24Å; P675-N703 PolarHBondContact O-ND2 3.14Å
676	P	87.7	Confident	90.7	Very high	13 Å²	13	18.9 Å²	18.9	8%	0.084	11%	0.106	C	C	.	.	H	α-helix	trans	-58.8	-37.5	177.2	-27	37.4	0	0	0	113.4	D678 S679 L704 N707 I716	P676-D678 VanDerWaalsContact C-N 3.33Å; P676-D678 PolarHBondContact O-N 3.34Å; P676-S679 WeakPolarHBondContact O-CB 3.27Å; P676-S679 PolarHBondContact O-N 3.24Å; P676-L704 HydrophobicContact CB-CD2 4.32Å; P676-L704 VanDerWaalsContact O-CD2 3.26Å; P676-L704 WeakPolarHBondContact O-CD2 3.45Å; P676-N707 HydrophobicContact CG-CB 3.68Å; P676-I716 HydrophobicContact CB-CD1 3.67Å; P676-I716 HydrophobicContact CB-CG1 4.35Å
677	E	86.7	Confident	90.2	Very high	35 Å²	35	26.5 Å²	26.5	16%	0.164	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-40.6	177.4	56.5	-85.7	-162.8	0	0	112.7	P675 S679 L680 Y681	P675-E677 VanDerWaalsContact C-N 3.29Å; P675-E677 HydrophobicContact CB-CG 4.02Å; P675-E677 WeakPolarHBondContact CB-OE1 3.38Å; P675-E677 WeakPolarHBondContact CB-OE2 3.28Å; P675-E677 PolarHBondContact O-N 3.42Å; E677-S679 PolarHBondContact O-N 2.72Å; E677-L680 PolarHBondContact O-N 3.06Å; E677-Y681 VanDerWaalsContact O-CD2 3.23Å; E677-Y681 WeakPolarHBondContact O-CD2 3.47Å
678	D	90.8	Very high	89.8	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.011	15%	0.15	C	C	.	.	H	α-helix	trans	-64.6	-32	174.6	-77.8	1.3	0	0	0	111.6	Q658 A659 S662 M674 P675 P676 L680 Y681 L682	Q658-D678 VanDerWaalsContact C-OD2 3.28Å; A659-D678 HydrophobicContact CB-CB 4.18Å; A659-D678 PolarHBondContact N-OD1 3.33Å; A659-D678 PolarHBondContact N-OD2 3.49Å; S662-D678 PolarHBondContact OG-OD2 2.79Å; M674-D678 HydrophobicContact CB-CB 4.17Å; M674-D678 HydrophobicContact CG-CB 4.38Å; P675-D678 PolarHBondContact O-N 3Å; P676-D678 VanDerWaalsContact C-N 3.33Å; P676-D678 PolarHBondContact O-N 3.34Å; D678-L680 VanDerWaalsContact C-N 3.26Å; D678-L680 PolarHBondContact O-N 3.33Å; D678-Y681 PolarHBondContact O-N 3.47Å; D678-L682 WeakPolarHBondContact O-CG 3.4Å; D678-L682 PolarHBondContact O-N 2.96Å
679	S	90.9	Very high	89.5	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.6	-29.9	-177.1	-58	0	0	0	0	112.5	M674 P675 P676 E677 F683 C700 N703	M674-S679 WeakPolarHBondContact CG-OG 3.42Å; P675-S679 PolarHBondContact O-N 2.71Å; P675-S679 PolarHBondContact O-OG 3.24Å; P676-S679 WeakPolarHBondContact O-CB 3.27Å; P676-S679 PolarHBondContact O-N 3.24Å; E677-S679 PolarHBondContact O-N 2.72Å; S679-F683 WeakPolarHBondContact O-CB 3.16Å; S679-F683 PolarHBondContact O-N 2.89Å; S679-C700 WeakPolarHBondContact O-CB 3.33Å; S679-N703 PolarHBondContact OG-ND2 3.01Å
680	L	86.2	Confident	89.3	Confident	5 Å²	5	30.5 Å²	30.5	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-66.8	-45.1	174	-83	165	0	0	0	112	L27 E677 D678 L682 L704 I716 A719 A720 A725 M728	L27-L680 HydrophobicContact CD1-CD2 4.29Å; E677-L680 PolarHBondContact O-N 3.06Å; D678-L680 VanDerWaalsContact C-N 3.26Å; D678-L680 PolarHBondContact O-N 3.33Å; L680-L682 VanDerWaalsContact C-N 3.31Å; L680-L682 PolarHBondContact O-N 2.95Å; L680-L704 HydrophobicContact CD1-CD2 4.3Å; L680-L704 HydrophobicContact CD2-CD1 3.98Å; L680-L704 HydrophobicContact CD2-CD2 4.42Å; L680-L704 HydrophobicContact CG-CD1 4.05Å; L680-L704 HydrophobicContact CG-CD2 3.8Å; L680-I716 HydrophobicContact CD1-CG2 3.64Å; L680-A719 HydrophobicContact CB-CB 4.34Å; L680-A719 HydrophobicContact CD1-CB 3.74Å; L680-A720 HydrophobicContact CD1-CB 3.99Å; L680-A725 HydrophobicContact CD2-CB 3.89Å; L680-M728 HydrophobicContact CD1-CG 4.19Å; L680-M728 HydrophobicContact CD2-CB 4.17Å; L680-M728 HydrophobicContact CD2-CG 4.03Å
681	Y	86.1	Confident	89.4	Confident	22 Å²	22	30.9 Å²	30.9	9%	0.086	16%	0.157	C	C	.	.	H	α-helix	trans	-63.6	-40.3	177.6	-67.7	-77.2	0	0	0	111.4	I650 M653 A659 E677 D678 A719 T723	I650-Y681 WeakPolarHBondContact CD1-O 3.39Å; M653-Y681 HydrophobicContact CE-CD1 3.74Å; M653-Y681 HydrophobicContact CE-CG 4.48Å; M653-Y681 HydrophobicContact SD-CD1 3.56Å; M653-Y681 VanDerWaalsContact SD-CD1 3.56Å; M653-Y681 HydrophobicContact SD-CE1 4.14Å; A659-Y681 HydrophobicContact CB-CD2 4.04Å; A659-Y681 HydrophobicContact CB-CG 4.05Å; E677-Y681 VanDerWaalsContact O-CD2 3.23Å; E677-Y681 WeakPolarHBondContact O-CD2 3.47Å; D678-Y681 PolarHBondContact O-N 3.47Å; Y681-A719 HydrophobicContact CE2-CB 3.87Å; Y681-T723 HydrophobicContact CD1-CG2 3.92Å; Y681-T723 HydrophobicContact CE1-CG2 4.19Å; Y681-T723 HydrophobicContact CG-CG2 4.44Å
682	L	91	Very high	89.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-87.3	-7.8	-174.2	-62.7	-174.4	0	0	0	114.6	I650 A659 M663 M674 D678 L680 A684 A685 P686 L696	I650-L682 HydrophobicContact CD1-CD2 4.11Å; A659-L682 HydrophobicContact CB-CD2 4.45Å; A659-L682 HydrophobicContact CB-CG 4.38Å; M663-L682 HydrophobicContact CB-CD1 4.42Å; M663-L682 HydrophobicContact CB-CD2 3.79Å; M663-L682 HydrophobicContact CG-CD2 4.28Å; M663-L682 HydrophobicContact SD-CD2 4.4Å; M674-L682 HydrophobicContact CE-CD1 4.5Å; M674-L682 HydrophobicContact SD-CD1 3.8Å; D678-L682 WeakPolarHBondContact O-CG 3.4Å; D678-L682 PolarHBondContact O-N 2.96Å; L680-L682 VanDerWaalsContact C-N 3.31Å; L680-L682 PolarHBondContact O-N 2.95Å; L682-A684 VanDerWaalsContact C-N 3.26Å; L682-A684 PolarHBondContact O-N 3.14Å; L682-A685 HydrophobicContact CD2-CB 4.3Å; L682-A685 VanDerWaalsContact O-CB 3.23Å; L682-A685 WeakPolarHBondContact O-CB 3.37Å; L682-A685 PolarHBondContact O-N 3.42Å; L682-P686 WeakPolarHBondContact O-CD 3.21Å; L682-L696 HydrophobicContact CB-CD2 4.32Å
683	F	87.6	Confident	88.9	Confident	20 Å²	20	33.4 Å²	33.4	9%	0.088	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-38.9	-177.6	-168.2	-87.2	0	0	0	112.9	L25 L27 S679 Q697 C700 K701	L25-F683 HydrophobicContact CD2-CD1 3.31Å; L25-F683 HydrophobicContact CD2-CE1 3.73Å; L25-F683 HydrophobicContact CD2-CG 4.37Å; L27-F683 HydrophobicContact CD2-CD1 4.06Å; L27-F683 HydrophobicContact CD2-CD2 3.77Å; L27-F683 HydrophobicContact CD2-CE1 3.61Å; L27-F683 HydrophobicContact CD2-CE2 3.33Å; L27-F683 HydrophobicContact CD2-CG 4.1Å; L27-F683 HydrophobicContact CD2-CZ 3.25Å; S679-F683 WeakPolarHBondContact O-CB 3.16Å; S679-F683 PolarHBondContact O-N 2.89Å; F683-Q697 HydrophobicContact CD1-CG 4.19Å; F683-Q697 HydrophobicContact CD2-CG 4.07Å; F683-Q697 HydrophobicContact CE1-CG 4.01Å; F683-Q697 HydrophobicContact CE2-CG 3.81Å; F683-Q697 HydrophobicContact CG-CG 4.25Å; F683-Q697 HydrophobicContact CZ-CG 3.78Å; F683-C700 HydrophobicContact CD2-CB 4.07Å; F683-K701 HydrophobicContact CE2-CB 3.87Å; F683-K701 HydrophobicContact CE2-CG 4.29Å
684	A	85.3	Confident	88.7	Confident	29 Å²	29	31.1 Å²	31.1	24%	0.24	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-11	178	0	0	0	0	0	113.7	L25 I650 L682 P686 Y687 Y688	L25-A684 HydrophobicContact CD2-CB 4.41Å; I650-A684 HydrophobicContact CG2-CB 4.01Å; L682-A684 VanDerWaalsContact C-N 3.26Å; L682-A684 PolarHBondContact O-N 3.14Å; A684-P686 VanDerWaalsContact C-CD 3.48Å; A684-Y687 PolarHBondContact O-N 2.89Å; A684-Y688 PolarHBondContact O-N 3.15Å
685	A	88.9	Confident	88.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.1	-39.6	-174.5	0	0	0	0	0	113.6	I650 L682 Y687 Y688 Y689 F691 L696	I650-A685 HydrophobicContact CD1-CB 4.06Å; L682-A685 HydrophobicContact CD2-CB 4.3Å; L682-A685 VanDerWaalsContact O-CB 3.23Å; L682-A685 WeakPolarHBondContact O-CB 3.37Å; L682-A685 PolarHBondContact O-N 3.42Å; A685-Y687 VanDerWaalsContact C-N 3.34Å; A685-Y687 PolarHBondContact O-N 3.47Å; A685-Y688 PolarHBondContact O-N 2.96Å; A685-Y689 HydrophobicContact CB-CD2 4.23Å; A685-Y689 WeakPolarHBondContact O-CB 3.45Å; A685-Y689 PolarHBondContact O-N 2.94Å; A685-F691 HydrophobicContact CB-CE2 4.27Å; A685-L696 HydrophobicContact CB-CD2 4.28Å
686	P	88.4	Confident	88.7	Confident	8 Å²	8	29.3 Å²	29.3	5%	0.052	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-36.9	-178.6	-29.1	40.6	0	0	0	114.7	L682 A684 G690 F691 L696 Q697	L682-P686 WeakPolarHBondContact O-CD 3.21Å; A684-P686 VanDerWaalsContact C-CD 3.48Å; P686-G690 VanDerWaalsContact O-CA 3.27Å; P686-G690 WeakPolarHBondContact O-CA 3.34Å; P686-G690 PolarHBondContact O-N 3.33Å; P686-F691 HydrophobicContact CB-CB 4.39Å; P686-F691 HydrophobicContact CB-CD2 3.97Å; P686-F691 HydrophobicContact CG-CD2 3.95Å; P686-F691 HydrophobicContact CG-CE2 4.47Å; P686-F691 PolarHBondContact O-N 3.25Å; P686-L696 HydrophobicContact CG-CB 3.93Å; P686-L696 HydrophobicContact CG-CD2 4.33Å; P686-L696 HydrophobicContact CG-CG 4.39Å; P686-Q697 HydrophobicContact CG-CB 3.95Å
687	Y	85.6	Confident	88.6	Confident	162 Å²	162	30 Å²	30	64%	0.635	15%	0.151	S	C	*	.	H	α-helix	trans	-73.9	-46.4	176.1	-64.4	-80.2	0	0	0	111	A684 A685 G690 Q697	A684-Y687 PolarHBondContact O-N 2.89Å; A685-Y687 VanDerWaalsContact C-N 3.34Å; A685-Y687 PolarHBondContact O-N 3.47Å; Y687-G690 PolarHBondContact O-N 2.76Å; Y687-Q697 VanDerWaalsContact CE2-OE1 3.29Å; Y687-Q697 PolarHBondContact OH-OE1 3.41Å
688	Y	88.7	Confident	88.5	Confident	78 Å²	78	29.6 Å²	29.6	31%	0.306	15%	0.153	S	C	.	.	H	α-helix	trans	-64.9	-47	-176.5	-172.6	-95	0	0	0	112.5	S649 I650 G651 A684 A685 G690	S649-Y688 WeakPolarHBondContact O-CE1 3.45Å; S649-Y688 PolarHBondContact OG-OH 3.41Å; I650-Y688 HydrophobicContact CG2-CG 4.42Å; G651-Y688 VanDerWaalsContact CA-CE2 3.47Å; A684-Y688 PolarHBondContact O-N 3.15Å; A685-Y688 PolarHBondContact O-N 2.96Å; Y688-G690 VanDerWaalsContact C-N 3.33Å
689	Y	92	Very high	88.3	Confident	3 Å²	3	31.8 Å²	31.8	1%	0.012	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-1.8	178.7	-73	-72.9	0	0	0	113.4	S629 Y631 F632 I648 S649 I650 M663 A685 F691	S629-Y689 WeakPolarHBondContact CB-O 3.26Å; S629-Y689 PolarHBondContact OG-O 3.49Å; Y631-Y689 WeakPolarHBondContact CB-O 3.48Å; Y631-Y689 AromaticContact CD1-CD1 3.6Å; Y631-Y689 HydrophobicContact CD1-CD1 3.6Å; Y631-Y689 AromaticContact CD1-CE1 3.88Å; Y631-Y689 HydrophobicContact CD1-CE1 3.88Å; Y631-Y689 HydrophobicContact CE1-CD1 4.16Å; Y631-Y689 AromaticContact CE1-CE1 3.96Å; Y631-Y689 HydrophobicContact CE1-CE1 3.96Å; Y631-Y689 HydrophobicContact CG-CD1 4.25Å; Y631-Y689 PolarHBondContact N-O 2.92Å; F632-Y689 HydrophobicContact CD2-CD1 4.24Å; F632-Y689 HydrophobicContact CE1-CE1 4.29Å; F632-Y689 AromaticContact CE2-CD1 3.59Å; F632-Y689 HydrophobicContact CE2-CD1 3.59Å; F632-Y689 AromaticContact CE2-CE1 3.71Å; F632-Y689 HydrophobicContact CE2-CE1 3.71Å; F632-Y689 AromaticContact CZ-CD1 3.86Å; F632-Y689 HydrophobicContact CZ-CD1 3.86Å; F632-Y689 AromaticContact CZ-CE1 3.49Å; F632-Y689 HydrophobicContact CZ-CE1 3.49Å; F632-Y689 VanDerWaalsContact CZ-CE1 3.49Å; I648-Y689 WeakPolarHBondContact CG2-OH 3.43Å; S649-Y689 PolarHBondContact O-OH 3.34Å; I650-Y689 HydrophobicContact CD1-CE2 4.46Å; I650-Y689 HydrophobicContact CG1-CE2 3.71Å; M663-Y689 HydrophobicContact CE-CE2 3.92Å; M663-Y689 HydrophobicContact SD-CD2 3.74Å; M663-Y689 HydrophobicContact SD-CE2 3.41Å; M663-Y689 WeakPolarHBondContact SD-CE2 3.31Å; A685-Y689 HydrophobicContact CB-CD2 4.23Å; A685-Y689 WeakPolarHBondContact O-CB 3.45Å; A685-Y689 PolarHBondContact O-N 2.94Å; Y689-F691 VanDerWaalsContact CB-CE1 3.48Å; Y689-F691 HydrophobicContact CD2-CZ 4.47Å; Y689-F691 HydrophobicContact CG-CE1 4.33Å; Y689-F691 HydrophobicContact CG-CZ 4.39Å
690	G	91.5	Very high	88.1	Confident	22 Å²	22	31.8 Å²	31.8	23%	0.227	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	55.8	178.8	0	0	0	0	0	112.9	S630 P686 Y687 Y688	S630-G690 PolarHBondContact N-O 3.48Å; S630-G690 WeakPolarHBondContact OG-CA 3.5Å; S630-G690 PolarHBondContact OG-O 2.6Å; P686-G690 VanDerWaalsContact O-CA 3.27Å; P686-G690 WeakPolarHBondContact O-CA 3.34Å; P686-G690 PolarHBondContact O-N 3.33Å; Y687-G690 PolarHBondContact O-N 2.76Å; Y688-G690 VanDerWaalsContact C-N 3.33Å
691	F	93.9	Very high	87.9	Confident	16 Å²	16	34.7 Å²	34.7	7%	0.07	17%	0.174	C	C	.	.			trans	-70.3	153.2	173.5	-62.3	-25.2	0	0	0	111	R628 M663 Y666 I667 A685 P686 Y689 N693 L696	R628-F691 WeakPolarHBondContact O-CD1 3.48Å; M663-F691 HydrophobicContact CG-CZ 4.28Å; Y666-F691 HydrophobicContact CD1-CD2 4.08Å; Y666-F691 AromaticContact CD1-CE2 3.88Å; Y666-F691 HydrophobicContact CD1-CE2 3.88Å; Y666-F691 HydrophobicContact CD1-CZ 4.32Å; Y666-F691 AromaticContact CE1-CD2 3.56Å; Y666-F691 HydrophobicContact CE1-CD2 3.56Å; Y666-F691 AromaticContact CE1-CE2 3.86Å; Y666-F691 HydrophobicContact CE1-CE2 3.86Å; Y666-F691 HydrophobicContact CE1-CG 4.05Å; I667-F691 HydrophobicContact CD1-CE1 4.21Å; I667-F691 HydrophobicContact CD1-CZ 4.25Å; I667-F691 HydrophobicContact CG1-CE1 4.06Å; I667-F691 HydrophobicContact CG1-CZ 4.11Å; A685-F691 HydrophobicContact CB-CE2 4.27Å; P686-F691 HydrophobicContact CB-CB 4.39Å; P686-F691 HydrophobicContact CB-CD2 3.97Å; P686-F691 HydrophobicContact CG-CD2 3.95Å; P686-F691 HydrophobicContact CG-CE2 4.47Å; P686-F691 PolarHBondContact O-N 3.25Å; Y689-F691 VanDerWaalsContact CB-CE1 3.48Å; Y689-F691 HydrophobicContact CD2-CZ 4.47Å; Y689-F691 HydrophobicContact CG-CE1 4.33Å; Y689-F691 HydrophobicContact CG-CZ 4.39Å; F691-N693 PolarHBondContact O-N 2.93Å; F691-L696 HydrophobicContact CD2-CD2 4.26Å; F691-L696 HydrophobicContact CE2-CD2 3.66Å
692	S	87.9	Confident	87.5	Confident	60 Å²	60	35.5 Å²	35.5	42%	0.42	18%	0.179	S	C	.	.	S	Bend	trans	-57.7	-25.7	-173.9	-57.7	0	0	0	0	115.3	D364	D364-S692 PolarHBondContact OD1-OG 3.21Å; D364-S692 VanDerWaalsContact OD2-CB 3.31Å; D364-S692 WeakPolarHBondContact OD2-CB 3.43Å; D364-S692 PolarHBondContact OD2-OG 3Å
693	N	86.8	Confident	87.2	Confident	38 Å²	38	36.3 Å²	36.3	20%	0.203	18%	0.183	C	C	.	.	S	Bend	trans	-153.7	175.7	170.2	68.6	13.9	0	0	0	111.4	K358 T360 F691 R695	K358-N693 PolarHBondContact O-ND2 3.25Å; T360-N693 WeakPolarHBondContact CG2-ND2 3.33Å; F691-N693 PolarHBondContact O-N 2.93Å; N693-R695 PolarHBondContact O-N 3.02Å; N693-R695 WeakPolarHBondContact OD1-CB 3.32Å; N693-R695 PolarHBondContact OD1-N 3.22Å; N693-R695 VanDerWaalsContact OD1-N 3.08Å
694	N	86.7	Confident	87	Confident	73 Å²	73	35.4 Å²	35.4	39%	0.39	18%	0.179	S	C	.	.	S	Bend	trans	-82.2	21.1	179.6	67.1	-17.7	0	0	0	114.1	P357 L696 Q697 A698	P357-N694 WeakPolarHBondContact CG-OD1 3.3Å; N694-L696 PolarHBondContact O-N 2.91Å; N694-Q697 HydrophobicContact CB-CB 4.43Å; N694-Q697 PolarHBondContact O-N 3Å; N694-A698 PolarHBondContact O-N 3.25Å
695	R	89.3	Confident	86.5	Confident	29 Å²	29	37.1 Å²	37.1	11%	0.109	18%	0.182	C	C	.	.	H	α-helix	trans	-54.5	-52.4	-178.1	178.8	175.7	175.6	79.9	5.5	112	P357 Y666 V672 N693 Q697 A698 Y699	P357-R695 HydrophobicContact CB-CB 4.02Å; P357-R695 WeakPolarHBondContact O-CD 3.48Å; P357-R695 PolarHBondContact O-NH1 3.32Å; Y666-R695 HydrophobicContact CE2-CG 4.46Å; V672-R695 HydrophobicContact CG1-CG 4.47Å; N693-R695 PolarHBondContact O-N 3.02Å; N693-R695 WeakPolarHBondContact OD1-CB 3.32Å; N693-R695 PolarHBondContact OD1-N 3.22Å; N693-R695 VanDerWaalsContact OD1-N 3.08Å; R695-Q697 VanDerWaalsContact C-N 3.3Å; R695-Q697 PolarHBondContact O-N 3.38Å; R695-A698 PolarHBondContact O-N 3Å; R695-Y699 HydrophobicContact CG-CD2 3.88Å; R695-Y699 HydrophobicContact CG-CE2 3.91Å; R695-Y699 VanDerWaalsContact CZ-CE2 3.42Å; R695-Y699 PolarHBondContact NH2-OH 2.89Å; R695-Y699 WeakPolarHBondContact O-CD2 3.42Å; R695-Y699 PolarHBondContact O-N 3.29Å; R695-Y699 VanDerWaalsContact O-N 3.1Å
696	L	90.3	Very high	85.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.6	-45	-179.9	178.2	65	0	0	0	111.2	Y666 M674 L682 A685 P686 F691 N694 A698 Y699 C700	Y666-L696 HydrophobicContact CD1-CB 4.28Å; Y666-L696 HydrophobicContact CD1-CD2 4.06Å; Y666-L696 HydrophobicContact CD2-CB 4.08Å; Y666-L696 HydrophobicContact CD2-CD1 4.02Å; Y666-L696 HydrophobicContact CD2-CG 4.5Å; Y666-L696 HydrophobicContact CE1-CB 4.02Å; Y666-L696 HydrophobicContact CE1-CD2 4.45Å; Y666-L696 HydrophobicContact CE2-CB 3.8Å; Y666-L696 HydrophobicContact CG-CB 4.3Å; Y666-L696 HydrophobicContact CG-CD1 4.11Å; Y666-L696 HydrophobicContact CG-CD2 4.2Å; Y666-L696 HydrophobicContact CG-CG 4.45Å; M674-L696 HydrophobicContact CE-CD1 3.48Å; M674-L696 VanDerWaalsContact CE-CD1 3.48Å; M674-L696 HydrophobicContact SD-CD1 4.35Å; L682-L696 HydrophobicContact CB-CD2 4.32Å; A685-L696 HydrophobicContact CB-CD2 4.28Å; P686-L696 HydrophobicContact CG-CB 3.93Å; P686-L696 HydrophobicContact CG-CD2 4.33Å; P686-L696 HydrophobicContact CG-CG 4.39Å; F691-L696 HydrophobicContact CD2-CD2 4.26Å; F691-L696 HydrophobicContact CE2-CD2 3.66Å; N694-L696 PolarHBondContact O-N 2.91Å; L696-A698 PolarHBondContact O-N 2.96Å; L696-Y699 PolarHBondContact O-N 3.1Å; L696-C700 WeakPolarHBondContact O-CB 3.28Å; L696-C700 PolarHBondContact O-N 3.02Å; L696-C700 PolarHBondContact O-SG 3.43Å
697	Q	87.1	Confident	85.5	Confident	29 Å²	29	43.9 Å²	43.9	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-44.4	177.6	-178.3	-177.8	41.6	0	0	111.9	F683 P686 Y687 N694 R695 Y699 C700 K701	F683-Q697 HydrophobicContact CD1-CG 4.19Å; F683-Q697 HydrophobicContact CD2-CG 4.07Å; F683-Q697 HydrophobicContact CE1-CG 4.01Å; F683-Q697 HydrophobicContact CE2-CG 3.81Å; F683-Q697 HydrophobicContact CG-CG 4.25Å; F683-Q697 HydrophobicContact CZ-CG 3.78Å; P686-Q697 HydrophobicContact CG-CB 3.95Å; Y687-Q697 VanDerWaalsContact CE2-OE1 3.29Å; Y687-Q697 PolarHBondContact OH-OE1 3.41Å; N694-Q697 HydrophobicContact CB-CB 4.43Å; N694-Q697 PolarHBondContact O-N 3Å; R695-Q697 VanDerWaalsContact C-N 3.3Å; R695-Q697 PolarHBondContact O-N 3.38Å; Q697-Y699 VanDerWaalsContact C-N 3.34Å; Q697-Y699 PolarHBondContact O-N 3.11Å; Q697-C700 PolarHBondContact O-N 3.1Å; Q697-K701 PolarHBondContact O-N 3.01Å
698	A	83.4	Confident	85.5	Confident	25 Å²	25	37.2 Å²	37.2	21%	0.207	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-42.2	179.4	0	0	0	0	0	112	P357 N694 R695 L696 K701 Q702	P357-A698 HydrophobicContact CG-CB 4.2Å; N694-A698 PolarHBondContact O-N 3.25Å; R695-A698 PolarHBondContact O-N 3Å; L696-A698 PolarHBondContact O-N 2.96Å; A698-K701 WeakPolarHBondContact O-CB 3.21Å; A698-K701 PolarHBondContact O-N 2.83Å; A698-Q702 PolarHBondContact O-N 2.73Å
699	Y	86.4	Confident	85.4	Confident	48 Å²	48	36.5 Å²	36.5	19%	0.188	20%	0.196	C	C	.	.	H	α-helix	trans	-71.4	-37	175.1	-82.2	-84.4	0	0	0	112.7	Y356 V672 R695 L696 Q697 K701 Q702 N703	Y356-Y699 HydrophobicContact CD1-CD2 4.32Å; Y356-Y699 HydrophobicContact CD1-CE1 4.32Å; Y356-Y699 AromaticContact CD1-CE2 3.98Å; Y356-Y699 HydrophobicContact CD1-CE2 3.98Å; Y356-Y699 HydrophobicContact CD2-CE1 4.24Å; Y356-Y699 HydrophobicContact CD2-CE2 4.48Å; Y356-Y699 AromaticContact CD2-CZ 3.83Å; Y356-Y699 WeakPolarHBondContact CD2-OH 3.19Å; Y356-Y699 HydrophobicContact CE2-CE1 4.42Å; Y356-Y699 HydrophobicContact CG-CE1 4.24Å; Y356-Y699 AromaticContact CG-CE2 3.82Å; Y356-Y699 HydrophobicContact CG-CE2 3.82Å; Y356-Y699 AromaticContact CG-CZ 3.62Å; V672-Y699 HydrophobicContact CB-CD1 4.08Å; V672-Y699 HydrophobicContact CB-CD2 4.01Å; V672-Y699 HydrophobicContact CB-CG 3.7Å; V672-Y699 HydrophobicContact CG1-CD2 3.85Å; V672-Y699 HydrophobicContact CG1-CE2 4.42Å; V672-Y699 HydrophobicContact CG1-CG 4.05Å; V672-Y699 HydrophobicContact CG2-CD1 3.59Å; V672-Y699 HydrophobicContact CG2-CD2 3.94Å; V672-Y699 HydrophobicContact CG2-CE1 3.75Å; V672-Y699 HydrophobicContact CG2-CE2 4.11Å; V672-Y699 HydrophobicContact CG2-CG 3.68Å; R695-Y699 HydrophobicContact CG-CD2 3.88Å; R695-Y699 HydrophobicContact CG-CE2 3.91Å; R695-Y699 VanDerWaalsContact CZ-CE2 3.42Å; R695-Y699 PolarHBondContact NH2-OH 2.89Å; R695-Y699 WeakPolarHBondContact O-CD2 3.42Å; R695-Y699 PolarHBondContact O-N 3.29Å; R695-Y699 VanDerWaalsContact O-N 3.1Å; L696-Y699 PolarHBondContact O-N 3.1Å; Q697-Y699 VanDerWaalsContact C-N 3.34Å; Q697-Y699 PolarHBondContact O-N 3.11Å; Y699-K701 VanDerWaalsContact C-N 3.3Å; Y699-K701 PolarHBondContact O-N 3.48Å; Y699-Q702 PolarHBondContact O-N 3.02Å; Y699-N703 VanDerWaalsContact O-CB 3.23Å; Y699-N703 WeakPolarHBondContact O-CB 3.18Å; Y699-N703 PolarHBondContact O-N 3.01Å
700	C	87.9	Confident	85.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-44.7	172.1	-69.7	0	0	0	0	110.8	S679 F683 L696 Q697 N703 L704	S679-C700 WeakPolarHBondContact O-CB 3.33Å; F683-C700 HydrophobicContact CD2-CB 4.07Å; L696-C700 WeakPolarHBondContact O-CB 3.28Å; L696-C700 PolarHBondContact O-N 3.02Å; L696-C700 PolarHBondContact O-SG 3.43Å; Q697-C700 PolarHBondContact O-N 3.1Å; C700-N703 PolarHBondContact O-N 3.29Å; C700-L704 WeakPolarHBondContact O-CD1 3.46Å; C700-L704 VanDerWaalsContact O-CG 3.23Å; C700-L704 WeakPolarHBondContact O-CG 3.17Å; C700-L704 PolarHBondContact O-N 3.3Å; C700-L704 VanDerWaalsContact O-N 3.07Å
701	K	81.2	Confident	85.2	Confident	66 Å²	66	44.9 Å²	44.9	29%	0.287	23%	0.232	S	C	.	.	H	α-helix	trans	-56.5	-55	175.1	-166.6	-178.2	-179.8	176.1	0	111	N28 F29 F683 Q697 A698 Y699 N703 L704 E705	N28-K701 PolarHBondContact O-NZ 2.79Å; F29-K701 HydrophobicContact CD1-CG 4.28Å; F29-K701 HydrophobicContact CE1-CG 3.91Å; F683-K701 HydrophobicContact CE2-CB 3.87Å; F683-K701 HydrophobicContact CE2-CG 4.29Å; Q697-K701 PolarHBondContact O-N 3.01Å; A698-K701 WeakPolarHBondContact O-CB 3.21Å; A698-K701 PolarHBondContact O-N 2.83Å; Y699-K701 VanDerWaalsContact C-N 3.3Å; Y699-K701 PolarHBondContact O-N 3.48Å; K701-N703 VanDerWaalsContact C-N 3.32Å; K701-N703 PolarHBondContact O-N 3.26Å; K701-L704 WeakPolarHBondContact O-CB 3.18Å; K701-L704 PolarHBondContact O-N 3.34Å; K701-E705 WeakPolarHBondContact CE-OE1 3.17Å; K701-E705 WeakPolarHBondContact O-CG 3.37Å; K701-E705 PolarHBondContact O-N 3.08Å
702	Q	78	Confident	85	Confident	39 Å²	39	45.3 Å²	45.3	18%	0.182	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-41.4	-178	-171.7	-155.3	-5.5	0	0	112.2	Y356 A698 Y699 L704 E705 M706	Y356-Q702 HydrophobicContact CE1-CB 4.32Å; Y356-Q702 HydrophobicContact CE1-CG 4.41Å; Y356-Q702 VanDerWaalsContact CE1-OE1 3.3Å; Y356-Q702 VanDerWaalsContact CZ-CD 3.43Å; Y356-Q702 WeakPolarHBondContact OH-CG 3.45Å; Y356-Q702 PolarHBondContact OH-NE2 2.89Å; Y356-Q702 PolarHBondContact OH-OE1 3.15Å; A698-Q702 PolarHBondContact O-N 2.73Å; Y699-Q702 PolarHBondContact O-N 3.02Å; Q702-L704 VanDerWaalsContact C-N 3.29Å; Q702-L704 PolarHBondContact O-N 3.24Å; Q702-E705 WeakPolarHBondContact O-CB 3.28Å; Q702-E705 PolarHBondContact O-N 3.05Å; Q702-E705 VanDerWaalsContact O-N 3.11Å; Q702-M706 HydrophobicContact CG-CG 4.07Å; Q702-M706 WeakPolarHBondContact O-CB 3.47Å; Q702-M706 VanDerWaalsContact O-CG 3.31Å; Q702-M706 WeakPolarHBondContact O-CG 3.26Å; Q702-M706 PolarHBondContact O-N 2.96Å
703	N	85.2	Confident	85.2	Confident	18 Å²	18	42.5 Å²	42.5	10%	0.096	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-39.8	179.5	-167.5	25.7	0	0	0	111.3	M674 P675 S679 Y699 C700 K701 E705 N707	M674-N703 PolarHBondContact O-ND2 3.29Å; P675-N703 PolarHBondContact O-ND2 3.14Å; S679-N703 PolarHBondContact OG-ND2 3.01Å; Y699-N703 VanDerWaalsContact O-CB 3.23Å; Y699-N703 WeakPolarHBondContact O-CB 3.18Å; Y699-N703 PolarHBondContact O-N 3.01Å; C700-N703 PolarHBondContact O-N 3.29Å; K701-N703 VanDerWaalsContact C-N 3.32Å; K701-N703 PolarHBondContact O-N 3.26Å; N703-E705 VanDerWaalsContact C-N 3.34Å; N703-N707 WeakPolarHBondContact O-CB 3.4Å; N703-N707 PolarHBondContact O-N 2.85Å; N703-N707 PolarHBondContact OD1-ND2 3.43Å
704	L	83.3	Confident	85.4	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-67.4	-32.3	172.5	-67.9	168.7	0	0	0	112.6	P676 L680 C700 K701 Q702 V708 M728	P676-L704 HydrophobicContact CB-CD2 4.32Å; P676-L704 VanDerWaalsContact O-CD2 3.26Å; P676-L704 WeakPolarHBondContact O-CD2 3.45Å; L680-L704 HydrophobicContact CD1-CD2 4.3Å; L680-L704 HydrophobicContact CD2-CD1 3.98Å; L680-L704 HydrophobicContact CD2-CD2 4.42Å; L680-L704 HydrophobicContact CG-CD1 4.05Å; L680-L704 HydrophobicContact CG-CD2 3.8Å; C700-L704 WeakPolarHBondContact O-CD1 3.46Å; C700-L704 VanDerWaalsContact O-CG 3.23Å; C700-L704 WeakPolarHBondContact O-CG 3.17Å; C700-L704 PolarHBondContact O-N 3.3Å; C700-L704 VanDerWaalsContact O-N 3.07Å; K701-L704 WeakPolarHBondContact O-CB 3.18Å; K701-L704 PolarHBondContact O-N 3.34Å; Q702-L704 VanDerWaalsContact C-N 3.29Å; Q702-L704 PolarHBondContact O-N 3.24Å; L704-V708 WeakPolarHBondContact O-CG2 3.44Å; L704-M728 HydrophobicContact CB-CE 3.82Å; L704-M728 HydrophobicContact CD1-CE 4.38Å; L704-M728 HydrophobicContact CD2-CE 4.32Å; L704-M728 HydrophobicContact CG-CE 4.4Å
705	E	73.3	Confident	85.6	Confident	64 Å²	64	41.3 Å²	41.3	30%	0.299	21%	0.206	S	C	.	.	H	α-helix	trans	-72.9	-38.4	176.3	-70.1	167.8	168.1	0	0	112.5	F29 F32 K701 Q702 N703	F29-E705 HydrophobicContact CD1-CG 3.43Å; F29-E705 VanDerWaalsContact CD1-CG 3.43Å; F29-E705 VanDerWaalsContact CD1-OE1 3.26Å; F29-E705 WeakPolarHBondContact CD1-OE1 3.46Å; F29-E705 HydrophobicContact CE1-CG 3.52Å; F32-E705 HydrophobicContact CD1-CB 4.25Å; F32-E705 HydrophobicContact CD1-CG 3.98Å; F32-E705 HydrophobicContact CE1-CG 4.06Å; K701-E705 WeakPolarHBondContact CE-OE1 3.17Å; K701-E705 WeakPolarHBondContact O-CG 3.37Å; K701-E705 PolarHBondContact O-N 3.08Å; Q702-E705 WeakPolarHBondContact O-CB 3.28Å; Q702-E705 PolarHBondContact O-N 3.05Å; Q702-E705 VanDerWaalsContact O-N 3.11Å; N703-E705 VanDerWaalsContact C-N 3.34Å
706	M	74.3	Confident	85.6	Confident	71 Å²	71	39.9 Å²	39.9	35%	0.35	20%	0.201	S	C	.	.	H	α-helix	trans	-97.1	-28.2	-166.5	-68.5	-59.8	-49.4	0	0	114.1	T34 Q702	T34-M706 HydrophobicContact CG2-CE 3.41Å; T34-M706 VanDerWaalsContact CG2-CE 3.41Å; T34-M706 HydrophobicContact CG2-SD 4.13Å; T34-M706 WeakPolarHBondContact OG1-CE 3.29Å; Q702-M706 HydrophobicContact CG-CG 4.07Å; Q702-M706 WeakPolarHBondContact O-CB 3.47Å; Q702-M706 VanDerWaalsContact O-CG 3.31Å; Q702-M706 WeakPolarHBondContact O-CG 3.26Å; Q702-M706 PolarHBondContact O-N 2.96Å
707	N	83.4	Confident	85.6	Confident	80 Å²	80	39.9 Å²	39.9	43%	0.428	20%	0.201	S	C	.	.	S	Bend	trans	-121	13.6	-164.3	-61.3	-43.9	0	0	0	113.6	P676 N703 T709 N712	P676-N707 HydrophobicContact CG-CB 3.68Å; N703-N707 WeakPolarHBondContact O-CB 3.4Å; N703-N707 PolarHBondContact O-N 2.85Å; N703-N707 PolarHBondContact OD1-ND2 3.43Å; N707-T709 PolarHBondContact O-N 3.1Å; N707-N712 PolarHBondContact O-ND2 3.34Å
708	V	85.1	Confident	85.8	Confident	21 Å²	21	41.7 Å²	41.7	13%	0.127	21%	0.209	C	C	.	.			trans	-77.6	117	168.6	178.3	0	0	0	0	109	L704 I716 M728 I735	L704-V708 WeakPolarHBondContact O-CG2 3.44Å; V708-I716 HydrophobicContact CB-CD1 4.28Å; V708-I716 HydrophobicContact CG1-CD1 4.19Å; V708-I716 HydrophobicContact CG2-CD1 3.76Å; V708-M728 HydrophobicContact CG2-SD 4.44Å; V708-I735 HydrophobicContact CG1-CD1 3.62Å
709	T	87.5	Confident	85.9	Confident	63 Å²	63	40.6 Å²	40.6	39%	0.387	20%	0.201	S	C	.	.			trans	-132.4	169.2	-175.2	69.8	0	0	0	0	111.2	N707 E711 N712 V713	N707-T709 PolarHBondContact O-N 3.1Å; T709-E711 PolarHBondContact O-N 2.77Å; T709-E711 VanDerWaalsContact O-N 3.13Å; T709-E711 PolarHBondContact OG1-N 2.93Å; T709-N712 PolarHBondContact N-OD1 2.83Å; T709-N712 PolarHBondContact O-N 3.36Å; T709-N712 PolarHBondContact O-OD1 2.7Å; T709-N712 PolarHBondContact OG1-OD1 2.82Å; T709-V713 VanDerWaalsContact O-CB 3.29Å; T709-V713 WeakPolarHBondContact O-CB 3.24Å; T709-V713 PolarHBondContact O-N 3.14Å
710	V	88.3	Confident	86	Confident	37 Å²	37	38.4 Å²	38.4	22%	0.224	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-31.1	174.4	175.2	0	0	0	0	111.9	Q739 K742 V743 L746	V710-Q739 HydrophobicContact CG2-CB 3.9Å; V710-Q739 HydrophobicContact CG2-CG 3.98Å; V710-K742 HydrophobicContact CG1-CB 3.74Å; V710-K742 HydrophobicContact CG1-CD 4.47Å; V710-V743 HydrophobicContact CG1-CG2 3.83Å; V710-L746 VanDerWaalsContact O-CD1 3.24Å; V710-L746 WeakPolarHBondContact O-CD1 3.21Å
711	E	89.5	Confident	86	Confident	165 Å²	165	40.4 Å²	40.4	77%	0.771	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-33.4	-174.5	-62	-177.3	177.6	0	0	113.2	T709	T709-E711 PolarHBondContact O-N 2.77Å; T709-E711 VanDerWaalsContact O-N 3.13Å; T709-E711 PolarHBondContact OG1-N 2.93Å
712	N	90.6	Very high	86.1	Confident	25 Å²	25	42.5 Å²	42.5	13%	0.134	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-9	-176.1	62.5	12.6	0	0	0	114.2	N707 T709 L714 Q715 I716	N707-N712 PolarHBondContact O-ND2 3.34Å; T709-N712 PolarHBondContact N-OD1 2.83Å; T709-N712 PolarHBondContact O-N 3.36Å; T709-N712 PolarHBondContact O-OD1 2.7Å; T709-N712 PolarHBondContact OG1-OD1 2.82Å; N712-L714 PolarHBondContact O-N 3.25Å; N712-Q715 PolarHBondContact O-N 2.95Å; N712-I716 HydrophobicContact CB-CD1 4.24Å; N712-I716 WeakPolarHBondContact O-CG1 3.38Å; N712-I716 PolarHBondContact O-N 3Å; N712-I716 VanDerWaalsContact O-N 3.14Å; N712-I716 WeakPolarHBondContact OD1-CD1 3.2Å
713	V	91.1	Very high	86.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-53.6	-33	-174.8	70.1	0	0	0	0	114.4	T709 L717 C732 I735 I736 V743	T709-V713 VanDerWaalsContact O-CB 3.29Å; T709-V713 WeakPolarHBondContact O-CB 3.24Å; T709-V713 PolarHBondContact O-N 3.14Å; V713-L717 WeakPolarHBondContact O-CB 3.35Å; V713-L717 PolarHBondContact O-N 2.98Å; V713-C732 HydrophobicContact CG2-CB 3.78Å; V713-I735 HydrophobicContact CG2-CB 4.2Å; V713-I735 HydrophobicContact CG2-CG2 4.16Å; V713-I736 HydrophobicContact CB-CG1 4.39Å; V713-I736 HydrophobicContact CG1-CD1 4.37Å; V713-I736 HydrophobicContact CG1-CG1 3.71Å; V713-I736 HydrophobicContact CG2-CD1 4.07Å; V713-I736 HydrophobicContact CG2-CG1 3.75Å; V713-V743 HydrophobicContact CG1-CG1 4.46Å; V713-V743 HydrophobicContact CG1-CG2 4.07Å
714	L	92.7	Very high	86.1	Confident	5 Å²	5	45.6 Å²	45.6	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-70.3	-38.2	179.5	-62.7	-177.2	0	0	0	112.8	N712 E718 I736 V743 L746 N748 L749 L752	N712-L714 PolarHBondContact O-N 3.25Å; L714-E718 PolarHBondContact O-N 2.97Å; L714-I736 HydrophobicContact CD2-CD1 3.87Å; L714-I736 HydrophobicContact CD2-CG1 4.27Å; L714-V743 HydrophobicContact CD1-CG1 4.04Å; L714-V743 HydrophobicContact CD2-CG1 3.49Å; L714-V743 VanDerWaalsContact CD2-CG1 3.49Å; L714-V743 HydrophobicContact CG-CG1 3.87Å; L714-L746 HydrophobicContact CD1-CB 4.01Å; L714-L746 HydrophobicContact CD1-CD1 3.93Å; L714-L746 HydrophobicContact CG-CD1 4.29Å; L714-N748 HydrophobicContact CD1-CB 4.48Å; L714-L749 HydrophobicContact CD1-CB 3.91Å; L714-L749 HydrophobicContact CD1-CD1 3.93Å; L714-L749 HydrophobicContact CD2-CD1 3.81Å; L714-L752 HydrophobicContact CD2-CD1 4.13Å
715	Q	89.7	Confident	86.1	Confident	81 Å²	81	45.6 Å²	45.6	38%	0.379	23%	0.227	S	C	.	.	H	α-helix	trans	-71.3	-38.6	177	-68.5	172.9	-9.6	0	0	110.7	N712 L717 E718 A719	N712-Q715 PolarHBondContact O-N 2.95Å; Q715-L717 VanDerWaalsContact C-N 3.34Å; Q715-E718 PolarHBondContact O-N 3.05Å; Q715-A719 WeakPolarHBondContact O-CB 3.28Å; Q715-A719 PolarHBondContact O-N 2.83Å
716	I	89.7	Confident	86.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.9	-37.8	176.4	-58.8	174.8	0	0	0	110.4	P676 L680 V708 N712 A719 A720 M728 C732	P676-I716 HydrophobicContact CB-CD1 3.67Å; P676-I716 HydrophobicContact CB-CG1 4.35Å; L680-I716 HydrophobicContact CD1-CG2 3.64Å; V708-I716 HydrophobicContact CB-CD1 4.28Å; V708-I716 HydrophobicContact CG1-CD1 4.19Å; V708-I716 HydrophobicContact CG2-CD1 3.76Å; N712-I716 HydrophobicContact CB-CD1 4.24Å; N712-I716 WeakPolarHBondContact O-CG1 3.38Å; N712-I716 PolarHBondContact O-N 3Å; N712-I716 VanDerWaalsContact O-N 3.14Å; N712-I716 WeakPolarHBondContact OD1-CD1 3.2Å; I716-A719 PolarHBondContact O-N 2.85Å; I716-A720 VanDerWaalsContact O-CB 3.24Å; I716-A720 WeakPolarHBondContact O-CB 3.21Å; I716-A720 PolarHBondContact O-N 3.33Å; I716-M728 HydrophobicContact CG2-CG 4.03Å; I716-M728 HydrophobicContact CG2-SD 4.21Å; I716-C732 VanDerWaalsContact CG2-SG 3.56Å
717	L	90.8	Very high	86.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.2	-46.5	173.1	-179.2	69.9	0	0	0	111.6	V713 Q715 A720 D721 K729 C732 L733 I736 L756 I760	V713-L717 WeakPolarHBondContact O-CB 3.35Å; V713-L717 PolarHBondContact O-N 2.98Å; Q715-L717 VanDerWaalsContact C-N 3.34Å; L717-A720 PolarHBondContact O-N 2.87Å; L717-D721 PolarHBondContact O-N 2.99Å; L717-K729 HydrophobicContact CD1-CG 3.76Å; L717-C732 HydrophobicContact CB-CB 4.1Å; L717-C732 HydrophobicContact CD1-CB 3.92Å; L717-L733 HydrophobicContact CD1-CD2 4.13Å; L717-L733 HydrophobicContact CD1-CG 3.98Å; L717-L733 HydrophobicContact CD2-CD2 4.32Å; L717-I736 HydrophobicContact CD2-CD1 3.8Å; L717-L756 HydrophobicContact CD2-CD2 4.39Å; L717-L756 HydrophobicContact CG-CD2 4.15Å; L717-I760 HydrophobicContact CD2-CD1 3.81Å; L717-I760 HydrophobicContact CD2-CG1 4Å
718	E	89.8	Confident	87	Confident	66 Å²	66	42.9 Å²	42.9	31%	0.308	22%	0.216	S	C	.	.	H	α-helix	trans	-64.6	-42.9	177.5	-168.6	-171.2	164.3	0	0	111.9	L714 Q715 D721 K722 L752 L756	L714-E718 PolarHBondContact O-N 2.97Å; Q715-E718 PolarHBondContact O-N 3.05Å; E718-D721 PolarHBondContact O-N 3.37Å; E718-K722 WeakPolarHBondContact O-CG 3.38Å; E718-K722 PolarHBondContact O-N 3.35Å; E718-K722 VanDerWaalsContact OE1-CE 3.32Å; E718-K722 WeakPolarHBondContact OE1-CE 3.34Å; E718-K722 IonicContact OE1-NZ 3.52Å; E718-K722 PolarHBondContact OE1-NZ 2.98Å; E718-L752 HydrophobicContact CB-CD2 4.38Å; E718-L756 HydrophobicContact CB-CD1 4.13Å; E718-L756 HydrophobicContact CG-CD1 4.15Å
719	A	87.3	Confident	87.1	Confident	3 Å²	3	43.4 Å²	43.4	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-63.1	-42.9	176	0	0	0	0	0	111.6	L680 Y681 Q715 I716 D721 K722 T723	L680-A719 HydrophobicContact CB-CB 4.34Å; L680-A719 HydrophobicContact CD1-CB 3.74Å; Y681-A719 HydrophobicContact CE2-CB 3.87Å; Q715-A719 WeakPolarHBondContact O-CB 3.28Å; Q715-A719 PolarHBondContact O-N 2.83Å; I716-A719 PolarHBondContact O-N 2.85Å; A719-D721 VanDerWaalsContact C-N 3.3Å; A719-D721 PolarHBondContact O-N 2.79Å; A719-K722 PolarHBondContact O-N 2.89Å; A719-T723 WeakPolarHBondContact O-CG2 3.34Å; A719-T723 PolarHBondContact O-N 3.06Å; A719-T723 PolarHBondContact O-OG1 3.02Å
720	A	87.8	Confident	87.1	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-35.4	179.5	0	0	0	0	0	111.9	L680 I716 L717 Q724 A725 M728 K729	L680-A720 HydrophobicContact CD1-CB 3.99Å; I716-A720 VanDerWaalsContact O-CB 3.24Å; I716-A720 WeakPolarHBondContact O-CB 3.21Å; I716-A720 PolarHBondContact O-N 3.33Å; L717-A720 PolarHBondContact O-N 2.87Å; A720-Q724 CarbonylContact O-C 3.59Å; A720-Q724 WeakPolarHBondContact O-CA 3.47Å; A720-Q724 PolarHBondContact O-N 2.98Å; A720-A725 HydrophobicContact CB-CB 4.32Å; A720-A725 PolarHBondContact O-N 3.44Å; A720-M728 HydrophobicContact CB-CB 4.09Å; A720-M728 HydrophobicContact CB-CG 4.06Å; A720-K729 HydrophobicContact CB-CB 4.2Å
721	D	87.9	Confident	86.9	Confident	42 Å²	42	48.5 Å²	48.5	23%	0.225	23%	0.231	C	C	.	.	H	α-helix	trans	-67.4	-46.5	172.9	-168.2	67.6	0	0	0	111.5	L717 E718 A719 T723 Q724 K729 L756	L717-D721 PolarHBondContact O-N 2.99Å; E718-D721 PolarHBondContact O-N 3.37Å; A719-D721 VanDerWaalsContact C-N 3.3Å; A719-D721 PolarHBondContact O-N 2.79Å; D721-T723 VanDerWaalsContact C-N 3.32Å; D721-T723 PolarHBondContact O-N 2.97Å; D721-Q724 PolarHBondContact O-N 3.1Å; D721-Q724 VanDerWaalsContact O-N 3.14Å; D721-Q724 PolarHBondContact O-NE2 2.84Å; D721-K729 IonicContact OD1-NZ 3.28Å; D721-K729 PolarHBondContact OD1-NZ 2.99Å; D721-L756 HydrophobicContact CB-CD1 4.43Å; D721-L756 HydrophobicContact CB-CD2 3.83Å
722	K	83.6	Confident	86.9	Confident	111 Å²	111	40.7 Å²	40.7	48%	0.483	19%	0.194	S	C	.	.	H	α-helix	trans	-61.7	-38	176.5	-75	178.2	-174.7	166.5	0	113.2	E718 A719 Q724	E718-K722 WeakPolarHBondContact O-CG 3.38Å; E718-K722 PolarHBondContact O-N 3.35Å; E718-K722 VanDerWaalsContact OE1-CE 3.32Å; E718-K722 WeakPolarHBondContact OE1-CE 3.34Å; E718-K722 IonicContact OE1-NZ 3.52Å; E718-K722 PolarHBondContact OE1-NZ 2.98Å; A719-K722 PolarHBondContact O-N 2.89Å; K722-Q724 VanDerWaalsContact C-N 3.32Å
723	T	80.4	Confident	86.9	Confident	17 Å²	17	40.3 Å²	40.3	10%	0.104	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	0.6	178.5	62.5	0	0	0	0	113.6	M653 Y681 A719 D721 A725	M653-T723 HydrophobicContact CE-CG2 4.19Å; Y681-T723 HydrophobicContact CD1-CG2 3.92Å; Y681-T723 HydrophobicContact CE1-CG2 4.19Å; Y681-T723 HydrophobicContact CG-CG2 4.44Å; A719-T723 WeakPolarHBondContact O-CG2 3.34Å; A719-T723 PolarHBondContact O-N 3.06Å; A719-T723 PolarHBondContact O-OG1 3.02Å; D721-T723 VanDerWaalsContact C-N 3.32Å; D721-T723 PolarHBondContact O-N 2.97Å; T723-A725 PolarHBondContact O-N 3.23Å
724	Q	83.3	Confident	86.7	Confident	105 Å²	105	45.5 Å²	45.5	49%	0.491	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	31.4	-176.3	-59.5	-68.4	-58.2	0	0	113.4	A720 D721 K722 L726	A720-Q724 CarbonylContact O-C 3.59Å; A720-Q724 WeakPolarHBondContact O-CA 3.47Å; A720-Q724 PolarHBondContact O-N 2.98Å; D721-Q724 PolarHBondContact O-N 3.1Å; D721-Q724 VanDerWaalsContact O-N 3.14Å; D721-Q724 PolarHBondContact O-NE2 2.84Å; K722-Q724 VanDerWaalsContact C-N 3.32Å; Q724-L726 PolarHBondContact O-N 3.06Å
725	A	82.3	Confident	86.4	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.008	22%	0.223	C	C	.	.			trans	-81.4	79	176.1	0	0	0	0	0	110.8	L27 L680 A720 T723 D727 M728 K729	L27-A725 HydrophobicContact CD1-CB 4.15Å; L680-A725 HydrophobicContact CD2-CB 3.89Å; A720-A725 HydrophobicContact CB-CB 4.32Å; A720-A725 PolarHBondContact O-N 3.44Å; T723-A725 PolarHBondContact O-N 3.23Å; A725-D727 VanDerWaalsContact C-N 3.33Å; A725-D727 PolarHBondContact O-N 3.23Å; A725-M728 HydrophobicContact CB-CB 4.24Å; A725-M728 PolarHBondContact O-N 2.99Å; A725-K729 PolarHBondContact O-N 3.41Å
726	L	83.8	Confident	86.6	Confident	101 Å²	101	42.9 Å²	42.9	53%	0.529	21%	0.205	S	C	.	.	H	α-helix	trans	-57.5	-39.9	-172.2	-62.9	178.6	0	0	0	113.9	Q724 K729 K730	Q724-L726 PolarHBondContact O-N 3.06Å; L726-K729 PolarHBondContact O-N 2.7Å; L726-K730 WeakPolarHBondContact O-CG 3.34Å; L726-K730 PolarHBondContact O-N 3.47Å
727	D	81.6	Confident	86.7	Confident	55 Å²	55	43.5 Å²	43.5	29%	0.294	21%	0.209	S	C	.	.	H	α-helix	trans	-67.1	-41.3	-179	-62.4	-36.6	0	0	0	111.6	T26 L27 A725 K730 H731	T26-D727 WeakPolarHBondContact CA-OD2 3.21Å; L27-D727 HydrophobicContact CB-CB 4.41Å; L27-D727 PolarHBondContact N-OD2 2.9Å; A725-D727 VanDerWaalsContact C-N 3.33Å; A725-D727 PolarHBondContact O-N 3.23Å; D727-K730 PolarHBondContact O-N 3.48Å; D727-H731 WeakPolarHBondContact O-CB 3.45Å; D727-H731 PolarHBondContact O-N 3.12Å
728	M	84.3	Confident	86.5	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-67.4	-40.8	174.6	-174.5	56.4	60.3	0	0	111.1	L27 F29 L680 L704 V708 I716 A720 A725 K730 H731 C732	L27-M728 HydrophobicContact CD1-CB 3.82Å; L27-M728 HydrophobicContact CD1-CE 4.3Å; F29-M728 HydrophobicContact CE1-CE 4.43Å; F29-M728 HydrophobicContact CE2-CE 3.59Å; F29-M728 HydrophobicContact CZ-CE 3.33Å; L680-M728 HydrophobicContact CD1-CG 4.19Å; L680-M728 HydrophobicContact CD2-CB 4.17Å; L680-M728 HydrophobicContact CD2-CG 4.03Å; L704-M728 HydrophobicContact CB-CE 3.82Å; L704-M728 HydrophobicContact CD1-CE 4.38Å; L704-M728 HydrophobicContact CD2-CE 4.32Å; L704-M728 HydrophobicContact CG-CE 4.4Å; V708-M728 HydrophobicContact CG2-SD 4.44Å; I716-M728 HydrophobicContact CG2-CG 4.03Å; I716-M728 HydrophobicContact CG2-SD 4.21Å; A720-M728 HydrophobicContact CB-CB 4.09Å; A720-M728 HydrophobicContact CB-CG 4.06Å; A725-M728 HydrophobicContact CB-CB 4.24Å; A725-M728 PolarHBondContact O-N 2.99Å; M728-K730 VanDerWaalsContact C-N 3.32Å; M728-K730 PolarHBondContact O-N 2.6Å; M728-H731 PolarHBondContact O-N 2.96Å; M728-H731 VanDerWaalsContact O-N 3.13Å; M728-H731 HydrophobicContact SD-CB 4.41Å; M728-C732 PolarHBondContact O-N 3.29Å; M728-C732 PolarHBondContact O-SG 3.18Å
729	K	88.1	Confident	86.6	Confident	33 Å²	33	48.7 Å²	48.7	14%	0.143	23%	0.232	C	C	.	.	H	α-helix	trans	-56	-47.7	175.3	-173.1	176.1	179.8	176.2	0	110.9	L717 A720 D721 A725 L726 H731 C732 L733 D759	L717-K729 HydrophobicContact CD1-CG 3.76Å; A720-K729 HydrophobicContact CB-CB 4.2Å; D721-K729 IonicContact OD1-NZ 3.28Å; D721-K729 PolarHBondContact OD1-NZ 2.99Å; A725-K729 PolarHBondContact O-N 3.41Å; L726-K729 PolarHBondContact O-N 2.7Å; K729-H731 PolarHBondContact O-N 3.36Å; K729-C732 PolarHBondContact O-N 3.3Å; K729-L733 HydrophobicContact CG-CD1 4.31Å; K729-L733 VanDerWaalsContact O-CG 3.29Å; K729-L733 WeakPolarHBondContact O-CG 3.28Å; K729-L733 PolarHBondContact O-N 2.95Å; K729-D759 WeakPolarHBondContact CE-OD2 2.83Å; K729-D759 IonicContact NZ-OD2 3.79Å; K729-D759 PolarHBondContact NZ-OD2 3.16Å
730	K	86	Confident	86.8	Confident	141 Å²	141	51.9 Å²	51.9	61%	0.613	25%	0.246	S	C	*	.	H	α-helix	trans	-60.3	-44.3	174.8	-72.3	173.5	-176.5	171.3	0	112.3	L726 D727 M728 L733 H734	L726-K730 WeakPolarHBondContact O-CG 3.34Å; L726-K730 PolarHBondContact O-N 3.47Å; D727-K730 PolarHBondContact O-N 3.48Å; M728-K730 VanDerWaalsContact C-N 3.32Å; M728-K730 PolarHBondContact O-N 2.6Å; K730-L733 PolarHBondContact O-N 3.37Å; K730-H734 PolarHBondContact O-N 2.96Å
731	H	85.2	Confident	86.9	Confident	66 Å²	66	57.9 Å²	57.9	31%	0.306	28%	0.277	S	S	.	.	H	α-helix	trans	-62.4	-44.5	178.4	-175.9	68.4	0	0	0	112.5	D727 M728 K729 H734 I735	D727-H731 WeakPolarHBondContact O-CB 3.45Å; D727-H731 PolarHBondContact O-N 3.12Å; M728-H731 PolarHBondContact O-N 2.96Å; M728-H731 VanDerWaalsContact O-N 3.13Å; M728-H731 HydrophobicContact SD-CB 4.41Å; K729-H731 PolarHBondContact O-N 3.36Å; H731-H734 WeakPolarHBondContact O-CB 3.39Å; H731-H734 PolarHBondContact O-N 3.24Å; H731-I735 WeakPolarHBondContact NE2-CD1 3.35Å; H731-I735 PolarHBondContact O-N 3.45Å; H731-I735 VanDerWaalsContact O-N 3.07Å
732	C	88.4	Confident	87.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.6	-47.2	174.1	-68.6	0	0	0	0	111.4	V713 I716 L717 M728 K729 H734 I735 I736	V713-C732 HydrophobicContact CG2-CB 3.78Å; I716-C732 VanDerWaalsContact CG2-SG 3.56Å; L717-C732 HydrophobicContact CB-CB 4.1Å; L717-C732 HydrophobicContact CD1-CB 3.92Å; M728-C732 PolarHBondContact O-N 3.29Å; M728-C732 PolarHBondContact O-SG 3.18Å; K729-C732 PolarHBondContact O-N 3.3Å; C732-H734 VanDerWaalsContact C-N 3.31Å; C732-H734 PolarHBondContact O-N 3.05Å; C732-I735 PolarHBondContact O-N 3.35Å; C732-I736 WeakPolarHBondContact O-CB 3.27Å; C732-I736 WeakPolarHBondContact O-CD1 3.43Å; C732-I736 WeakPolarHBondContact O-CG1 3.08Å; C732-I736 PolarHBondContact O-N 3.31Å
733	L	90.9	Very high	87.5	Confident	18 Å²	18	56.4 Å²	56.4	9%	0.094	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-42.8	177	-71	168	0	0	0	111.6	L717 K729 K730 I735 I736 V737 D759 I760	L717-L733 HydrophobicContact CD1-CD2 4.13Å; L717-L733 HydrophobicContact CD1-CG 3.98Å; L717-L733 HydrophobicContact CD2-CD2 4.32Å; K729-L733 HydrophobicContact CG-CD1 4.31Å; K729-L733 VanDerWaalsContact O-CG 3.29Å; K729-L733 WeakPolarHBondContact O-CG 3.28Å; K729-L733 PolarHBondContact O-N 2.95Å; K730-L733 PolarHBondContact O-N 3.37Å; L733-I735 PolarHBondContact O-N 2.95Å; L733-I736 PolarHBondContact O-N 3.01Å; L733-V737 WeakPolarHBondContact O-CB 3.48Å; L733-V737 WeakPolarHBondContact O-CG2 3.21Å; L733-V737 PolarHBondContact O-N 3.13Å; L733-D759 HydrophobicContact CD2-CB 4.38Å; L733-I760 HydrophobicContact CD2-CB 4.45Å; L733-I760 HydrophobicContact CD2-CG1 3.74Å
734	H	87.3	Confident	88	Confident	109 Å²	109	57.9 Å²	57.9	51%	0.505	28%	0.279	S	S	.	.	H	α-helix	trans	-58.7	-48.1	175.4	177.2	-87.1	0	0	0	112.4	K730 H731 C732 I736 V737 H738	K730-H734 PolarHBondContact O-N 2.96Å; H731-H734 WeakPolarHBondContact O-CB 3.39Å; H731-H734 PolarHBondContact O-N 3.24Å; C732-H734 VanDerWaalsContact C-N 3.31Å; C732-H734 PolarHBondContact O-N 3.05Å; H734-I736 PolarHBondContact O-N 3.37Å; H734-V737 PolarHBondContact O-N 3.45Å; H734-H738 AromaticContact CD2-CD2 3.78Å; H734-H738 AromaticContact CD2-NE2 3.94Å; H734-H738 AromaticContact CE1-CD2 3.41Å; H734-H738 PolarHBondContact CE1-CD2 3.09Å; H734-H738 VanDerWaalsContact CE1-CD2 3.41Å; H734-H738 AromaticContact CE1-NE2 3.71Å; H734-H738 AromaticContact ND1-CD2 3.82Å; H734-H738 AromaticContact NE2-CD2 3.39Å; H734-H738 PolarHBondContact NE2-CD2 2.76Å; H734-H738 AromaticContact NE2-NE2 3.31Å; H734-H738 PolarHBondContact NE2-NE2 2.75Å; H734-H738 PolarHBondContact O-CD2 2.88Å; H734-H738 PolarHBondContact O-N 3.03Å
735	I	87	Confident	88.4	Confident	30 Å²	30	60.8 Å²	60.8	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-44.9	176.1	-67.6	173.2	0	0	0	111	V708 V713 H731 C732 L733 V737 H738 Q739	V708-I735 HydrophobicContact CG1-CD1 3.62Å; V713-I735 HydrophobicContact CG2-CB 4.2Å; V713-I735 HydrophobicContact CG2-CG2 4.16Å; H731-I735 WeakPolarHBondContact NE2-CD1 3.35Å; H731-I735 PolarHBondContact O-N 3.45Å; H731-I735 VanDerWaalsContact O-N 3.07Å; C732-I735 PolarHBondContact O-N 3.35Å; L733-I735 PolarHBondContact O-N 2.95Å; I735-V737 VanDerWaalsContact C-N 3.34Å; I735-V737 PolarHBondContact O-N 3.49Å; I735-H738 PolarHBondContact O-N 2.98Å; I735-Q739 PolarHBondContact O-N 3.04Å
736	I	92.4	Very high	88.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59	-47.8	-179.4	-70.9	164.3	0	0	0	110.4	V713 L714 L717 C732 L733 H734 Q739 F740 V743 I760	V713-I736 HydrophobicContact CB-CG1 4.39Å; V713-I736 HydrophobicContact CG1-CD1 4.37Å; V713-I736 HydrophobicContact CG1-CG1 3.71Å; V713-I736 HydrophobicContact CG2-CD1 4.07Å; V713-I736 HydrophobicContact CG2-CG1 3.75Å; L714-I736 HydrophobicContact CD2-CD1 3.87Å; L714-I736 HydrophobicContact CD2-CG1 4.27Å; L717-I736 HydrophobicContact CD2-CD1 3.8Å; C732-I736 WeakPolarHBondContact O-CB 3.27Å; C732-I736 WeakPolarHBondContact O-CD1 3.43Å; C732-I736 WeakPolarHBondContact O-CG1 3.08Å; C732-I736 PolarHBondContact O-N 3.31Å; L733-I736 PolarHBondContact O-N 3.01Å; H734-I736 PolarHBondContact O-N 3.37Å; I736-Q739 CarbonylContact O-C 3.58Å; I736-Q739 PolarHBondContact O-N 3.36Å; I736-F740 HydrophobicContact CG2-CD2 4.12Å; I736-F740 WeakPolarHBondContact O-CA 3.5Å; I736-F740 VanDerWaalsContact O-CB 3.29Å; I736-F740 WeakPolarHBondContact O-CB 3.22Å; I736-F740 PolarHBondContact O-N 2.93Å; I736-V743 HydrophobicContact CG1-CG1 4.23Å; I736-V743 HydrophobicContact CG2-CG1 4.09Å; I736-I760 HydrophobicContact CD1-CD1 4.43Å; I736-I760 HydrophobicContact CD1-CG1 4.41Å; I736-I760 HydrophobicContact CG2-CG1 4.41Å; I736-I760 HydrophobicContact CG2-CG2 3.97Å
737	V	92.5	Very high	89.1	Confident	14 Å²	14	62.8 Å²	62.8	9%	0.085	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-47.1	-179.6	167.9	0	0	0	0	111.1	L733 H734 I735 Q739 F740 L764 H767	L733-V737 WeakPolarHBondContact O-CB 3.48Å; L733-V737 WeakPolarHBondContact O-CG2 3.21Å; L733-V737 PolarHBondContact O-N 3.13Å; H734-V737 PolarHBondContact O-N 3.45Å; I735-V737 VanDerWaalsContact C-N 3.34Å; I735-V737 PolarHBondContact O-N 3.49Å; V737-Q739 VanDerWaalsContact C-N 3.3Å; V737-Q739 PolarHBondContact O-N 2.81Å; V737-F740 PolarHBondContact O-N 3.41Å; V737-L764 HydrophobicContact CB-CD2 4.27Å; V737-L764 HydrophobicContact CG1-CD2 4.2Å; V737-L764 HydrophobicContact CG2-CD2 4Å; V737-L764 HydrophobicContact CG2-CG 4.06Å; V737-H767 HydrophobicContact CG1-CB 3.27Å; V737-H767 WeakPolarHBondContact CG1-CD2 3.35Å
738	H	87.8	Confident	89.3	Confident	97 Å²	97	63.1 Å²	63.1	45%	0.449	31%	0.308	S	S	.	.	H	α-helix	trans	-67.1	-26.6	179.7	-88.7	-78.7	0	0	0	114.3	H734 I735 H767	H734-H738 AromaticContact CD2-CD2 3.78Å; H734-H738 AromaticContact CD2-NE2 3.94Å; H734-H738 AromaticContact CE1-CD2 3.41Å; H734-H738 PolarHBondContact CE1-CD2 3.09Å; H734-H738 VanDerWaalsContact CE1-CD2 3.41Å; H734-H738 AromaticContact CE1-NE2 3.71Å; H734-H738 AromaticContact ND1-CD2 3.82Å; H734-H738 AromaticContact NE2-CD2 3.39Å; H734-H738 PolarHBondContact NE2-CD2 2.76Å; H734-H738 AromaticContact NE2-NE2 3.31Å; H734-H738 PolarHBondContact NE2-NE2 2.75Å; H734-H738 PolarHBondContact O-CD2 2.88Å; H734-H738 PolarHBondContact O-N 3.03Å; I735-H738 PolarHBondContact O-N 2.98Å; H738-H767 AromaticContact CE1-CE1 3.55Å; H738-H767 AromaticContact NE2-CE1 3.62Å
739	Q	90.3	Very high	89.6	Confident	77 Å²	77	64.4 Å²	64.4	36%	0.36	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	28.9	179.7	-63.8	-67.5	-57.1	0	0	112.3	V710 I735 I736 V737 I741 K742 V743	V710-Q739 HydrophobicContact CG2-CB 3.9Å; V710-Q739 HydrophobicContact CG2-CG 3.98Å; I735-Q739 PolarHBondContact O-N 3.04Å; I736-Q739 CarbonylContact O-C 3.58Å; I736-Q739 PolarHBondContact O-N 3.36Å; V737-Q739 VanDerWaalsContact C-N 3.3Å; V737-Q739 PolarHBondContact O-N 2.81Å; Q739-I741 VanDerWaalsContact C-N 3.27Å; Q739-I741 PolarHBondContact O-N 3.08Å; Q739-I741 VanDerWaalsContact O-N 3.11Å; Q739-K742 PolarHBondContact O-N 3.44Å; Q739-V743 PolarHBondContact O-N 3.16Å; Q739-V743 VanDerWaalsContact O-N 3.11Å
740	F	92.6	Very high	89.5	Confident	70 Å²	70	74.1 Å²	74.1	31%	0.307	35%	0.351	S	S	.	.	H	α-helix	trans	-58.4	-35.1	-167.9	-175.2	-109.5	0	0	0	113.8	I736 V737 K742 V743 S744 I760 L764	I736-F740 HydrophobicContact CG2-CD2 4.12Å; I736-F740 WeakPolarHBondContact O-CA 3.5Å; I736-F740 VanDerWaalsContact O-CB 3.29Å; I736-F740 WeakPolarHBondContact O-CB 3.22Å; I736-F740 PolarHBondContact O-N 2.93Å; V737-F740 PolarHBondContact O-N 3.41Å; F740-K742 PolarHBondContact O-N 3.15Å; F740-V743 PolarHBondContact O-N 2.9Å; F740-S744 WeakPolarHBondContact O-CB 3.42Å; F740-S744 PolarHBondContact O-N 3.03Å; F740-S744 PolarHBondContact O-OG 2.87Å; F740-I760 HydrophobicContact CE2-CG2 4.09Å; F740-L764 HydrophobicContact CB-CD2 3.92Å; F740-L764 HydrophobicContact CD1-CD1 4.27Å; F740-L764 HydrophobicContact CD1-CD2 4.15Å; F740-L764 HydrophobicContact CD2-CD1 3.73Å; F740-L764 HydrophobicContact CD2-CD2 3.91Å; F740-L764 HydrophobicContact CD2-CG 4.34Å; F740-L764 HydrophobicContact CE1-CD1 4.04Å; F740-L764 HydrophobicContact CE2-CD1 3.48Å; F740-L764 VanDerWaalsContact CE2-CD1 3.48Å; F740-L764 HydrophobicContact CG-CD1 4.12Å; F740-L764 HydrophobicContact CG-CD2 3.72Å; F740-L764 HydrophobicContact CZ-CD1 3.64Å
741	I	90.1	Very high	89.7	Confident	128 Å²	128	71.5 Å²	71.5	66%	0.656	35%	0.35	S	S	*	.	H	α-helix	trans	-60.7	-34.9	177.8	-60.6	173.7	0	0	0	111.7	Q739 S744 K745	Q739-I741 VanDerWaalsContact C-N 3.27Å; Q739-I741 PolarHBondContact O-N 3.08Å; Q739-I741 VanDerWaalsContact O-N 3.11Å; I741-S744 PolarHBondContact O-OG 2.94Å; I741-K745 WeakPolarHBondContact O-CG 3.4Å
742	K	91.9	Very high	90	Very high	121 Å²	121	69 Å²	69	53%	0.526	34%	0.339	S	S	.	.	H	α-helix	trans	-79.4	-46.7	177.2	-64.4	179.2	-176.5	162.5	0	110.5	V710 Q739 F740 S744 K745	V710-K742 HydrophobicContact CG1-CB 3.74Å; V710-K742 HydrophobicContact CG1-CD 4.47Å; Q739-K742 PolarHBondContact O-N 3.44Å; F740-K742 PolarHBondContact O-N 3.15Å; K742-S744 VanDerWaalsContact C-N 3.35Å; K742-S744 PolarHBondContact O-N 3.28Å; K742-K745 PolarHBondContact O-N 2.84Å
743	V	91.9	Very high	90.1	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-62.9	-39.8	-178.9	177.8	0	0	0	0	112	V710 V713 L714 I736 Q739 F740 K745 L746 L749	V710-V743 HydrophobicContact CG1-CG2 3.83Å; V713-V743 HydrophobicContact CG1-CG1 4.46Å; V713-V743 HydrophobicContact CG1-CG2 4.07Å; L714-V743 HydrophobicContact CD1-CG1 4.04Å; L714-V743 HydrophobicContact CD2-CG1 3.49Å; L714-V743 VanDerWaalsContact CD2-CG1 3.49Å; L714-V743 HydrophobicContact CG-CG1 3.87Å; I736-V743 HydrophobicContact CG1-CG1 4.23Å; I736-V743 HydrophobicContact CG2-CG1 4.09Å; Q739-V743 PolarHBondContact O-N 3.16Å; Q739-V743 VanDerWaalsContact O-N 3.11Å; F740-V743 PolarHBondContact O-N 2.9Å; V743-K745 PolarHBondContact O-N 2.99Å; V743-K745 VanDerWaalsContact O-N 3.13Å; V743-L746 HydrophobicContact CG1-CD1 4.27Å; V743-L746 VanDerWaalsContact O-CB 3.26Å; V743-L746 WeakPolarHBondContact O-CB 3.46Å; V743-L746 WeakPolarHBondContact O-CG 3.37Å; V743-L746 PolarHBondContact O-N 2.85Å; V743-L749 HydrophobicContact CG1-CD1 4.49Å
744	S	90.7	Very high	90.2	Very high	48 Å²	48	78.7 Å²	78.7	34%	0.336	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.6	-179.3	57	0	0	0	0	114.4	F740 I741 K742	F740-S744 WeakPolarHBondContact O-CB 3.42Å; F740-S744 PolarHBondContact O-N 3.03Å; F740-S744 PolarHBondContact O-OG 2.87Å; I741-S744 PolarHBondContact O-OG 2.94Å; K742-S744 VanDerWaalsContact C-N 3.35Å; K742-S744 PolarHBondContact O-N 3.28Å
745	K	92.1	Very high	90.4	Very high	166 Å²	166	79.3 Å²	79.3	72%	0.722	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-9.1	176	-64.8	177.2	-175.9	-179.1	0	112.9	I741 K742 V743	I741-K745 WeakPolarHBondContact O-CG 3.4Å; K742-K745 PolarHBondContact O-N 2.84Å; V743-K745 PolarHBondContact O-N 2.99Å; V743-K745 VanDerWaalsContact O-N 3.13Å
746	L	91.8	Very high	90.8	Very high	43 Å²	43	78 Å²	78	23%	0.225	39%	0.389	C	S	.	.	S	Bend	trans	-69.6	136.7	178.6	-63.6	173	0	0	0	110.1	V710 L714 V743 N748 L749	V710-L746 VanDerWaalsContact O-CD1 3.24Å; V710-L746 WeakPolarHBondContact O-CD1 3.21Å; L714-L746 HydrophobicContact CD1-CB 4.01Å; L714-L746 HydrophobicContact CD1-CD1 3.93Å; L714-L746 HydrophobicContact CG-CD1 4.29Å; V743-L746 HydrophobicContact CG1-CD1 4.27Å; V743-L746 VanDerWaalsContact O-CB 3.26Å; V743-L746 WeakPolarHBondContact O-CB 3.46Å; V743-L746 WeakPolarHBondContact O-CG 3.37Å; V743-L746 PolarHBondContact O-N 2.85Å; L746-N748 PolarHBondContact O-N 3.09Å; L746-L749 PolarHBondContact O-N 3Å
747	P	87.5	Confident	90.8	Very high	101 Å²	101	80.6 Å²	80.6	66%	0.656	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-62.3	-31.5	-178.6	24.5	-32.6	0	0	0	112.1	L749	P747-L749 VanDerWaalsContact C-N 3.26Å; P747-L749 PolarHBondContact O-N 2.78Å
748	N	86.9	Confident	90.8	Very high	62 Å²	62	85 Å²	85	33%	0.332	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-75.7	-9	-173.8	-57	-8.6	0	0	0	113.6	L714 L746 R750 S751	L714-N748 HydrophobicContact CD1-CB 4.48Å; L746-N748 PolarHBondContact O-N 3.09Å; N748-R750 PolarHBondContact O-N 2.93Å; N748-S751 PolarHBondContact O-N 3.15Å; N748-S751 PolarHBondContact O-OG 3.39Å
749	L	89.2	Confident	91	Very high	28 Å²	28	82.2 Å²	82.2	15%	0.147	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-62.8	-37.4	175.7	-170.1	79.7	0	0	0	111	L714 V743 L746 P747 S751 L752 L757 I760	L714-L749 HydrophobicContact CD1-CB 3.91Å; L714-L749 HydrophobicContact CD1-CD1 3.93Å; L714-L749 HydrophobicContact CD2-CD1 3.81Å; V743-L749 HydrophobicContact CG1-CD1 4.49Å; L746-L749 PolarHBondContact O-N 3Å; P747-L749 VanDerWaalsContact C-N 3.26Å; P747-L749 PolarHBondContact O-N 2.78Å; L749-S751 PolarHBondContact O-N 2.75Å; L749-L752 HydrophobicContact CD1-CD1 4.12Å; L749-L752 PolarHBondContact O-N 3.17Å; L749-L757 HydrophobicContact CD1-CD2 4.41Å; L749-L757 HydrophobicContact CG-CD2 4.23Å; L749-I760 HydrophobicContact CD1-CD1 4.22Å
750	R	87.5	Confident	91.2	Very high	237 Å²	237	78.8 Å²	78.8	89%	0.894	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-71.3	-16.9	-178.1	-61.4	-177.9	-177.3	-174.6	0.5	113.4	N748	N748-R750 PolarHBondContact O-N 2.93Å
751	S	89	Confident	91.1	Very high	86 Å²	86	80.6 Å²	80.6	60%	0.601	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-91	-4.7	178.9	55.2	0	0	0	0	113.5	N748 L749	N748-S751 PolarHBondContact O-N 3.15Å; N748-S751 PolarHBondContact O-OG 3.39Å; L749-S751 PolarHBondContact O-N 2.75Å
752	L	91.3	Very high	91.2	Very high	14 Å²	14	81 Å²	81	7%	0.073	41%	0.409	C	S	.	.	S	Bend	trans	-67.2	153.2	176.9	-69	-178.9	0	0	0	112	L714 E718 L749 L756 L757 I760	L714-L752 HydrophobicContact CD2-CD1 4.13Å; E718-L752 HydrophobicContact CB-CD2 4.38Å; L749-L752 HydrophobicContact CD1-CD1 4.12Å; L749-L752 PolarHBondContact O-N 3.17Å; L752-L756 HydrophobicContact CB-CB 4.41Å; L752-L756 HydrophobicContact CD2-CD1 4.25Å; L752-L757 HydrophobicContact CB-CD2 4.13Å; L752-L757 HydrophobicContact CB-CG 4.04Å; L752-L757 HydrophobicContact CD1-CD2 4.26Å; L752-I760 HydrophobicContact CD1-CD1 3.7Å
753	S	92.4	Very high	91.2	Very high	55 Å²	55	76.5 Å²	76.5	39%	0.385	39%	0.393	S	S	.	.			trans	-62	152.2	172.5	75	0	0	0	0	110.8	L755 L756 L757	S753-L755 PolarHBondContact O-N 3.02Å; S753-L756 PolarHBondContact O-N 2.82Å; S753-L756 VanDerWaalsContact O-N 3.16Å; S753-L756 WeakPolarHBondContact OG-CG 3.41Å; S753-L756 PolarHBondContact OG-N 3.17Å; S753-L757 PolarHBondContact O-N 2.95Å
754	Q	91.5	Very high	91.1	Very high	166 Å²	166	77.8 Å²	77.8	78%	0.776	40%	0.4	S	S	*	.	H	α-helix	trans	-57.3	-36.1	177	-71.1	-178.5	-7.2	0	0	111.9	L757 L758	Q754-L757 PolarHBondContact O-N 2.96Å; Q754-L758 VanDerWaalsContact O-CG 3.31Å; Q754-L758 WeakPolarHBondContact O-CG 3.33Å; Q754-L758 PolarHBondContact O-N 3.47Å
755	L	92.9	Very high	91	Very high	123 Å²	123	78.2 Å²	78.2	64%	0.644	41%	0.406	S	S	*	.	H	α-helix	trans	-62.6	-47.1	177	-66.4	172.5	0	0	0	111.8	S753 L757 L758 D759	S753-L755 PolarHBondContact O-N 3.02Å; L755-L757 VanDerWaalsContact C-N 3.32Å; L755-L757 PolarHBondContact O-N 2.71Å; L755-L758 WeakPolarHBondContact O-CB 3.16Å; L755-L758 PolarHBondContact O-N 2.95Å; L755-L758 VanDerWaalsContact O-N 3.16Å; L755-D759 PolarHBondContact O-N 2.87Å
756	L	93.5	Very high	90.8	Very high	1 Å²	1	74 Å²	74	1%	0.005	40%	0.395	C	S	.	.	H	α-helix	trans	-67.1	-33.8	178.8	-71.5	175.9	0	0	0	112.9	L717 E718 D721 L752 S753 L758 D759 I760	L717-L756 HydrophobicContact CD2-CD2 4.39Å; L717-L756 HydrophobicContact CG-CD2 4.15Å; E718-L756 HydrophobicContact CB-CD1 4.13Å; E718-L756 HydrophobicContact CG-CD1 4.15Å; D721-L756 HydrophobicContact CB-CD1 4.43Å; D721-L756 HydrophobicContact CB-CD2 3.83Å; L752-L756 HydrophobicContact CB-CB 4.41Å; L752-L756 HydrophobicContact CD2-CD1 4.25Å; S753-L756 PolarHBondContact O-N 2.82Å; S753-L756 VanDerWaalsContact O-N 3.16Å; S753-L756 WeakPolarHBondContact OG-CG 3.41Å; S753-L756 PolarHBondContact OG-N 3.17Å; L756-L758 VanDerWaalsContact C-N 3.34Å; L756-D759 PolarHBondContact O-N 2.89Å; L756-I760 WeakPolarHBondContact O-CG1 3.21Å; L756-I760 PolarHBondContact O-N 3.1Å
757	L	92.8	Very high	90.6	Very high	56 Å²	56	74.7 Å²	74.7	29%	0.293	40%	0.397	S	S	.	.	H	α-helix	trans	-65.3	-39	172.9	-70.7	173.5	0	0	0	111.7	L749 L752 S753 Q754 L755 I760 I761	L749-L757 HydrophobicContact CD1-CD2 4.41Å; L749-L757 HydrophobicContact CG-CD2 4.23Å; L752-L757 HydrophobicContact CB-CD2 4.13Å; L752-L757 HydrophobicContact CB-CG 4.04Å; L752-L757 HydrophobicContact CD1-CD2 4.26Å; S753-L757 PolarHBondContact O-N 2.95Å; Q754-L757 PolarHBondContact O-N 2.96Å; L755-L757 VanDerWaalsContact C-N 3.32Å; L755-L757 PolarHBondContact O-N 2.71Å; L757-I760 PolarHBondContact O-N 2.91Å; L757-I761 WeakPolarHBondContact O-CD1 3.33Å; L757-I761 VanDerWaalsContact O-CG1 3.26Å; L757-I761 WeakPolarHBondContact O-CG1 3.01Å; L757-I761 PolarHBondContact O-N 3.31Å
758	L	92.9	Very high	90.4	Very high	105 Å²	105	74.2 Å²	74.2	55%	0.55	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-45.7	173.7	-71	169.7	0	0	0	111.1	Q754 L755 L756 I760 I761 E762	Q754-L758 VanDerWaalsContact O-CG 3.31Å; Q754-L758 WeakPolarHBondContact O-CG 3.33Å; Q754-L758 PolarHBondContact O-N 3.47Å; L755-L758 WeakPolarHBondContact O-CB 3.16Å; L755-L758 PolarHBondContact O-N 2.95Å; L755-L758 VanDerWaalsContact O-N 3.16Å; L756-L758 VanDerWaalsContact C-N 3.34Å; L758-I760 VanDerWaalsContact C-N 3.27Å; L758-I760 PolarHBondContact O-N 3.01Å; L758-I761 PolarHBondContact O-N 2.73Å; L758-I761 VanDerWaalsContact O-N 3.08Å; L758-E762 WeakPolarHBondContact O-CB 3.16Å; L758-E762 PolarHBondContact O-N 3.19Å
759	D	92.5	Very high	90.1	Very high	40 Å²	40	74.2 Å²	74.2	21%	0.214	39%	0.392	C	S	.	.	H	α-helix	trans	-57.7	-40.3	176.8	-68.3	-18.4	0	0	0	112.2	K729 L733 L755 L756 S763	K729-D759 WeakPolarHBondContact CE-OD2 2.83Å; K729-D759 IonicContact NZ-OD2 3.79Å; K729-D759 PolarHBondContact NZ-OD2 3.16Å; L733-D759 HydrophobicContact CD2-CB 4.38Å; L755-D759 PolarHBondContact O-N 2.87Å; L756-D759 PolarHBondContact O-N 2.89Å; D759-S763 WeakPolarHBondContact O-CB 3.38Å; D759-S763 PolarHBondContact O-N 3.19Å; D759-S763 PolarHBondContact O-OG 2.98Å
760	I	93.3	Very high	89.7	Confident	5 Å²	5	77.8 Å²	77.8	3%	0.026	41%	0.412	C	S	.	.	H	α-helix	trans	-64.5	-46.2	175.2	-70.1	161.6	0	0	0	110.8	L717 L733 I736 F740 L749 L752 L756 L757 L758 E762 S763 L764	L717-I760 HydrophobicContact CD2-CD1 3.81Å; L717-I760 HydrophobicContact CD2-CG1 4Å; L733-I760 HydrophobicContact CD2-CB 4.45Å; L733-I760 HydrophobicContact CD2-CG1 3.74Å; I736-I760 HydrophobicContact CD1-CD1 4.43Å; I736-I760 HydrophobicContact CD1-CG1 4.41Å; I736-I760 HydrophobicContact CG2-CG1 4.41Å; I736-I760 HydrophobicContact CG2-CG2 3.97Å; F740-I760 HydrophobicContact CE2-CG2 4.09Å; L749-I760 HydrophobicContact CD1-CD1 4.22Å; L752-I760 HydrophobicContact CD1-CD1 3.7Å; L756-I760 WeakPolarHBondContact O-CG1 3.21Å; L756-I760 PolarHBondContact O-N 3.1Å; L757-I760 PolarHBondContact O-N 2.91Å; L758-I760 VanDerWaalsContact C-N 3.27Å; L758-I760 PolarHBondContact O-N 3.01Å; I760-E762 VanDerWaalsContact C-N 3.34Å; I760-S763 PolarHBondContact O-N 2.73Å; I760-L764 HydrophobicContact CG2-CD1 3.85Å; I760-L764 HydrophobicContact CG2-CG 4.44Å; I760-L764 WeakPolarHBondContact O-CB 3.33Å; I760-L764 VanDerWaalsContact O-CG 3.29Å; I760-L764 WeakPolarHBondContact O-CG 3.28Å; I760-L764 PolarHBondContact O-N 3.12Å
761	I	91.8	Very high	89.1	Confident	107 Å²	107	72.3 Å²	72.3	55%	0.549	39%	0.394	S	S	.	.	H	α-helix	trans	-62.8	-43.3	179.7	-69.2	164.7	0	0	0	110.8	L757 L758 L764 A765	L757-I761 WeakPolarHBondContact O-CD1 3.33Å; L757-I761 VanDerWaalsContact O-CG1 3.26Å; L757-I761 WeakPolarHBondContact O-CG1 3.01Å; L757-I761 PolarHBondContact O-N 3.31Å; L758-I761 PolarHBondContact O-N 2.73Å; L758-I761 VanDerWaalsContact O-N 3.08Å; I761-L764 PolarHBondContact O-N 3.43Å; I761-A765 PolarHBondContact O-N 3.18Å
762	E	91.9	Very high	88.4	Confident	136 Å²	136	73.5 Å²	73.5	64%	0.636	39%	0.39	S	S	*	.	H	α-helix	trans	-64.1	-42.6	179.1	-150.4	171.4	-140.8	0	0	110.9	L758 I760 L764 A765 T766	L758-E762 WeakPolarHBondContact O-CB 3.16Å; L758-E762 PolarHBondContact O-N 3.19Å; I760-E762 VanDerWaalsContact C-N 3.34Å; E762-L764 PolarHBondContact O-N 2.87Å; E762-A765 PolarHBondContact O-N 3.13Å; E762-T766 PolarHBondContact O-N 2.95Å; E762-T766 VanDerWaalsContact O-N 3.08Å; E762-T766 PolarHBondContact O-OG1 3.26Å
763	S	91.4	Very high	87.1	Confident	28 Å²	28	76.3 Å²	76.3	20%	0.196	41%	0.41	C	S	.	.	H	α-helix	trans	-67.1	-31.8	175.2	-58.4	0	0	0	0	113.6	D759 I760 T766 H767	D759-S763 WeakPolarHBondContact O-CB 3.38Å; D759-S763 PolarHBondContact O-N 3.19Å; D759-S763 PolarHBondContact O-OG 2.98Å; I760-S763 PolarHBondContact O-N 2.73Å; S763-T766 WeakPolarHBondContact CA-OG1 3.42Å; S763-T766 PolarHBondContact O-OG1 3.42Å; S763-H767 WeakPolarHBondContact O-CB 3.21Å; S763-H767 PolarHBondContact O-N 2.76Å
764	L	90	Very high	85.7	Confident	27 Å²	27	76.8 Å²	76.8	14%	0.141	42%	0.417	C	S	.	.	H	α-helix	trans	-69.5	-42.2	172.7	-76.5	162.7	0	0	0	111.2	V737 F740 I760 I761 E762 H767 I768	V737-L764 HydrophobicContact CB-CD2 4.27Å; V737-L764 HydrophobicContact CG1-CD2 4.2Å; V737-L764 HydrophobicContact CG2-CD2 4Å; V737-L764 HydrophobicContact CG2-CG 4.06Å; F740-L764 HydrophobicContact CB-CD2 3.92Å; F740-L764 HydrophobicContact CD1-CD1 4.27Å; F740-L764 HydrophobicContact CD1-CD2 4.15Å; F740-L764 HydrophobicContact CD2-CD1 3.73Å; F740-L764 HydrophobicContact CD2-CD2 3.91Å; F740-L764 HydrophobicContact CD2-CG 4.34Å; F740-L764 HydrophobicContact CE1-CD1 4.04Å; F740-L764 HydrophobicContact CE2-CD1 3.48Å; F740-L764 VanDerWaalsContact CE2-CD1 3.48Å; F740-L764 HydrophobicContact CG-CD1 4.12Å; F740-L764 HydrophobicContact CG-CD2 3.72Å; F740-L764 HydrophobicContact CZ-CD1 3.64Å; I760-L764 HydrophobicContact CG2-CD1 3.85Å; I760-L764 HydrophobicContact CG2-CG 4.44Å; I760-L764 WeakPolarHBondContact O-CB 3.33Å; I760-L764 VanDerWaalsContact O-CG 3.29Å; I760-L764 WeakPolarHBondContact O-CG 3.28Å; I760-L764 PolarHBondContact O-N 3.12Å; I761-L764 PolarHBondContact O-N 3.43Å; E762-L764 PolarHBondContact O-N 2.87Å; L764-H767 PolarHBondContact O-N 3.24Å; L764-I768 WeakPolarHBondContact O-CD1 3.49Å; L764-I768 VanDerWaalsContact O-CG1 3.24Å; L764-I768 WeakPolarHBondContact O-CG1 3.24Å; L764-I768 PolarHBondContact O-N 2.93Å
765	A	88.1	Confident	84.4	Confident	56 Å²	56	73.8 Å²	73.8	46%	0.463	40%	0.403	S	S	.	.	H	α-helix	trans	-62.3	-44.1	179.7	0	0	0	0	0	111.5	I761 E762 I768 S769	I761-A765 PolarHBondContact O-N 3.18Å; E762-A765 PolarHBondContact O-N 3.13Å; A765-I768 PolarHBondContact O-N 2.89Å; A765-S769 WeakPolarHBondContact O-CB 3.49Å; A765-S769 PolarHBondContact O-N 2.92Å
766	T	88.1	Confident	82.6	Confident	79 Å²	79	73.8 Å²	73.8	49%	0.485	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-46.5	175.8	50.9	0	0	0	0	111.7	E762 S763 I768 S769 D770	E762-T766 PolarHBondContact O-N 2.95Å; E762-T766 VanDerWaalsContact O-N 3.08Å; E762-T766 PolarHBondContact O-OG1 3.26Å; S763-T766 WeakPolarHBondContact CA-OG1 3.42Å; S763-T766 PolarHBondContact O-OG1 3.42Å; T766-I768 PolarHBondContact O-N 2.83Å; T766-S769 WeakPolarHBondContact O-CB 3.35Å; T766-S769 PolarHBondContact O-N 3.2Å; T766-D770 PolarHBondContact O-N 3.39Å
767	H	87.3	Confident	80.7	Confident	57 Å²	57	76 Å²	76	26%	0.264	42%	0.424	S	S	.	.	H	α-helix	trans	-64	-37.3	178.8	-176	74.5	0	0	0	114	V737 H738 S763 L764 D770 K771	V737-H767 HydrophobicContact CG1-CB 3.27Å; V737-H767 WeakPolarHBondContact CG1-CD2 3.35Å; H738-H767 AromaticContact CE1-CE1 3.55Å; H738-H767 AromaticContact NE2-CE1 3.62Å; S763-H767 WeakPolarHBondContact O-CB 3.21Å; S763-H767 PolarHBondContact O-N 2.76Å; L764-H767 PolarHBondContact O-N 3.24Å; H767-D770 PolarHBondContact O-N 2.75Å; H767-K771 WeakPolarHBondContact O-CB 3.46Å; H767-K771 PolarHBondContact O-N 3.28Å
768	I	84.2	Confident	78.7	Confident	91 Å²	91	77.4 Å²	77.4	47%	0.467	44%	0.439	S	S	.	.	H	α-helix	trans	-64.8	-43.8	174.4	-68.6	164.8	0	0	0	110.2	L764 A765 T766 K771 Q772	L764-I768 WeakPolarHBondContact O-CD1 3.49Å; L764-I768 VanDerWaalsContact O-CG1 3.24Å; L764-I768 WeakPolarHBondContact O-CG1 3.24Å; L764-I768 PolarHBondContact O-N 2.93Å; A765-I768 PolarHBondContact O-N 2.89Å; T766-I768 PolarHBondContact O-N 2.83Å; I768-K771 PolarHBondContact O-N 2.86Å; I768-Q772 HydrophobicContact CG2-CG 4.49Å; I768-Q772 WeakPolarHBondContact O-CB 3.35Å; I768-Q772 WeakPolarHBondContact O-CG 3.37Å; I768-Q772 PolarHBondContact O-N 3.02Å
769	S	81.4	Confident	76.5	Confident	61 Å²	61	79.5 Å²	79.5	43%	0.427	45%	0.451	S	S	.	.	H	α-helix	trans	-60	-45.9	176.4	-175.8	0	0	0	0	111.7	A765 T766 K771 Q772 C773	A765-S769 WeakPolarHBondContact O-CB 3.49Å; A765-S769 PolarHBondContact O-N 2.92Å; T766-S769 WeakPolarHBondContact O-CB 3.35Å; T766-S769 PolarHBondContact O-N 3.2Å; S769-K771 PolarHBondContact O-N 2.81Å; S769-Q772 PolarHBondContact O-N 3.48Å; S769-C773 PolarHBondContact O-N 3.27Å; S769-C773 PolarHBondContact O-SG 2.92Å
770	D	78.9	Confident	74.1	Confident	104 Å²	104	87.3 Å²	87.3	56%	0.556	49%	0.49	S	S	*	.	H	α-helix	trans	-64.3	-41.5	179.4	-70.6	-16.7	0	0	0	111.8	T766 H767 C773 A774	T766-D770 PolarHBondContact O-N 3.39Å; H767-D770 PolarHBondContact O-N 2.75Å; D770-C773 PolarHBondContact O-N 3.4Å; D770-A774 WeakPolarHBondContact O-CB 3.46Å; D770-A774 PolarHBondContact O-N 3.21Å
771	K	76.1	Confident	73.2	Confident	121 Å²	121	91.4 Å²	91.4	53%	0.526	51%	0.514	S	S	.	.	H	α-helix	trans	-66.3	-40.9	177.6	-164.8	-178.9	179.8	-167.4	0	112.1	H767 I768 S769 A774 E775	H767-K771 WeakPolarHBondContact O-CB 3.46Å; H767-K771 PolarHBondContact O-N 3.28Å; I768-K771 PolarHBondContact O-N 2.86Å; S769-K771 PolarHBondContact O-N 2.81Å; K771-A774 PolarHBondContact O-N 2.96Å; K771-E775 VanDerWaalsContact CE-OE1 3.29Å; K771-E775 WeakPolarHBondContact CE-OE1 3.35Å; K771-E775 WeakPolarHBondContact O-CG 3.46Å; K771-E775 PolarHBondContact O-N 2.99Å
772	Q	73.1	Confident	72.2	Confident	112 Å²	112	90.6 Å²	90.6	52%	0.523	51%	0.512	S	S	.	.	H	α-helix	trans	-64.6	-38.7	174.3	-73.8	176.4	-9.4	0	0	111.9	I768 S769 E775 M776	I768-Q772 HydrophobicContact CG2-CG 4.49Å; I768-Q772 WeakPolarHBondContact O-CB 3.35Å; I768-Q772 WeakPolarHBondContact O-CG 3.37Å; I768-Q772 PolarHBondContact O-N 3.02Å; S769-Q772 PolarHBondContact O-N 3.48Å; Q772-E775 PolarHBondContact O-N 2.74Å; Q772-M776 WeakPolarHBondContact O-CB 3.05Å; Q772-M776 WeakPolarHBondContact O-CE 3.45Å; Q772-M776 VanDerWaalsContact O-CG 3.32Å; Q772-M776 WeakPolarHBondContact O-CG 3.46Å; Q772-M776 PolarHBondContact O-N 3.4Å
773	C	64.2	Low	71.1	Confident	72 Å²	72	88.1 Å²	88.1	49%	0.486	51%	0.505	S	S	.	.	H	α-helix	trans	-65.7	-38.7	174	-68.7	0	0	0	0	112.3	S769 D770 G777	S769-C773 PolarHBondContact O-N 3.27Å; S769-C773 PolarHBondContact O-SG 2.92Å; D770-C773 PolarHBondContact O-N 3.4Å; C773-G777 PolarHBondContact O-N 3.29Å
774	A	64.4	Low	69.9	Low	65 Å²	65	91.6 Å²	91.6	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-66.9	-41.4	176.2	0	0	0	0	0	112.4	D770 K771 G777 S778	D770-A774 WeakPolarHBondContact O-CB 3.46Å; D770-A774 PolarHBondContact O-N 3.21Å; K771-A774 PolarHBondContact O-N 2.96Å; A774-G777 PolarHBondContact O-N 3.15Å; A774-S778 PolarHBondContact O-N 3.03Å; A774-S778 PolarHBondContact O-OG 2.98Å
775	E	64.1	Low	68.6	Low	104 Å²	104	95.6 Å²	95.6	49%	0.486	55%	0.547	S	S	.	.	H	α-helix	trans	-67.7	-37.3	176.8	-72.8	173.8	-175.5	0	0	111.8	K771 Q772 G777 S778	K771-E775 VanDerWaalsContact CE-OE1 3.29Å; K771-E775 WeakPolarHBondContact CE-OE1 3.35Å; K771-E775 WeakPolarHBondContact O-CG 3.46Å; K771-E775 PolarHBondContact O-N 2.99Å; Q772-E775 PolarHBondContact O-N 2.74Å; E775-G777 VanDerWaalsContact C-N 3.35Å; E775-S778 PolarHBondContact O-N 3.3Å; E775-S778 PolarHBondContact O-OG 3.2Å
776	M	55.4	Low	67.3	Low	123 Å²	123	98.3 Å²	98.3	61%	0.606	55%	0.552	S	S	*	*	H	α-helix	trans	-71.1	-26.6	173.1	-71.4	-173.9	-62.6	0	0	113.6	Q772	Q772-M776 WeakPolarHBondContact O-CB 3.05Å; Q772-M776 WeakPolarHBondContact O-CE 3.45Å; Q772-M776 VanDerWaalsContact O-CG 3.32Å; Q772-M776 WeakPolarHBondContact O-CG 3.46Å; Q772-M776 PolarHBondContact O-N 3.4Å
777	G	53	Low	65.9	Low	47 Å²	47	99.6 Å²	99.6	49%	0.485	56%	0.557	S	S	.	*	H	α-helix	trans	-81.1	-17	176.6	0	0	0	0	0	114.5	C773 A774 E775	C773-G777 PolarHBondContact O-N 3.29Å; A774-G777 PolarHBondContact O-N 3.15Å; E775-G777 VanDerWaalsContact C-N 3.35Å
778	S	50.1	Low	64.2	Low	86 Å²	86	102.9 Å²	102.9	60%	0.601	58%	0.58	S	S	*	*	S	Bend	trans	-86.8	-11.2	173.9	51.5	0	0	0	0	114.4	A774 E775	A774-S778 PolarHBondContact O-N 3.03Å; A774-S778 PolarHBondContact O-OG 2.98Å; E775-S778 PolarHBondContact O-N 3.3Å; E775-S778 PolarHBondContact O-OG 3.2Å
779	D	46.7	Very low	62.5	Low	149 Å²	149	103.9 Å²	103.9	80%	0.797	59%	0.589	S	S	*	*			trans	-100.2	10.3	176.7	-78.7	-20.4	0	0	0	113
780	I	43.1	Very low	60.8	Low	203 Å²	203	107.8 Å²	107.8	100%	1.041	60%	0.604	S	S	*	*			trans	-114.8	0	169.3	-57.6	174.5	0	0	0	108

Retrieved 780 of 780 residues in 291.6 ms (Link to these results)

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