A0A3B3TKZ6_9TELE Loading...

Kelch-like family, member 42

AlphaFold DB , UniProt , Accession A0A3B3TKZ6, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 470 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	36.8	Very low	74	Confident	249 Å²	249	71.6 Å²	71.6	100%	1.227	42%	0.423	S	S	*	.				0	87.9	0	-71.8	175	157.5	0	0	106.7
2	S	41.5	Very low	75	Confident	122 Å²	122	74.5 Å²	74.5	85%	0.853	44%	0.435	S	S	*	.			trans	-78.7	131.5	176	77.2	0	0	0	0	107.8
3	A	50.1	Low	75.7	Confident	90 Å²	90	81.6 Å²	81.6	74%	0.744	47%	0.47	S	S	*	.			trans	-52.4	144.4	176	0	0	0	0	0	110.3	Q5	A3-Q5 VanDerWaalsContact C-N 3.33Å; A3-Q5 PolarHBondContact O-N 3.23Å
4	D	65.1	Low	76.8	Confident	117 Å²	117	85 Å²	85	63%	0.626	47%	0.471	S	S	*	.			trans	-58.9	95.8	170.4	-86.9	-34.7	0	0	0	108.6	V6 N19	D4-V6 PolarHBondContact O-N 3.02Å; D4-V6 VanDerWaalsContact O-N 3.11Å; D4-N19 VanDerWaalsContact CB-ND2 3.34Å; D4-N19 WeakPolarHBondContact CB-ND2 3.43Å; D4-N19 PolarHBondContact OD1-ND2 3.4Å
5	Q	82	Confident	77.8	Confident	88 Å²	88	85.3 Å²	85.3	41%	0.411	48%	0.476	S	S	.	.			trans	-67	112.3	177.6	-170.4	176.6	13.5	0	0	107.8	A3 K20 D44	A3-Q5 VanDerWaalsContact C-N 3.33Å; A3-Q5 PolarHBondContact O-N 3.23Å; Q5-K20 HydrophobicContact CB-CB 4.27Å; Q5-K20 HydrophobicContact CB-CD 4.32Å; Q5-K20 HydrophobicContact CG-CD 4.31Å; Q5-K20 WeakPolarHBondContact O-CB 3.49Å; Q5-K20 PolarHBondContact O-N 2.95Å; Q5-D44 PolarHBondContact NE2-OD1 3.38Å
6	V	87.5	Confident	78.7	Confident	74 Å²	74	82.4 Å²	82.4	45%	0.448	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	135.6	173.8	-179.1	0	0	0	0	107.9	D4 E17 V18	D4-V6 PolarHBondContact O-N 3.02Å; D4-V6 VanDerWaalsContact O-N 3.11Å; V6-E17 HydrophobicContact CG1-CB 3.7Å; V6-E17 HydrophobicContact CG1-CG 4.13Å; V6-V18 WeakPolarHBondContact CA-O 3.36Å
7	I	89.4	Confident	79.4	Confident	1 Å²	1	87.1 Å²	87.1	1%	0.005	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.1	177.2	-64.1	-176	0	0	0	108.7	V18 K20 Y34 D44 V46	I7-V18 PolarHBondContact N-O 3.26Å; I7-V18 PolarHBondContact O-N 3.02Å; I7-K20 HydrophobicContact CD1-CB 3.74Å; I7-K20 HydrophobicContact CD1-CD 3.55Å; I7-K20 HydrophobicContact CD1-CG 3.53Å; I7-K20 HydrophobicContact CG1-CB 4.07Å; I7-K20 HydrophobicContact CG1-CD 4.44Å; I7-K20 HydrophobicContact CG1-CG 4.39Å; I7-Y34 HydrophobicContact CD1-CE1 3.72Å; I7-Y34 HydrophobicContact CD1-CE2 4.26Å; I7-Y34 VanDerWaalsContact CD1-CZ 3.45Å; I7-Y34 WeakPolarHBondContact CD1-OH 3.41Å; I7-D44 WeakPolarHBondContact CG2-O 3.41Å; I7-V46 HydrophobicContact CG2-CG2 4.37Å
8	A	90.3	Very high	80	Confident	24 Å²	24	82.4 Å²	82.4	20%	0.198	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.1	173.2	0	0	0	0	0	110.9	T15 Y16 D44 S45 V46	A8-T15 HydrophobicContact CB-CG2 3.78Å; A8-Y16 WeakPolarHBondContact CA-O 3.36Å; A8-D44 PolarHBondContact N-O 3.41Å; A8-S45 CarbonylContact O-C 3.59Å; A8-S45 WeakPolarHBondContact O-CA 3.46Å; A8-V46 PolarHBondContact O-N 3.16Å
9	I	90.9	Very high	80.5	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122	167.2	-61.4	177.6	0	0	0	107.8	V11 T15 Y16 V18 L23 F30 L48 L56 L60	I9-V11 HydrophobicContact CG2-CG2 4.44Å; I9-T15 CarbonylContact O-C 3.49Å; I9-T15 WeakPolarHBondContact O-CA 3.42Å; I9-Y16 PolarHBondContact N-O 3.34Å; I9-Y16 PolarHBondContact O-N 3.37Å; I9-V18 HydrophobicContact CD1-CB 4.46Å; I9-V18 HydrophobicContact CD1-CG2 3.99Å; I9-V18 HydrophobicContact CG1-CG2 4.44Å; I9-L23 HydrophobicContact CD1-CD1 3.99Å; I9-L23 HydrophobicContact CD1-CD2 3.9Å; I9-F30 HydrophobicContact CD1-CE2 4.4Å; I9-F30 HydrophobicContact CD1-CZ 3.87Å; I9-L48 HydrophobicContact CG2-CD1 3.65Å; I9-L48 HydrophobicContact CG2-CG 4.27Å; I9-L56 HydrophobicContact CG2-CD2 4.15Å; I9-L60 HydrophobicContact CD1-CD2 3.83Å
10	V	90	Very high	80.9	Confident	23 Å²	23	77 Å²	77	14%	0.139	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	122.6	-178.7	-171.7	0	0	0	0	109.4	R14 T15 V46 Q47 L48	V10-R14 WeakPolarHBondContact CA-O 3.4Å; V10-T15 HydrophobicContact CG2-CG2 4.24Å; V10-V46 PolarHBondContact N-O 3.47Å; V10-Q47 WeakPolarHBondContact O-CA 3.26Å; V10-L48 PolarHBondContact O-N 3.2Å
11	V	90.7	Very high	81.3	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.6	172.7	176.2	0	0	0	0	108.5	I9 D13 R14 L48 V53 L56	I9-V11 HydrophobicContact CG2-CG2 4.44Å; V11-D13 PolarHBondContact O-N 2.7Å; V11-D13 VanDerWaalsContact O-N 3.15Å; V11-R14 PolarHBondContact N-O 3.14Å; V11-R14 PolarHBondContact O-N 2.59Å; V11-L48 HydrophobicContact CG2-CB 3.74Å; V11-L48 HydrophobicContact CG2-CD1 4.29Å; V11-L48 HydrophobicContact CG2-CG 4.44Å; V11-V53 HydrophobicContact CG1-CG2 4.27Å; V11-L56 HydrophobicContact CB-CD2 4Å; V11-L56 HydrophobicContact CG2-CD2 3.48Å; V11-L56 VanDerWaalsContact CG2-CD2 3.48Å
12	D	85.9	Confident	83.9	Confident	106 Å²	106	72.2 Å²	72.2	57%	0.567	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	-116.4	-168.8	-56.6	-31.1	0	0	0	110.7
13	D	84.3	Confident	86.3	Confident	167 Å²	167	66.4 Å²	66.4	89%	0.893	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	7.9	179.5	-64.4	-38.1	0	0	0	113.7	V11	V11-D13 PolarHBondContact O-N 2.7Å; V11-D13 VanDerWaalsContact O-N 3.15Å
14	R	90.4	Very high	88.2	Confident	129 Å²	129	64.5 Å²	64.5	49%	0.487	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	141.3	-178.4	-64.4	-168.5	-175.4	-169.4	3.5	111.9	V10 V11 Y16 E57	V10-R14 WeakPolarHBondContact CA-O 3.4Å; V11-R14 PolarHBondContact N-O 3.14Å; V11-R14 PolarHBondContact O-N 2.59Å; R14-Y16 HydrophobicContact CB-CE2 3.69Å; R14-Y16 WeakPolarHBondContact CD-OH 3.26Å; R14-E57 IonicContact NH1-OE1 2.97Å; R14-E57 PolarHBondContact NH1-OE1 2.95Å
15	T	91.9	Very high	89.5	Confident	89 Å²	89	64.6 Å²	64.6	55%	0.546	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.9	177.5	-56.9	0	0	0	0	110.3	A8 I9 V10	A8-T15 HydrophobicContact CB-CG2 3.78Å; I9-T15 CarbonylContact O-C 3.49Å; I9-T15 WeakPolarHBondContact O-CA 3.42Å; V10-T15 HydrophobicContact CG2-CG2 4.24Å
16	Y	92	Very high	89.9	Confident	40 Å²	40	63 Å²	63	16%	0.157	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125.2	-179.8	-59	-89.4	0	0	0	110.3	A8 I9 R14 V53 L56 E57 L60	A8-Y16 WeakPolarHBondContact CA-O 3.36Å; I9-Y16 PolarHBondContact N-O 3.34Å; I9-Y16 PolarHBondContact O-N 3.37Å; R14-Y16 HydrophobicContact CB-CE2 3.69Å; R14-Y16 WeakPolarHBondContact CD-OH 3.26Å; Y16-V53 WeakPolarHBondContact OH-CG1 2.77Å; Y16-L56 HydrophobicContact CD2-CD2 3.92Å; Y16-L56 HydrophobicContact CE2-CD2 3.89Å; Y16-E57 HydrophobicContact CE1-CG 3.71Å; Y16-E57 WeakPolarHBondContact OH-CG 3.36Å; Y16-E57 PolarHBondContact OH-OE1 3.24Å; Y16-L60 HydrophobicContact CD1-CD1 4.19Å; Y16-L60 HydrophobicContact CD2-CD1 4.34Å; Y16-L60 HydrophobicContact CG-CD1 3.81Å
17	E	90.5	Very high	90.3	Very high	161 Å²	161	59.4 Å²	59.4	75%	0.752	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	121	175.6	-73.2	-171.9	177.7	0	0	110.8	V6	V6-E17 HydrophobicContact CG1-CB 3.7Å; V6-E17 HydrophobicContact CG1-CG 4.13Å
18	V	90.3	Very high	90.5	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.024	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145	-173.7	-165	0	0	0	0	111	V6 I7 I9 K20 L23 L60	V6-V18 WeakPolarHBondContact CA-O 3.36Å; I7-V18 PolarHBondContact N-O 3.26Å; I7-V18 PolarHBondContact O-N 3.02Å; I9-V18 HydrophobicContact CD1-CB 4.46Å; I9-V18 HydrophobicContact CD1-CG2 3.99Å; I9-V18 HydrophobicContact CG1-CG2 4.44Å; V18-K20 PolarHBondContact O-N 3.42Å; V18-L23 HydrophobicContact CB-CD1 3.9Å; V18-L23 HydrophobicContact CB-CG 4.35Å; V18-L23 HydrophobicContact CG1-CD1 3.86Å; V18-L23 HydrophobicContact CG1-CD2 4.1Å; V18-L23 HydrophobicContact CG1-CG 3.75Å; V18-L60 HydrophobicContact CG1-CD2 4.34Å; V18-L60 HydrophobicContact CG2-CD1 3.95Å; V18-L60 HydrophobicContact CG2-CD2 3.93Å; V18-L60 HydrophobicContact CG2-CG 4.47Å
19	N	90.3	Very high	90.6	Very high	23 Å²	23	63.7 Å²	63.7	12%	0.123	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	119.2	176.2	-177.7	-65.8	0	0	0	111.1	D4 K21 K22 L23	D4-N19 VanDerWaalsContact CB-ND2 3.34Å; D4-N19 WeakPolarHBondContact CB-ND2 3.43Å; D4-N19 PolarHBondContact OD1-ND2 3.4Å; N19-K21 VanDerWaalsContact C-N 3.28Å; N19-K21 PolarHBondContact O-N 2.76Å; N19-K21 WeakPolarHBondContact OD1-CA 3.29Å; N19-K21 VanDerWaalsContact OD1-CB 3.26Å; N19-K21 WeakPolarHBondContact OD1-CB 3.45Å; N19-K21 PolarHBondContact OD1-N 3.4Å; N19-K22 HydrophobicContact CB-CB 4.28Å; N19-K22 HydrophobicContact CB-CD 4.22Å; N19-K22 HydrophobicContact CB-CG 4.09Å; N19-K22 PolarHBondContact O-N 2.96Å; N19-K22 PolarHBondContact OD1-N 2.85Å; N19-K22 VanDerWaalsContact OD1-N 3.12Å; N19-L23 PolarHBondContact O-N 3.16Å; N19-L23 VanDerWaalsContact O-N 3.16Å
20	K	88.7	Confident	90.6	Very high	33 Å²	33	63.7 Å²	63.7	14%	0.143	30%	0.304	C	S	.	.	H	α-helix	trans	-54.7	-41	-179.2	-175.6	-179.9	-160	157.8	0	113.1	Q5 I7 V18 L23 I24 Y34	Q5-K20 HydrophobicContact CB-CB 4.27Å; Q5-K20 HydrophobicContact CB-CD 4.32Å; Q5-K20 HydrophobicContact CG-CD 4.31Å; Q5-K20 WeakPolarHBondContact O-CB 3.49Å; Q5-K20 PolarHBondContact O-N 2.95Å; I7-K20 HydrophobicContact CD1-CB 3.74Å; I7-K20 HydrophobicContact CD1-CD 3.55Å; I7-K20 HydrophobicContact CD1-CG 3.53Å; I7-K20 HydrophobicContact CG1-CB 4.07Å; I7-K20 HydrophobicContact CG1-CD 4.44Å; I7-K20 HydrophobicContact CG1-CG 4.39Å; V18-K20 PolarHBondContact O-N 3.42Å; K20-L23 PolarHBondContact O-N 2.9Å; K20-I24 HydrophobicContact CD-CD1 4.48Å; K20-I24 HydrophobicContact CG-CD1 3.86Å; K20-I24 WeakPolarHBondContact O-CG1 3.22Å; K20-I24 PolarHBondContact O-N 3.42Å; K20-I24 VanDerWaalsContact O-N 3.08Å; K20-Y34 HydrophobicContact CG-CE2 4.46Å
21	K	89.8	Confident	90.7	Very high	148 Å²	148	67.5 Å²	67.5	64%	0.643	32%	0.316	S	S	*	.	H	α-helix	trans	-65.5	-44.6	-177.9	-174.6	-176.5	174.6	-174.5	0	110.9	N19 L23 I24 E25	N19-K21 VanDerWaalsContact C-N 3.28Å; N19-K21 PolarHBondContact O-N 2.76Å; N19-K21 WeakPolarHBondContact OD1-CA 3.29Å; N19-K21 VanDerWaalsContact OD1-CB 3.26Å; N19-K21 WeakPolarHBondContact OD1-CB 3.45Å; N19-K21 PolarHBondContact OD1-N 3.4Å; K21-L23 VanDerWaalsContact C-N 3.34Å; K21-L23 PolarHBondContact O-N 3.35Å; K21-I24 PolarHBondContact O-N 2.68Å; K21-E25 WeakPolarHBondContact O-CB 3.13Å; K21-E25 PolarHBondContact O-N 2.89Å
22	K	90.9	Very high	90.6	Very high	78 Å²	78	70.1 Å²	70.1	34%	0.339	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-41.2	176.7	-67.3	-170.9	-179.7	-176.6	0	112	N19 E25 K26 I63 N64	N19-K22 HydrophobicContact CB-CB 4.28Å; N19-K22 HydrophobicContact CB-CD 4.22Å; N19-K22 HydrophobicContact CB-CG 4.09Å; N19-K22 PolarHBondContact O-N 2.96Å; N19-K22 PolarHBondContact OD1-N 2.85Å; N19-K22 VanDerWaalsContact OD1-N 3.12Å; K22-E25 PolarHBondContact O-N 3.35Å; K22-K26 WeakPolarHBondContact O-CB 3.19Å; K22-K26 WeakPolarHBondContact O-CG 3.39Å; K22-K26 PolarHBondContact O-N 2.85Å; K22-K26 VanDerWaalsContact O-N 3.08Å; K22-I63 HydrophobicContact CB-CG2 3.8Å; K22-N64 PolarHBondContact NZ-O 3.22Å
23	L	90.6	Very high	90.8	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.9	-52.7	176.1	-77.7	164.1	0	0	0	111.6	I9 V18 N19 K20 K21 E25 K26 S27 F30 L60 I63	I9-L23 HydrophobicContact CD1-CD1 3.99Å; I9-L23 HydrophobicContact CD1-CD2 3.9Å; V18-L23 HydrophobicContact CB-CD1 3.9Å; V18-L23 HydrophobicContact CB-CG 4.35Å; V18-L23 HydrophobicContact CG1-CD1 3.86Å; V18-L23 HydrophobicContact CG1-CD2 4.1Å; V18-L23 HydrophobicContact CG1-CG 3.75Å; N19-L23 PolarHBondContact O-N 3.16Å; N19-L23 VanDerWaalsContact O-N 3.16Å; K20-L23 PolarHBondContact O-N 2.9Å; K21-L23 VanDerWaalsContact C-N 3.34Å; K21-L23 PolarHBondContact O-N 3.35Å; L23-E25 VanDerWaalsContact C-N 3.28Å; L23-E25 PolarHBondContact O-N 3.48Å; L23-K26 PolarHBondContact O-N 3.4Å; L23-S27 WeakPolarHBondContact O-CB 3.46Å; L23-S27 PolarHBondContact O-N 3.16Å; L23-F30 HydrophobicContact CB-CB 4.26Å; L23-F30 HydrophobicContact CB-CD2 4.19Å; L23-F30 HydrophobicContact CB-CG 4.28Å; L23-F30 HydrophobicContact CD2-CD2 3.57Å; L23-F30 HydrophobicContact CD2-CE2 3.54Å; L23-F30 HydrophobicContact CD2-CG 4.3Å; L23-F30 HydrophobicContact CD2-CZ 4.21Å; L23-F30 HydrophobicContact CG-CD2 4.41Å; L23-L60 HydrophobicContact CD2-CD2 4.21Å; L23-I63 HydrophobicContact CD2-CD1 3.91Å
24	I	90.8	Very high	91	Very high	49 Å²	49	59.9 Å²	59.9	25%	0.251	28%	0.28	S	S	.	.	H	α-helix	trans	-63	-36	-179.3	-68.5	170.6	0	0	0	111.8	K20 K21 R31 Y34	K20-I24 HydrophobicContact CD-CD1 4.48Å; K20-I24 HydrophobicContact CG-CD1 3.86Å; K20-I24 WeakPolarHBondContact O-CG1 3.22Å; K20-I24 PolarHBondContact O-N 3.42Å; K20-I24 VanDerWaalsContact O-N 3.08Å; K21-I24 PolarHBondContact O-N 2.68Å; I24-R31 HydrophobicContact CG2-CB 4.08Å; I24-R31 HydrophobicContact CG2-CG 3.95Å; I24-R31 PolarHBondContact O-NE 3.15Å; I24-R31 PolarHBondContact O-NH2 2.89Å; I24-Y34 HydrophobicContact CD1-CD2 3.78Å; I24-Y34 HydrophobicContact CD1-CG 4.11Å; I24-Y34 HydrophobicContact CG1-CD2 3.66Å; I24-Y34 HydrophobicContact CG1-CE2 4.45Å; I24-Y34 HydrophobicContact CG1-CG 4.43Å
25	E	91.6	Very high	90.8	Very high	119 Å²	119	58.1 Å²	58.1	56%	0.556	29%	0.288	S	S	*	.	H	α-helix	trans	-67.3	-38.3	178.7	-171.4	-176.7	154	0	0	111.9	K21 K22 L23 R31	K21-E25 WeakPolarHBondContact O-CB 3.13Å; K21-E25 PolarHBondContact O-N 2.89Å; K22-E25 PolarHBondContact O-N 3.35Å; L23-E25 VanDerWaalsContact C-N 3.28Å; L23-E25 PolarHBondContact O-N 3.48Å; E25-R31 PolarHBondContact O-NH2 3.15Å
26	K	92.3	Very high	90.3	Very high	54 Å²	54	56.8 Å²	56.8	24%	0.235	28%	0.282	C	S	.	.	H	α-helix	trans	-103.1	-17.5	-170.1	-63	-66.2	-177.6	176	0	115.1	K22 L23 I63	K22-K26 WeakPolarHBondContact O-CB 3.19Å; K22-K26 WeakPolarHBondContact O-CG 3.39Å; K22-K26 PolarHBondContact O-N 2.85Å; K22-K26 VanDerWaalsContact O-N 3.08Å; L23-K26 PolarHBondContact O-N 3.4Å; K26-I63 HydrophobicContact CB-CG1 4.02Å
27	S	94.9	Very high	89.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.309	C	S	.	.			trans	-123.7	121.1	-178.8	166.3	0	0	0	0	110.9	L23 Y29 F30 R31 L85	L23-S27 WeakPolarHBondContact O-CB 3.46Å; L23-S27 PolarHBondContact O-N 3.16Å; S27-Y29 VanDerWaalsContact C-N 3.29Å; S27-Y29 PolarHBondContact OG-N 2.87Å; S27-F30 VanDerWaalsContact OG-CD2 3.23Å; S27-F30 WeakPolarHBondContact OG-CD2 3.39Å; S27-F30 PolarHBondContact OG-N 3.06Å; S27-F30 VanDerWaalsContact OG-N 3.16Å; S27-R31 WeakPolarHBondContact O-CB 3.18Å; S27-R31 PolarHBondContact O-N 2.85Å; S27-L85 WeakPolarHBondContact CB-O 3.23Å; S27-L85 PolarHBondContact OG-O 2.79Å
28	D	92.8	Very high	88.5	Confident	50 Å²	50	56 Å²	56	27%	0.267	30%	0.3	S	S	.	.	H	α-helix	trans	-70.3	-29.1	175.8	-66.3	-40.8	0	0	0	111.5	R31 A32 Q86	D28-R31 PolarHBondContact O-N 3.43Å; D28-R31 IonicContact OD1-CZ 2.87Å; D28-R31 IonicContact OD1-NH1 2.88Å; D28-R31 PolarHBondContact OD1-NH1 3.21Å; D28-R31 IonicContact OD1-NH2 3.25Å; D28-R31 PolarHBondContact OD1-NH2 3.04Å; D28-A32 WeakPolarHBondContact O-CB 3.4Å; D28-A32 PolarHBondContact O-N 3.02Å; D28-Q86 HydrophobicContact CB-CB 3.96Å; D28-Q86 PolarHBondContact N-O 3.28Å
29	Y	92.9	Very high	87.4	Confident	64 Å²	64	64.6 Å²	64.6	25%	0.251	33%	0.332	S	S	.	.	H	α-helix	trans	-58.7	-54.5	172.1	174.1	-93.1	0	0	0	111.5	S27 R31 A32 L33 L48 L85	S27-Y29 VanDerWaalsContact C-N 3.29Å; S27-Y29 PolarHBondContact OG-N 2.87Å; Y29-R31 VanDerWaalsContact C-N 3.31Å; Y29-R31 PolarHBondContact O-N 3.46Å; Y29-A32 PolarHBondContact O-N 3.38Å; Y29-L33 HydrophobicContact CE1-CD2 4.36Å; Y29-L33 WeakPolarHBondContact O-CB 3.45Å; Y29-L33 PolarHBondContact O-N 2.88Å; Y29-L48 HydrophobicContact CE1-CD2 3.97Å; Y29-L85 WeakPolarHBondContact CB-O 3.45Å; Y29-L85 HydrophobicContact CD1-CD2 3.87Å; Y29-L85 HydrophobicContact CE1-CD2 4.22Å; Y29-L85 HydrophobicContact CG-CD2 4.38Å
30	F	91.6	Very high	86.6	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-67.3	-34.6	179.3	-71.6	-63.8	0	0	0	111.7	I9 L23 S27 A32 L33 Y34 V46 L48 L85	I9-F30 HydrophobicContact CD1-CE2 4.4Å; I9-F30 HydrophobicContact CD1-CZ 3.87Å; L23-F30 HydrophobicContact CB-CB 4.26Å; L23-F30 HydrophobicContact CB-CD2 4.19Å; L23-F30 HydrophobicContact CB-CG 4.28Å; L23-F30 HydrophobicContact CD2-CD2 3.57Å; L23-F30 HydrophobicContact CD2-CE2 3.54Å; L23-F30 HydrophobicContact CD2-CG 4.3Å; L23-F30 HydrophobicContact CD2-CZ 4.21Å; L23-F30 HydrophobicContact CG-CD2 4.41Å; S27-F30 VanDerWaalsContact OG-CD2 3.23Å; S27-F30 WeakPolarHBondContact OG-CD2 3.39Å; S27-F30 PolarHBondContact OG-N 3.06Å; S27-F30 VanDerWaalsContact OG-N 3.16Å; F30-A32 VanDerWaalsContact C-N 3.32Å; F30-A32 PolarHBondContact O-N 3.48Å; F30-L33 HydrophobicContact CD1-CD2 4.13Å; F30-L33 PolarHBondContact O-N 3.06Å; F30-Y34 HydrophobicContact CB-CD2 4.22Å; F30-Y34 HydrophobicContact CB-CE2 4.09Å; F30-Y34 AromaticContact CD1-CE2 3.99Å; F30-Y34 HydrophobicContact CD1-CE2 3.99Å; F30-Y34 HydrophobicContact CG-CE2 4.43Å; F30-Y34 WeakPolarHBondContact O-CD2 3.06Å; F30-Y34 PolarHBondContact O-N 3.1Å; F30-V46 HydrophobicContact CE1-CG1 4.33Å; F30-L48 HydrophobicContact CZ-CD1 4.18Å; F30-L85 HydrophobicContact CE2-CD1 4.23Å; F30-L85 HydrophobicContact CE2-CD2 3.89Å; F30-L85 HydrophobicContact CZ-CD2 3.99Å
31	R	91.4	Very high	85.8	Confident	104 Å²	104	66.9 Å²	66.9	39%	0.392	34%	0.344	S	S	.	.	H	α-helix	trans	-60	-43.6	173.1	-172.2	178.9	-53.2	143.6	14.5	111.7	I24 E25 S27 D28 Y29 S35	I24-R31 HydrophobicContact CG2-CB 4.08Å; I24-R31 HydrophobicContact CG2-CG 3.95Å; I24-R31 PolarHBondContact O-NE 3.15Å; I24-R31 PolarHBondContact O-NH2 2.89Å; E25-R31 PolarHBondContact O-NH2 3.15Å; S27-R31 WeakPolarHBondContact O-CB 3.18Å; S27-R31 PolarHBondContact O-N 2.85Å; D28-R31 PolarHBondContact O-N 3.43Å; D28-R31 IonicContact OD1-CZ 2.87Å; D28-R31 IonicContact OD1-NH1 2.88Å; D28-R31 PolarHBondContact OD1-NH1 3.21Å; D28-R31 IonicContact OD1-NH2 3.25Å; D28-R31 PolarHBondContact OD1-NH2 3.04Å; Y29-R31 VanDerWaalsContact C-N 3.31Å; Y29-R31 PolarHBondContact O-N 3.46Å; R31-S35 VanDerWaalsContact O-CB 3.29Å; R31-S35 WeakPolarHBondContact O-CB 3.44Å; R31-S35 PolarHBondContact O-N 3.05Å; R31-S35 VanDerWaalsContact O-N 3.15Å; R31-S35 PolarHBondContact O-OG 3.25Å
32	A	89.9	Confident	85	Confident	55 Å²	55	65.1 Å²	65.1	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-67.3	-45.8	176.2	0	0	0	0	0	111.1	D28 Y29 F30 Y34 S35 S36	D28-A32 WeakPolarHBondContact O-CB 3.4Å; D28-A32 PolarHBondContact O-N 3.02Å; Y29-A32 PolarHBondContact O-N 3.38Å; F30-A32 VanDerWaalsContact C-N 3.32Å; F30-A32 PolarHBondContact O-N 3.48Å; A32-Y34 PolarHBondContact O-N 3.33Å; A32-S35 WeakPolarHBondContact CA-OG 3.38Å; A32-S35 CarbonylContact O-C 3.6Å; A32-S35 PolarHBondContact O-N 2.89Å; A32-S35 VanDerWaalsContact O-N 3.16Å; A32-S35 PolarHBondContact O-OG 3.32Å; A32-S36 WeakPolarHBondContact O-CB 3.23Å; A32-S36 PolarHBondContact O-N 3.47Å
33	L	89.3	Confident	84.5	Confident	28 Å²	28	64.6 Å²	64.6	15%	0.147	34%	0.344	C	S	.	.	H	α-helix	trans	-55.2	-51.5	179	-176.2	68.6	0	0	0	111.4	Y29 F30 S35 S36 E40 S41 V46	Y29-L33 HydrophobicContact CE1-CD2 4.36Å; Y29-L33 WeakPolarHBondContact O-CB 3.45Å; Y29-L33 PolarHBondContact O-N 2.88Å; F30-L33 HydrophobicContact CD1-CD2 4.13Å; F30-L33 PolarHBondContact O-N 3.06Å; L33-S35 VanDerWaalsContact C-N 3.32Å; L33-S35 PolarHBondContact O-N 2.85Å; L33-S36 PolarHBondContact O-N 2.83Å; L33-S36 PolarHBondContact O-OG 2.59Å; L33-E40 HydrophobicContact CD1-CB 4Å; L33-S41 WeakPolarHBondContact O-CB 3.41Å; L33-V46 HydrophobicContact CD2-CG1 3.97Å; L33-V46 HydrophobicContact CD2-CG2 3.98Å
34	Y	88	Confident	84	Confident	29 Å²	29	69.7 Å²	69.7	11%	0.114	37%	0.372	C	S	.	.	H	α-helix	trans	-78	-11.3	-178.5	-65.5	-62.3	0	0	0	114.6	I7 K20 I24 F30 A32 V46	I7-Y34 HydrophobicContact CD1-CE1 3.72Å; I7-Y34 HydrophobicContact CD1-CE2 4.26Å; I7-Y34 VanDerWaalsContact CD1-CZ 3.45Å; I7-Y34 WeakPolarHBondContact CD1-OH 3.41Å; K20-Y34 HydrophobicContact CG-CE2 4.46Å; I24-Y34 HydrophobicContact CD1-CD2 3.78Å; I24-Y34 HydrophobicContact CD1-CG 4.11Å; I24-Y34 HydrophobicContact CG1-CD2 3.66Å; I24-Y34 HydrophobicContact CG1-CE2 4.45Å; I24-Y34 HydrophobicContact CG1-CG 4.43Å; F30-Y34 HydrophobicContact CB-CD2 4.22Å; F30-Y34 HydrophobicContact CB-CE2 4.09Å; F30-Y34 AromaticContact CD1-CE2 3.99Å; F30-Y34 HydrophobicContact CD1-CE2 3.99Å; F30-Y34 HydrophobicContact CG-CE2 4.43Å; F30-Y34 WeakPolarHBondContact O-CD2 3.06Å; F30-Y34 PolarHBondContact O-N 3.1Å; A32-Y34 PolarHBondContact O-N 3.33Å; Y34-V46 VanDerWaalsContact OH-CG2 3.22Å; Y34-V46 WeakPolarHBondContact OH-CG2 3.36Å
35	S	85.6	Confident	83.8	Confident	92 Å²	92	70 Å²	70	64%	0.643	38%	0.379	S	S	*	.	H	α-helix	trans	-99.6	-8.3	172.5	60.5	0	0	0	0	113.9	R31 A32 L33 G37	R31-S35 VanDerWaalsContact O-CB 3.29Å; R31-S35 WeakPolarHBondContact O-CB 3.44Å; R31-S35 PolarHBondContact O-N 3.05Å; R31-S35 VanDerWaalsContact O-N 3.15Å; R31-S35 PolarHBondContact O-OG 3.25Å; A32-S35 WeakPolarHBondContact CA-OG 3.38Å; A32-S35 CarbonylContact O-C 3.6Å; A32-S35 PolarHBondContact O-N 2.89Å; A32-S35 VanDerWaalsContact O-N 3.16Å; A32-S35 PolarHBondContact O-OG 3.32Å; L33-S35 VanDerWaalsContact C-N 3.32Å; L33-S35 PolarHBondContact O-N 2.85Å; S35-G37 VanDerWaalsContact C-N 3.33Å; S35-G37 PolarHBondContact O-N 2.96Å
36	S	82.3	Confident	83.7	Confident	62 Å²	62	64.9 Å²	64.9	43%	0.434	36%	0.355	S	S	.	.	S	Bend	trans	-69.9	-22.2	-175.1	67.7	0	0	0	0	115	A32 L33 M38	A32-S36 WeakPolarHBondContact O-CB 3.23Å; A32-S36 PolarHBondContact O-N 3.47Å; L33-S36 PolarHBondContact O-N 2.83Å; L33-S36 PolarHBondContact O-OG 2.59Å; S36-M38 PolarHBondContact O-N 2.9Å; S36-M38 WeakPolarHBondContact OG-CB 3.34Å; S36-M38 WeakPolarHBondContact OG-CG 3.44Å; S36-M38 PolarHBondContact OG-N 3.38Å
37	G	70.7	Confident	83.5	Confident	69 Å²	69	67.7 Å²	67.7	71%	0.711	37%	0.369	S	S	*	.			trans	71	9.1	-172.5	0	0	0	0	0	114.6	S35	S35-G37 VanDerWaalsContact C-N 3.33Å; S35-G37 PolarHBondContact O-N 2.96Å
38	M	73.9	Confident	83.3	Confident	114 Å²	114	67.9 Å²	67.9	56%	0.562	37%	0.37	S	S	*	.	S	Bend	trans	-73.4	165.3	174.4	-66	-70.8	-72.8	0	0	111.4	S36 E40 S41	S36-M38 PolarHBondContact O-N 2.9Å; S36-M38 WeakPolarHBondContact OG-CB 3.34Å; S36-M38 WeakPolarHBondContact OG-CG 3.44Å; S36-M38 PolarHBondContact OG-N 3.38Å; M38-E40 WeakPolarHBondContact CB-OE2 3.45Å; M38-E40 PolarHBondContact O-N 2.94Å; M38-S41 VanDerWaalsContact O-CB 3.26Å; M38-S41 WeakPolarHBondContact O-CB 3.47Å; M38-S41 PolarHBondContact O-N 2.69Å; M38-S41 PolarHBondContact O-OG 3.41Å
39	R	68.1	Low	83	Confident	186 Å²	186	73 Å²	73	70%	0.702	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-55.4	-42.4	-177.5	-178.5	179.7	170.3	157.3	3	111.9	S41 T42 E43	R39-S41 PolarHBondContact O-N 2.85Å; R39-S41 VanDerWaalsContact O-N 3.14Å; R39-T42 PolarHBondContact O-N 3.24Å; R39-T42 PolarHBondContact O-OG1 3.08Å; R39-E43 IonicContact CZ-OE1 3.74Å; R39-E43 IonicContact NE-OE1 3.78Å; R39-E43 PolarHBondContact NE-OE1 3.36Å; R39-E43 IonicContact NH2-OE1 2.91Å
40	E	72	Confident	82.5	Confident	88 Å²	88	73 Å²	73	41%	0.411	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-60.5	-22.3	179	-61.5	83	172.8	0	0	112.6	L33 M38 T42	L33-E40 HydrophobicContact CD1-CB 4Å; M38-E40 WeakPolarHBondContact CB-OE2 3.45Å; M38-E40 PolarHBondContact O-N 2.94Å; E40-T42 PolarHBondContact O-N 2.97Å
41	S	73.3	Confident	82.4	Confident	16 Å²	16	73.5 Å²	73.5	11%	0.112	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-71.6	-18.1	176.5	74.4	0	0	0	0	113.5	L33 M38 R39	L33-S41 WeakPolarHBondContact O-CB 3.41Å; M38-S41 VanDerWaalsContact O-CB 3.26Å; M38-S41 WeakPolarHBondContact O-CB 3.47Å; M38-S41 PolarHBondContact O-N 2.69Å; M38-S41 PolarHBondContact O-OG 3.41Å; R39-S41 PolarHBondContact O-N 2.85Å; R39-S41 VanDerWaalsContact O-N 3.14Å
42	T	72.9	Confident	82.4	Confident	111 Å²	111	69.9 Å²	69.9	68%	0.681	41%	0.406	S	S	*	.	S	Bend	trans	-108.9	-5.4	-177.1	61.9	0	0	0	0	114	R39 E40	R39-T42 PolarHBondContact O-N 3.24Å; R39-T42 PolarHBondContact O-OG1 3.08Å; E40-T42 PolarHBondContact O-N 2.97Å
43	E	79.1	Confident	82.4	Confident	66 Å²	66	68.4 Å²	68.4	31%	0.308	39%	0.391	S	S	.	.			trans	-83.1	146.4	179	-63.7	-168	171.7	0	0	111.2	R39 S45	R39-E43 IonicContact CZ-OE1 3.74Å; R39-E43 IonicContact NE-OE1 3.78Å; R39-E43 PolarHBondContact NE-OE1 3.36Å; R39-E43 IonicContact NH2-OE1 2.91Å; E43-S45 PolarHBondContact O-N 3.08Å
44	D	81.4	Confident	82.5	Confident	108 Å²	108	69.7 Å²	69.7	58%	0.578	40%	0.401	S	S	*	.	S	Bend	trans	-84.5	1.4	178.1	-67.6	-41.2	0	0	0	112.6	Q5 I7 A8	Q5-D44 PolarHBondContact NE2-OD1 3.38Å; I7-D44 WeakPolarHBondContact CG2-O 3.41Å; A8-D44 PolarHBondContact N-O 3.41Å
45	S	86.8	Confident	82.7	Confident	56 Å²	56	68.3 Å²	68.3	39%	0.392	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	138.8	175.4	60.8	0	0	0	0	111.8	A8 E43	A8-S45 CarbonylContact O-C 3.59Å; A8-S45 WeakPolarHBondContact O-CA 3.46Å; E43-S45 PolarHBondContact O-N 3.08Å
46	V	88.1	Confident	83.1	Confident	10 Å²	10	63.9 Å²	63.9	6%	0.061	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.7	174.2	179.7	0	0	0	0	109.6	I7 A8 V10 F30 L33 Y34 L48	I7-V46 HydrophobicContact CG2-CG2 4.37Å; A8-V46 PolarHBondContact O-N 3.16Å; V10-V46 PolarHBondContact N-O 3.47Å; F30-V46 HydrophobicContact CE1-CG1 4.33Å; L33-V46 HydrophobicContact CD2-CG1 3.97Å; L33-V46 HydrophobicContact CD2-CG2 3.98Å; Y34-V46 VanDerWaalsContact OH-CG2 3.22Å; Y34-V46 WeakPolarHBondContact OH-CG2 3.36Å; V46-L48 HydrophobicContact CG1-CD2 3.95Å; V46-L48 HydrophobicContact CG1-CG 4.38Å
47	Q	89	Confident	83.6	Confident	113 Å²	113	64.7 Å²	64.7	53%	0.528	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	120.3	173.6	-162.8	86.8	23.9	0	0	109.5	V10	V10-Q47 WeakPolarHBondContact O-CA 3.26Å
48	L	89.4	Confident	84.6	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.021	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	141.2	169.7	-49.4	166	0	0	0	108.8	I9 V10 V11 Y29 F30 V46 L51 L56 L85	I9-L48 HydrophobicContact CG2-CD1 3.65Å; I9-L48 HydrophobicContact CG2-CG 4.27Å; V10-L48 PolarHBondContact O-N 3.2Å; V11-L48 HydrophobicContact CG2-CB 3.74Å; V11-L48 HydrophobicContact CG2-CD1 4.29Å; V11-L48 HydrophobicContact CG2-CG 4.44Å; Y29-L48 HydrophobicContact CE1-CD2 3.97Å; F30-L48 HydrophobicContact CZ-CD1 4.18Å; V46-L48 HydrophobicContact CG1-CD2 3.95Å; V46-L48 HydrophobicContact CG1-CG 4.38Å; L48-L51 HydrophobicContact CB-CD1 3.94Å; L48-L51 HydrophobicContact CD1-CD1 3.77Å; L48-L51 HydrophobicContact CG-CD1 4.41Å; L48-L56 HydrophobicContact CD1-CD1 4.43Å; L48-L85 HydrophobicContact CD1-CD2 4.06Å; L48-L85 HydrophobicContact CD2-CD2 4.49Å
49	Q	87.1	Confident	85.6	Confident	157 Å²	157	57 Å²	57	73%	0.734	31%	0.306	S	S	*	.			trans	-123	145.5	-179.5	-66.2	-176.1	-7.6	0	0	109.9	L51	Q49-L51 VanDerWaalsContact C-N 3.33Å
50	G	83.3	Confident	86.7	Confident	66 Å²	66	48.5 Å²	48.5	68%	0.68	28%	0.275	S	S	*	.	S	Bend	trans	74.3	19.8	175.6	0	0	0	0	0	114.7
51	L	89.5	Confident	87.6	Confident	10 Å²	10	48.7 Å²	48.7	5%	0.052	28%	0.276	C	S	.	.			trans	-103.2	139.7	173.1	-73	177.5	0	0	0	110.9	L48 Q49 V53 T81 F84 L85	L48-L51 HydrophobicContact CB-CD1 3.94Å; L48-L51 HydrophobicContact CD1-CD1 3.77Å; L48-L51 HydrophobicContact CG-CD1 4.41Å; Q49-L51 VanDerWaalsContact C-N 3.33Å; L51-V53 PolarHBondContact O-N 3.25Å; L51-T81 HydrophobicContact CD1-CG2 4.27Å; L51-T81 HydrophobicContact CD2-CG2 4.13Å; L51-F84 HydrophobicContact CD1-CD1 3.87Å; L51-F84 HydrophobicContact CD1-CE1 4.07Å; L51-F84 HydrophobicContact CD2-CB 3.9Å; L51-F84 HydrophobicContact CD2-CD1 3.73Å; L51-F84 HydrophobicContact CD2-CD2 4.49Å; L51-F84 HydrophobicContact CD2-CE1 4.39Å; L51-F84 HydrophobicContact CD2-CG 3.79Å; L51-F84 HydrophobicContact CG-CD1 4.11Å; L51-F84 HydrophobicContact CG-CE1 4.34Å; L51-L85 HydrophobicContact CD1-CD1 4.45Å; L51-L85 HydrophobicContact CD1-CD2 4.28Å; L51-L85 HydrophobicContact CD1-CG 4.34Å
52	S	90.5	Very high	88.5	Confident	28 Å²	28	48.5 Å²	48.5	20%	0.196	27%	0.273	C	S	.	.			trans	-64.7	128.5	170.7	-179.9	0	0	0	0	111.2	P54 G55 L56 D77	S52-P54 WeakPolarHBondContact OG-CD 3.44Å; S52-G55 PolarHBondContact O-N 3.33Å; S52-L56 PolarHBondContact O-N 2.89Å; S52-D77 WeakPolarHBondContact CB-OD1 3.29Å; S52-D77 PolarHBondContact OG-OD1 3.27Å
53	V	91.4	Very high	89.4	Confident	24 Å²	24	43.4 Å²	43.4	15%	0.145	24%	0.241	C	C	.	.	H	α-helix	trans	-59.2	-48.4	177.6	170.7	0	0	0	0	112	V11 Y16 L51 G55 L56 E57	V11-V53 HydrophobicContact CG1-CG2 4.27Å; Y16-V53 WeakPolarHBondContact OH-CG1 2.77Å; L51-V53 PolarHBondContact O-N 3.25Å; V53-G55 VanDerWaalsContact C-N 3.31Å; V53-G55 PolarHBondContact O-N 2.93Å; V53-L56 PolarHBondContact O-N 3.11Å; V53-E57 WeakPolarHBondContact O-CG 3.34Å; V53-E57 PolarHBondContact O-N 2.98Å
54	P	91.2	Very high	89.8	Confident	54 Å²	54	43.5 Å²	43.5	35%	0.351	24%	0.244	S	C	.	.	H	α-helix	trans	-53.8	-43.6	171.8	-27.4	31.5	0	0	0	114	S52 E57 L58 D77	S52-P54 WeakPolarHBondContact OG-CD 3.44Å; P54-E57 PolarHBondContact O-N 3Å; P54-L58 WeakPolarHBondContact O-CG 3.18Å; P54-L58 PolarHBondContact O-N 3.12Å; P54-L58 VanDerWaalsContact O-N 3.14Å; P54-D77 HydrophobicContact CB-CB 4.5Å
55	G	92	Very high	90.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-43.1	179.6	0	0	0	0	0	112.2	S52 V53 L58 V59 D77	S52-G55 PolarHBondContact O-N 3.33Å; V53-G55 VanDerWaalsContact C-N 3.31Å; V53-G55 PolarHBondContact O-N 2.93Å; G55-L58 PolarHBondContact O-N 2.79Å; G55-V59 WeakPolarHBondContact O-CG2 3.43Å; G55-V59 PolarHBondContact O-N 2.67Å; G55-D77 WeakPolarHBondContact CA-O 3.37Å
56	L	93.3	Very high	90.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-44.9	175.7	-176.9	67.8	0	0	0	111.9	I9 V11 Y16 L48 S52 V53 L58 V59 L60 T81 L85	I9-L56 HydrophobicContact CG2-CD2 4.15Å; V11-L56 HydrophobicContact CB-CD2 4Å; V11-L56 HydrophobicContact CG2-CD2 3.48Å; V11-L56 VanDerWaalsContact CG2-CD2 3.48Å; Y16-L56 HydrophobicContact CD2-CD2 3.92Å; Y16-L56 HydrophobicContact CE2-CD2 3.89Å; L48-L56 HydrophobicContact CD1-CD1 4.43Å; S52-L56 PolarHBondContact O-N 2.89Å; V53-L56 PolarHBondContact O-N 3.11Å; L56-L58 VanDerWaalsContact C-N 3.3Å; L56-L58 PolarHBondContact O-N 3.34Å; L56-V59 PolarHBondContact O-N 3.09Å; L56-L60 HydrophobicContact CD1-CD1 4.13Å; L56-L60 HydrophobicContact CD1-CD2 4.38Å; L56-L60 HydrophobicContact CD1-CG 3.99Å; L56-L60 HydrophobicContact CD2-CD1 4.36Å; L56-L60 HydrophobicContact CG-CD1 3.89Å; L56-L60 HydrophobicContact CG-CG 4.11Å; L56-L60 WeakPolarHBondContact O-CB 3.45Å; L56-L60 VanDerWaalsContact O-CG 3.26Å; L56-L60 WeakPolarHBondContact O-CG 3.49Å; L56-L60 PolarHBondContact O-N 3.44Å; L56-T81 HydrophobicContact CB-CG2 4.44Å; L56-T81 HydrophobicContact CD1-CG2 4.47Å; L56-L85 HydrophobicContact CD1-CD1 3.96Å
57	E	92.2	Very high	90	Very high	78 Å²	78	49.4 Å²	49.4	36%	0.364	27%	0.271	S	S	.	.	H	α-helix	trans	-57.3	-44.7	178.8	-75.2	177.1	173.9	0	0	111.4	R14 Y16 V53 P54 L60 E61	R14-E57 IonicContact NH1-OE1 2.97Å; R14-E57 PolarHBondContact NH1-OE1 2.95Å; Y16-E57 HydrophobicContact CE1-CG 3.71Å; Y16-E57 WeakPolarHBondContact OH-CG 3.36Å; Y16-E57 PolarHBondContact OH-OE1 3.24Å; V53-E57 WeakPolarHBondContact O-CG 3.34Å; V53-E57 PolarHBondContact O-N 2.98Å; P54-E57 PolarHBondContact O-N 3Å; E57-L60 PolarHBondContact O-N 2.92Å; E57-E61 WeakPolarHBondContact O-CB 3.41Å; E57-E61 PolarHBondContact O-N 3.02Å
58	L	92.4	Very high	89.6	Confident	21 Å²	21	45 Å²	45	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-42.1	176.9	-69	171.3	0	0	0	113	P54 G55 L56 E61 F62 V68 T74 L78	P54-L58 WeakPolarHBondContact O-CG 3.18Å; P54-L58 PolarHBondContact O-N 3.12Å; P54-L58 VanDerWaalsContact O-N 3.14Å; G55-L58 PolarHBondContact O-N 2.79Å; L56-L58 VanDerWaalsContact C-N 3.3Å; L56-L58 PolarHBondContact O-N 3.34Å; L58-E61 PolarHBondContact O-N 3.12Å; L58-F62 WeakPolarHBondContact O-CB 3.16Å; L58-F62 PolarHBondContact O-N 3.23Å; L58-V68 HydrophobicContact CB-CG2 4.11Å; L58-V68 HydrophobicContact CD2-CG2 4.19Å; L58-T74 HydrophobicContact CD1-CG2 4.42Å; L58-L78 HydrophobicContact CB-CD1 3.91Å; L58-L78 HydrophobicContact CD1-CB 4.22Å
59	V	93.9	Very high	89	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.3	-41.6	177.7	170.4	0	0	0	0	110.9	G55 L56 F62 I63 L78 T81 A82 L85 V87 I90	G55-V59 WeakPolarHBondContact O-CG2 3.43Å; G55-V59 PolarHBondContact O-N 2.67Å; L56-V59 PolarHBondContact O-N 3.09Å; V59-F62 PolarHBondContact O-N 2.98Å; V59-I63 HydrophobicContact CG1-CD1 3.82Å; V59-I63 WeakPolarHBondContact O-CD1 3.36Å; V59-I63 VanDerWaalsContact O-CG1 3.25Å; V59-I63 WeakPolarHBondContact O-CG1 3.32Å; V59-I63 PolarHBondContact O-N 3.47Å; V59-L78 HydrophobicContact CG2-CD1 3.86Å; V59-T81 HydrophobicContact CB-CG2 4.31Å; V59-T81 HydrophobicContact CG2-CG2 3.88Å; V59-A82 HydrophobicContact CG2-CB 4.22Å; V59-L85 HydrophobicContact CG1-CD1 4.1Å; V59-V87 HydrophobicContact CG1-CG2 3.79Å; V59-I90 HydrophobicContact CB-CD1 4.31Å; V59-I90 HydrophobicContact CG1-CD1 4.24Å; V59-I90 HydrophobicContact CG2-CD1 3.86Å
60	L	92.4	Very high	88.2	Confident	8 Å²	8	47.5 Å²	47.5	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-68.9	-38.9	177	-67.1	-175.6	0	0	0	112.2	I9 Y16 V18 L23 L56 E57 F62 I63 N64	I9-L60 HydrophobicContact CD1-CD2 3.83Å; Y16-L60 HydrophobicContact CD1-CD1 4.19Å; Y16-L60 HydrophobicContact CD2-CD1 4.34Å; Y16-L60 HydrophobicContact CG-CD1 3.81Å; V18-L60 HydrophobicContact CG1-CD2 4.34Å; V18-L60 HydrophobicContact CG2-CD1 3.95Å; V18-L60 HydrophobicContact CG2-CD2 3.93Å; V18-L60 HydrophobicContact CG2-CG 4.47Å; L23-L60 HydrophobicContact CD2-CD2 4.21Å; L56-L60 HydrophobicContact CD1-CD1 4.13Å; L56-L60 HydrophobicContact CD1-CD2 4.38Å; L56-L60 HydrophobicContact CD1-CG 3.99Å; L56-L60 HydrophobicContact CD2-CD1 4.36Å; L56-L60 HydrophobicContact CG-CD1 3.89Å; L56-L60 HydrophobicContact CG-CG 4.11Å; L56-L60 WeakPolarHBondContact O-CB 3.45Å; L56-L60 VanDerWaalsContact O-CG 3.26Å; L56-L60 WeakPolarHBondContact O-CG 3.49Å; L56-L60 PolarHBondContact O-N 3.44Å; E57-L60 PolarHBondContact O-N 2.92Å; L60-F62 VanDerWaalsContact C-N 3.31Å; L60-F62 PolarHBondContact O-N 3.4Å; L60-I63 HydrophobicContact CD2-CD1 4.18Å; L60-I63 PolarHBondContact O-N 3.21Å; L60-N64 WeakPolarHBondContact O-CB 3.26Å; L60-N64 PolarHBondContact O-N 3.18Å; L60-N64 PolarHBondContact O-ND2 3.39Å
61	E	91.4	Very high	87.8	Confident	93 Å²	93	48.5 Å²	48.5	44%	0.435	26%	0.259	S	S	.	.	H	α-helix	trans	-58.4	-45.8	171.5	-173.6	-178	-180	0	0	110.6	E57 L58 N64 T65	E57-E61 WeakPolarHBondContact O-CB 3.41Å; E57-E61 PolarHBondContact O-N 3.02Å; L58-E61 PolarHBondContact O-N 3.12Å; E61-N64 PolarHBondContact O-N 3.29Å; E61-T65 HydrophobicContact CG-CG2 4.39Å; E61-T65 WeakPolarHBondContact O-CB 3.39Å; E61-T65 WeakPolarHBondContact O-CG2 3.5Å; E61-T65 PolarHBondContact O-N 2.86Å; E61-T65 PolarHBondContact O-OG1 3.33Å
62	F	92	Very high	87	Confident	11 Å²	11	52.5 Å²	52.5	5%	0.048	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-43.7	175.7	178.1	-91.8	0	0	0	112.4	L58 V59 L60 N64 T65 S66 K67 V68 V87 I90 L93	L58-F62 WeakPolarHBondContact O-CB 3.16Å; L58-F62 PolarHBondContact O-N 3.23Å; V59-F62 PolarHBondContact O-N 2.98Å; L60-F62 VanDerWaalsContact C-N 3.31Å; L60-F62 PolarHBondContact O-N 3.4Å; F62-N64 PolarHBondContact O-N 2.8Å; F62-T65 PolarHBondContact O-N 3.5Å; F62-S66 WeakPolarHBondContact O-CA 3.4Å; F62-S66 PolarHBondContact O-N 3.49Å; F62-K67 WeakPolarHBondContact CA-O 3.36Å; F62-V68 HydrophobicContact CB-CB 4.31Å; F62-V68 HydrophobicContact CD2-CB 4.13Å; F62-V87 HydrophobicContact CD1-CG1 4.17Å; F62-V87 HydrophobicContact CE1-CG1 4.2Å; F62-I90 HydrophobicContact CB-CD1 3.9Å; F62-I90 HydrophobicContact CB-CG1 4.21Å; F62-I90 HydrophobicContact CD1-CD1 3.62Å; F62-I90 HydrophobicContact CD1-CG1 3.31Å; F62-I90 HydrophobicContact CD2-CG1 3.95Å; F62-I90 HydrophobicContact CE1-CD1 4.3Å; F62-I90 HydrophobicContact CE1-CG1 3.54Å; F62-I90 HydrophobicContact CE2-CG1 4.14Å; F62-I90 HydrophobicContact CG-CD1 3.76Å; F62-I90 HydrophobicContact CG-CG1 3.53Å; F62-I90 HydrophobicContact CZ-CG1 3.94Å; F62-L93 HydrophobicContact CE2-CD2 4.14Å
63	I	90.3	Very high	86.5	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-35.7	177.2	-72.3	163.2	0	0	0	110.8	K22 L23 K26 V59 L60	K22-I63 HydrophobicContact CB-CG2 3.8Å; L23-I63 HydrophobicContact CD2-CD1 3.91Å; K26-I63 HydrophobicContact CB-CG1 4.02Å; V59-I63 HydrophobicContact CG1-CD1 3.82Å; V59-I63 WeakPolarHBondContact O-CD1 3.36Å; V59-I63 VanDerWaalsContact O-CG1 3.25Å; V59-I63 WeakPolarHBondContact O-CG1 3.32Å; V59-I63 PolarHBondContact O-N 3.47Å; L60-I63 HydrophobicContact CD2-CD1 4.18Å; L60-I63 PolarHBondContact O-N 3.21Å
64	N	88.9	Confident	86.3	Confident	68 Å²	68	60 Å²	60	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-79.7	-38.9	-178.9	-79.8	-41.4	0	0	0	114.1	K22 L60 E61 F62	K22-N64 PolarHBondContact NZ-O 3.22Å; L60-N64 WeakPolarHBondContact O-CB 3.26Å; L60-N64 PolarHBondContact O-N 3.18Å; L60-N64 PolarHBondContact O-ND2 3.39Å; E61-N64 PolarHBondContact O-N 3.29Å; F62-N64 PolarHBondContact O-N 2.8Å
65	T	89.1	Confident	86.3	Confident	73 Å²	73	57.7 Å²	57.7	45%	0.448	30%	0.298	S	S	.	.	H	α-helix	trans	-113.7	-14.7	-168.5	69.1	0	0	0	0	114.3	E61 F62 K67	E61-T65 HydrophobicContact CG-CG2 4.39Å; E61-T65 WeakPolarHBondContact O-CB 3.39Å; E61-T65 WeakPolarHBondContact O-CG2 3.5Å; E61-T65 PolarHBondContact O-N 2.86Å; E61-T65 PolarHBondContact O-OG1 3.33Å; F62-T65 PolarHBondContact O-N 3.5Å; T65-K67 PolarHBondContact O-N 2.85Å; T65-K67 PolarHBondContact OG1-N 3.49Å; T65-K67 VanDerWaalsContact OG1-N 3.15Å; T65-K67 PolarHBondContact OG1-O 3.37Å; T65-K67 VanDerWaalsContact OG1-O 3.14Å
66	S	86.3	Confident	86.3	Confident	66 Å²	66	62.5 Å²	62.5	46%	0.462	32%	0.321	S	S	.	.	S	Bend	trans	56.1	22.5	-167.6	-57.9	0	0	0	0	114.3	F62	F62-S66 WeakPolarHBondContact O-CA 3.4Å; F62-S66 PolarHBondContact O-N 3.49Å
67	K	84.4	Confident	86.2	Confident	160 Å²	160	64.3 Å²	64.3	70%	0.696	33%	0.331	S	S	*	.			trans	-126.8	146.3	173.8	-63.8	-176.5	-179.5	-178	0	108.7	F62 T65	F62-K67 WeakPolarHBondContact CA-O 3.36Å; T65-K67 PolarHBondContact O-N 2.85Å; T65-K67 PolarHBondContact OG1-N 3.49Å; T65-K67 VanDerWaalsContact OG1-N 3.15Å; T65-K67 PolarHBondContact OG1-O 3.37Å; T65-K67 VanDerWaalsContact OG1-O 3.14Å
68	V	81.1	Confident	86.3	Confident	19 Å²	19	60.6 Å²	60.6	12%	0.115	31%	0.313	C	S	.	.			trans	-137.8	129.7	171	80.4	0	0	0	0	107.7	L58 F62 V70 L78 L93	L58-V68 HydrophobicContact CB-CG2 4.11Å; L58-V68 HydrophobicContact CD2-CG2 4.19Å; F62-V68 HydrophobicContact CB-CB 4.31Å; F62-V68 HydrophobicContact CD2-CB 4.13Å; V68-V70 HydrophobicContact CG1-CG2 3.69Å; V68-L78 HydrophobicContact CG1-CD2 4.39Å; V68-L78 HydrophobicContact CG2-CD1 4.32Å; V68-L78 HydrophobicContact CG2-CD2 4.21Å; V68-L93 HydrophobicContact CG1-CD2 3.88Å
69	Q	75.6	Confident	86.3	Confident	162 Å²	162	59.6 Å²	59.6	76%	0.757	31%	0.308	S	S	*	.			trans	-96.4	103.5	170.3	-68.1	-164.1	12.2	0	0	107.6
70	V	71.3	Confident	86.3	Confident	53 Å²	53	62.4 Å²	62.4	32%	0.321	32%	0.321	S	S	.	.			trans	-85.8	124.7	179.1	-166.5	0	0	0	0	109	V68 L75 L78 L94	V68-V70 HydrophobicContact CG1-CG2 3.69Å; V70-L75 HydrophobicContact CG1-CB 4.11Å; V70-L75 HydrophobicContact CG1-CD1 3.72Å; V70-L75 HydrophobicContact CG1-CG 4.5Å; V70-L78 HydrophobicContact CB-CD2 4.46Å; V70-L78 HydrophobicContact CG1-CD2 4.14Å; V70-L78 HydrophobicContact CG2-CD2 3.54Å; V70-L94 HydrophobicContact CG2-CD2 4.19Å
71	V	73.9	Confident	86.4	Confident	86 Å²	86	62 Å²	62	52%	0.521	32%	0.319	S	S	.	.			trans	-102.6	145.8	165.7	-172.8	0	0	0	0	106.6	E73 T74 L75	V71-E73 PolarHBondContact O-N 2.86Å; V71-E73 VanDerWaalsContact O-N 3.15Å; V71-T74 PolarHBondContact O-N 3.23Å; V71-T74 PolarHBondContact O-OG1 2.97Å; V71-T74 VanDerWaalsContact O-OG1 3.12Å; V71-L75 PolarHBondContact O-N 3Å
72	N	73.1	Confident	86.5	Confident	95 Å²	95	57.6 Å²	57.6	51%	0.508	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-53.6	-39	-176.3	-74.1	7.8	0	0	0	112.7	T74 L75	N72-T74 PolarHBondContact O-N 2.77Å; N72-L75 WeakPolarHBondContact O-CB 3.47Å; N72-L75 PolarHBondContact O-N 3.02Å
73	E	81.1	Confident	86.6	Confident	176 Å²	176	58.8 Å²	58.8	82%	0.822	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-63.8	-23.9	-178.9	-62.8	178.5	170.6	0	0	114	V71	V71-E73 PolarHBondContact O-N 2.86Å; V71-E73 VanDerWaalsContact O-N 3.15Å
74	T	86.8	Confident	86.7	Confident	34 Å²	34	63.1 Å²	63.1	21%	0.209	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-106.4	5.5	-177.8	59.7	0	0	0	0	113.1	L58 V71 N72 L78	L58-T74 HydrophobicContact CD1-CG2 4.42Å; V71-T74 PolarHBondContact O-N 3.23Å; V71-T74 PolarHBondContact O-OG1 2.97Å; V71-T74 VanDerWaalsContact O-OG1 3.12Å; N72-T74 PolarHBondContact O-N 2.77Å; T74-L78 VanDerWaalsContact O-CB 3.31Å; T74-L78 WeakPolarHBondContact O-CB 3.16Å; T74-L78 PolarHBondContact O-N 3.05Å
75	L	89.8	Confident	87	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-68.1	-41.9	-174.6	177.9	62.7	0	0	0	112.2	V70 V71 N72 L78 I79 L94 E105 L106 L109	V70-L75 HydrophobicContact CG1-CB 4.11Å; V70-L75 HydrophobicContact CG1-CD1 3.72Å; V70-L75 HydrophobicContact CG1-CG 4.5Å; V71-L75 PolarHBondContact O-N 3Å; N72-L75 WeakPolarHBondContact O-CB 3.47Å; N72-L75 PolarHBondContact O-N 3.02Å; L75-L78 PolarHBondContact O-N 3.45Å; L75-I79 HydrophobicContact CD1-CD1 3.81Å; L75-I79 HydrophobicContact CD1-CG1 4.27Å; L75-I79 HydrophobicContact CG-CD1 4.07Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 2.87Å; L75-L94 HydrophobicContact CD1-CD2 4.21Å; L75-E105 HydrophobicContact CD2-CG 4.07Å; L75-L106 HydrophobicContact CD1-CD2 3.71Å; L75-L106 HydrophobicContact CD2-CD2 3.84Å; L75-L106 HydrophobicContact CD2-CG 4.2Å; L75-L106 HydrophobicContact CG-CD2 4.21Å; L75-L109 HydrophobicContact CD2-CD1 4.33Å; L75-L109 HydrophobicContact CG-CD1 4.03Å
76	E	92.4	Very high	87.2	Confident	102 Å²	102	61 Å²	61	48%	0.477	31%	0.31	S	S	.	.	H	α-helix	trans	-61.1	-51.8	175.6	177.2	165.1	-161.6	0	0	111.1	L78 I79 E80 L109	E76-L78 VanDerWaalsContact C-N 3.27Å; E76-L78 PolarHBondContact O-N 2.85Å; E76-I79 PolarHBondContact O-N 3.01Å; E76-I79 VanDerWaalsContact O-N 3.15Å; E76-E80 WeakPolarHBondContact O-CB 3.45Å; E76-E80 PolarHBondContact O-N 3.5Å; E76-L109 HydrophobicContact CB-CD1 4.22Å; E76-L109 HydrophobicContact CB-CD2 3.9Å; E76-L109 HydrophobicContact CG-CD2 3.71Å
77	D	92.2	Very high	87.6	Confident	38 Å²	38	57.9 Å²	57.9	20%	0.203	29%	0.288	C	S	.	.	H	α-helix	trans	-56.4	-41.9	178.2	-62.8	-54.4	0	0	0	112.1	S52 P54 G55 T81	S52-D77 WeakPolarHBondContact CB-OD1 3.29Å; S52-D77 PolarHBondContact OG-OD1 3.27Å; P54-D77 HydrophobicContact CB-CB 4.5Å; G55-D77 WeakPolarHBondContact CA-O 3.37Å; D77-T81 VanDerWaalsContact O-CB 3.29Å; D77-T81 WeakPolarHBondContact O-CB 3.45Å; D77-T81 PolarHBondContact O-N 3.23Å; D77-T81 PolarHBondContact O-OG1 3.31Å
78	L	93.4	Very high	87.9	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-46.1	178.3	175.8	61.6	0	0	0	111.4	L58 V59 V68 V70 T74 L75 E76 A82 I90	L58-L78 HydrophobicContact CB-CD1 3.91Å; L58-L78 HydrophobicContact CD1-CB 4.22Å; V59-L78 HydrophobicContact CG2-CD1 3.86Å; V68-L78 HydrophobicContact CG1-CD2 4.39Å; V68-L78 HydrophobicContact CG2-CD1 4.32Å; V68-L78 HydrophobicContact CG2-CD2 4.21Å; V70-L78 HydrophobicContact CB-CD2 4.46Å; V70-L78 HydrophobicContact CG1-CD2 4.14Å; V70-L78 HydrophobicContact CG2-CD2 3.54Å; T74-L78 VanDerWaalsContact O-CB 3.31Å; T74-L78 WeakPolarHBondContact O-CB 3.16Å; T74-L78 PolarHBondContact O-N 3.05Å; L75-L78 PolarHBondContact O-N 3.45Å; E76-L78 VanDerWaalsContact C-N 3.27Å; E76-L78 PolarHBondContact O-N 2.85Å; L78-A82 WeakPolarHBondContact O-CB 3.35Å; L78-A82 PolarHBondContact O-N 3.2Å; L78-I90 HydrophobicContact CD1-CD1 4.26Å; L78-I90 HydrophobicContact CD1-CG2 4.06Å; L78-I90 HydrophobicContact CD2-CG2 4.34Å; L78-I90 HydrophobicContact CG-CG2 4.2Å
79	I	93.3	Very high	88.4	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69	-44.5	-178.2	-73.3	172.6	0	0	0	110.9	L75 E76 T81 A82 S83 L94 L106 L109 Y113 I115 L118	L75-I79 HydrophobicContact CD1-CD1 3.81Å; L75-I79 HydrophobicContact CD1-CG1 4.27Å; L75-I79 HydrophobicContact CG-CD1 4.07Å; L75-I79 WeakPolarHBondContact O-CG1 3.45Å; L75-I79 PolarHBondContact O-N 2.87Å; E76-I79 PolarHBondContact O-N 3.01Å; E76-I79 VanDerWaalsContact O-N 3.15Å; I79-T81 PolarHBondContact O-N 2.66Å; I79-A82 PolarHBondContact O-N 3.05Å; I79-S83 WeakPolarHBondContact O-CB 3.42Å; I79-S83 PolarHBondContact O-N 2.78Å; I79-L94 HydrophobicContact CD1-CD1 4.03Å; I79-L94 HydrophobicContact CG1-CD1 3.63Å; I79-L106 HydrophobicContact CD1-CD2 3.59Å; I79-L109 HydrophobicContact CD1-CB 4.02Å; I79-L109 HydrophobicContact CD1-CD1 3.73Å; I79-L109 HydrophobicContact CG2-CB 4.32Å; I79-Y113 HydrophobicContact CG2-CD2 3.64Å; I79-Y113 HydrophobicContact CG2-CE2 4.25Å; I79-Y113 HydrophobicContact CG2-CG 4.35Å; I79-I115 HydrophobicContact CG2-CD1 3.59Å; I79-L118 HydrophobicContact CD1-CD2 4.36Å
80	E	93.6	Very high	89.2	Confident	59 Å²	59	46.5 Å²	46.5	28%	0.276	25%	0.245	S	C	.	.	H	α-helix	trans	-53.6	-55.5	174.7	-178	-179.6	-158.8	0	0	110.3	E76 S83 F84 Y113	E76-E80 WeakPolarHBondContact O-CB 3.45Å; E76-E80 PolarHBondContact O-N 3.5Å; E80-S83 PolarHBondContact O-N 2.89Å; E80-F84 WeakPolarHBondContact O-CB 3.39Å; E80-F84 PolarHBondContact O-N 2.6Å; E80-Y113 HydrophobicContact CB-CE1 3.8Å; E80-Y113 HydrophobicContact CB-CE2 4.2Å; E80-Y113 HydrophobicContact CG-CE1 3.67Å
81	T	93.9	Very high	90.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-68.2	-40.6	-175.2	-52.9	0	0	0	0	111.9	L51 L56 V59 D77 I79 S83 F84 L85	L51-T81 HydrophobicContact CD1-CG2 4.27Å; L51-T81 HydrophobicContact CD2-CG2 4.13Å; L56-T81 HydrophobicContact CB-CG2 4.44Å; L56-T81 HydrophobicContact CD1-CG2 4.47Å; V59-T81 HydrophobicContact CB-CG2 4.31Å; V59-T81 HydrophobicContact CG2-CG2 3.88Å; D77-T81 VanDerWaalsContact O-CB 3.29Å; D77-T81 WeakPolarHBondContact O-CB 3.45Å; D77-T81 PolarHBondContact O-N 3.23Å; D77-T81 PolarHBondContact O-OG1 3.31Å; I79-T81 PolarHBondContact O-N 2.66Å; T81-S83 VanDerWaalsContact C-N 3.33Å; T81-S83 PolarHBondContact O-N 3.15Å; T81-F84 PolarHBondContact O-N 3.38Å; T81-L85 HydrophobicContact CG2-CD1 3.77Å; T81-L85 HydrophobicContact CG2-CG 4.27Å; T81-L85 VanDerWaalsContact O-CB 3.32Å; T81-L85 WeakPolarHBondContact O-CB 3.14Å; T81-L85 WeakPolarHBondContact O-CG 3.2Å; T81-L85 PolarHBondContact O-N 3.29Å
82	A	94.1	Very high	90.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-35	176.9	0	0	0	0	0	112.2	V59 L78 I79 Q86 V87 I90 L91	V59-A82 HydrophobicContact CG2-CB 4.22Å; L78-A82 WeakPolarHBondContact O-CB 3.35Å; L78-A82 PolarHBondContact O-N 3.2Å; I79-A82 PolarHBondContact O-N 3.05Å; A82-Q86 CarbonylContact O-C 3.56Å; A82-Q86 WeakPolarHBondContact O-CA 3.49Å; A82-Q86 PolarHBondContact O-N 3.33Å; A82-V87 PolarHBondContact O-N 2.89Å; A82-I90 HydrophobicContact CB-CB 4.17Å; A82-I90 HydrophobicContact CB-CD1 4.21Å; A82-I90 HydrophobicContact CB-CG2 4.03Å; A82-L91 HydrophobicContact CB-CD2 4.25Å
83	S	93.6	Very high	91.7	Very high	35 Å²	35	45.5 Å²	45.5	25%	0.245	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-50	174.5	-170.4	0	0	0	0	110.7	I79 E80 T81 L85 Q86	I79-S83 WeakPolarHBondContact O-CB 3.42Å; I79-S83 PolarHBondContact O-N 2.78Å; E80-S83 PolarHBondContact O-N 2.89Å; T81-S83 VanDerWaalsContact C-N 3.33Å; T81-S83 PolarHBondContact O-N 3.15Å; S83-L85 PolarHBondContact O-N 2.63Å; S83-Q86 PolarHBondContact O-N 3.29Å
84	F	94	Very high	92.2	Very high	96 Å²	96	37.6 Å²	37.6	42%	0.421	19%	0.191	S	C	.	.	H	α-helix	trans	-59.4	-49	179.2	-177.4	-89.4	0	0	0	112.2	L51 E80 T81 Q86	L51-F84 HydrophobicContact CD1-CD1 3.87Å; L51-F84 HydrophobicContact CD1-CE1 4.07Å; L51-F84 HydrophobicContact CD2-CB 3.9Å; L51-F84 HydrophobicContact CD2-CD1 3.73Å; L51-F84 HydrophobicContact CD2-CD2 4.49Å; L51-F84 HydrophobicContact CD2-CE1 4.39Å; L51-F84 HydrophobicContact CD2-CG 3.79Å; L51-F84 HydrophobicContact CG-CD1 4.11Å; L51-F84 HydrophobicContact CG-CE1 4.34Å; E80-F84 WeakPolarHBondContact O-CB 3.39Å; E80-F84 PolarHBondContact O-N 2.6Å; T81-F84 PolarHBondContact O-N 3.38Å; F84-Q86 PolarHBondContact O-N 3.01Å
85	L	94.1	Very high	92.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	3.3	177.9	-62.6	179.5	0	0	0	113.2	S27 Y29 F30 L48 L51 L56 V59 T81 S83 V87	S27-L85 WeakPolarHBondContact CB-O 3.23Å; S27-L85 PolarHBondContact OG-O 2.79Å; Y29-L85 WeakPolarHBondContact CB-O 3.45Å; Y29-L85 HydrophobicContact CD1-CD2 3.87Å; Y29-L85 HydrophobicContact CE1-CD2 4.22Å; Y29-L85 HydrophobicContact CG-CD2 4.38Å; F30-L85 HydrophobicContact CE2-CD1 4.23Å; F30-L85 HydrophobicContact CE2-CD2 3.89Å; F30-L85 HydrophobicContact CZ-CD2 3.99Å; L48-L85 HydrophobicContact CD1-CD2 4.06Å; L48-L85 HydrophobicContact CD2-CD2 4.49Å; L51-L85 HydrophobicContact CD1-CD1 4.45Å; L51-L85 HydrophobicContact CD1-CD2 4.28Å; L51-L85 HydrophobicContact CD1-CG 4.34Å; L56-L85 HydrophobicContact CD1-CD1 3.96Å; V59-L85 HydrophobicContact CG1-CD1 4.1Å; T81-L85 HydrophobicContact CG2-CD1 3.77Å; T81-L85 HydrophobicContact CG2-CG 4.27Å; T81-L85 VanDerWaalsContact O-CB 3.32Å; T81-L85 WeakPolarHBondContact O-CB 3.14Å; T81-L85 WeakPolarHBondContact O-CG 3.2Å; T81-L85 PolarHBondContact O-N 3.29Å; S83-L85 PolarHBondContact O-N 2.63Å; L85-V87 VanDerWaalsContact C-N 3.28Å; L85-V87 HydrophobicContact CB-CG2 3.95Å; L85-V87 PolarHBondContact O-N 2.95Å
86	Q	93.8	Very high	92.5	Very high	96 Å²	96	41.7 Å²	41.7	45%	0.449	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	44.9	178.4	-55.3	179	17.3	0	0	113.1	D28 A82 S83 F84 T88	D28-Q86 HydrophobicContact CB-CB 3.96Å; D28-Q86 PolarHBondContact N-O 3.28Å; A82-Q86 CarbonylContact O-C 3.56Å; A82-Q86 WeakPolarHBondContact O-CA 3.49Å; A82-Q86 PolarHBondContact O-N 3.33Å; S83-Q86 PolarHBondContact O-N 3.29Å; F84-Q86 PolarHBondContact O-N 3.01Å; Q86-T88 VanDerWaalsContact C-N 3.28Å; Q86-T88 PolarHBondContact O-N 3.48Å; Q86-T88 VanDerWaalsContact O-N 3.1Å
87	V	94.2	Very high	92.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.			trans	-87.3	71.6	176.6	-171	0	0	0	0	108.8	V59 F62 A82 L85 S89 I90	V59-V87 HydrophobicContact CG1-CG2 3.79Å; F62-V87 HydrophobicContact CD1-CG1 4.17Å; F62-V87 HydrophobicContact CE1-CG1 4.2Å; A82-V87 PolarHBondContact O-N 2.89Å; L85-V87 VanDerWaalsContact C-N 3.28Å; L85-V87 HydrophobicContact CB-CG2 3.95Å; L85-V87 PolarHBondContact O-N 2.95Å; V87-S89 PolarHBondContact O-N 3.01Å; V87-I90 HydrophobicContact CB-CD1 4.08Å; V87-I90 HydrophobicContact CB-CG1 4.44Å; V87-I90 HydrophobicContact CG1-CB 4.4Å; V87-I90 HydrophobicContact CG1-CD1 3.61Å; V87-I90 HydrophobicContact CG1-CG1 3.73Å; V87-I90 PolarHBondContact O-N 3.46Å
88	T	91	Very high	92.4	Very high	58 Å²	58	39.7 Å²	39.7	36%	0.356	21%	0.211	S	C	.	.	H	α-helix	trans	-57.5	-24.4	-173.4	57.4	0	0	0	0	114	Q86 I90 L91 K92	Q86-T88 VanDerWaalsContact C-N 3.28Å; Q86-T88 PolarHBondContact O-N 3.48Å; Q86-T88 VanDerWaalsContact O-N 3.1Å; T88-I90 VanDerWaalsContact C-N 3.35Å; T88-I90 PolarHBondContact O-N 3Å; T88-L91 PolarHBondContact O-N 3.16Å; T88-K92 WeakPolarHBondContact O-CG 3.21Å; T88-K92 PolarHBondContact O-N 3.01Å
89	S	91.4	Very high	92.4	Very high	44 Å²	44	45.8 Å²	45.8	31%	0.308	23%	0.234	S	C	.	.	H	α-helix	trans	-64.7	-35.9	176.3	-62.4	0	0	0	0	112.7	V87 L93	V87-S89 PolarHBondContact O-N 3.01Å; S89-L93 PolarHBondContact O-N 2.96Å
90	I	91.6	Very high	92.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.7	-45.6	175.3	-66.8	173.4	0	0	0	109.7	V59 F62 L78 A82 V87 T88 K92 L93 L94	V59-I90 HydrophobicContact CB-CD1 4.31Å; V59-I90 HydrophobicContact CG1-CD1 4.24Å; V59-I90 HydrophobicContact CG2-CD1 3.86Å; F62-I90 HydrophobicContact CB-CD1 3.9Å; F62-I90 HydrophobicContact CB-CG1 4.21Å; F62-I90 HydrophobicContact CD1-CD1 3.62Å; F62-I90 HydrophobicContact CD1-CG1 3.31Å; F62-I90 HydrophobicContact CD2-CG1 3.95Å; F62-I90 HydrophobicContact CE1-CD1 4.3Å; F62-I90 HydrophobicContact CE1-CG1 3.54Å; F62-I90 HydrophobicContact CE2-CG1 4.14Å; F62-I90 HydrophobicContact CG-CD1 3.76Å; F62-I90 HydrophobicContact CG-CG1 3.53Å; F62-I90 HydrophobicContact CZ-CG1 3.94Å; L78-I90 HydrophobicContact CD1-CD1 4.26Å; L78-I90 HydrophobicContact CD1-CG2 4.06Å; L78-I90 HydrophobicContact CD2-CG2 4.34Å; L78-I90 HydrophobicContact CG-CG2 4.2Å; A82-I90 HydrophobicContact CB-CB 4.17Å; A82-I90 HydrophobicContact CB-CD1 4.21Å; A82-I90 HydrophobicContact CB-CG2 4.03Å; V87-I90 HydrophobicContact CB-CD1 4.08Å; V87-I90 HydrophobicContact CB-CG1 4.44Å; V87-I90 HydrophobicContact CG1-CB 4.4Å; V87-I90 HydrophobicContact CG1-CD1 3.61Å; V87-I90 HydrophobicContact CG1-CG1 3.73Å; V87-I90 PolarHBondContact O-N 3.46Å; T88-I90 VanDerWaalsContact C-N 3.35Å; T88-I90 PolarHBondContact O-N 3Å; I90-K92 VanDerWaalsContact C-N 3.28Å; I90-K92 PolarHBondContact O-N 3.43Å; I90-L93 WeakPolarHBondContact O-CA 3.42Å; I90-L93 WeakPolarHBondContact O-CB 3.07Å; I90-L93 PolarHBondContact O-N 3.14Å; I90-L94 HydrophobicContact CG2-CD1 4.23Å; I90-L94 HydrophobicContact CG2-CG 4.41Å; I90-L94 WeakPolarHBondContact O-CG 3.31Å; I90-L94 PolarHBondContact O-N 3.36Å
91	L	90.3	Very high	92.1	Very high	25 Å²	25	49.9 Å²	49.9	13%	0.131	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-36.6	179.7	-57.2	179.9	0	0	0	112.2	A82 T88 S95 I115	A82-L91 HydrophobicContact CB-CD2 4.25Å; T88-L91 PolarHBondContact O-N 3.16Å; L91-S95 PolarHBondContact O-N 2.94Å; L91-S95 PolarHBondContact O-OG 3.37Å; L91-I115 HydrophobicContact CD1-CD1 4.16Å; L91-I115 HydrophobicContact CD1-CG2 3.97Å; L91-I115 HydrophobicContact CD2-CD1 3.77Å
92	K	90.8	Very high	92	Very high	144 Å²	144	51 Å²	51	63%	0.626	26%	0.262	S	S	*	.	H	α-helix	trans	-66.7	-41.2	172.3	-73.8	176	-178.1	177	0	112.2	T88 I90 S95 S96	T88-K92 WeakPolarHBondContact O-CG 3.21Å; T88-K92 PolarHBondContact O-N 3.01Å; I90-K92 VanDerWaalsContact C-N 3.28Å; I90-K92 PolarHBondContact O-N 3.43Å; K92-S95 WeakPolarHBondContact O-CB 3.34Å; K92-S95 PolarHBondContact O-N 2.82Å; K92-S96 PolarHBondContact O-N 3.49Å; K92-S96 VanDerWaalsContact O-N 3.15Å
93	L	90.5	Very high	92	Very high	45 Å²	45	51 Å²	51	24%	0.236	26%	0.262	C	S	.	.	H	α-helix	trans	-60.6	-49	175	-179.5	67.3	0	0	0	110.6	F62 V68 S89 I90 S95 S96 E97	F62-L93 HydrophobicContact CE2-CD2 4.14Å; V68-L93 HydrophobicContact CG1-CD2 3.88Å; S89-L93 PolarHBondContact O-N 2.96Å; I90-L93 WeakPolarHBondContact O-CA 3.42Å; I90-L93 WeakPolarHBondContact O-CB 3.07Å; I90-L93 PolarHBondContact O-N 3.14Å; L93-S95 VanDerWaalsContact C-N 3.26Å; L93-S95 PolarHBondContact O-N 3.02Å; L93-S96 WeakPolarHBondContact O-CA 3.42Å; L93-S96 PolarHBondContact O-N 2.89Å; L93-S96 PolarHBondContact O-OG 3.07Å; L93-E97 HydrophobicContact CD1-CG 4.45Å; L93-E97 PolarHBondContact O-N 3.33Å; L93-E97 VanDerWaalsContact O-N 3.09Å
94	L	90.9	Very high	92.1	Very high	10 Å²	10	49.9 Å²	49.9	5%	0.052	25%	0.254	C	S	.	.	H	α-helix	trans	-57.9	-39.2	176.2	-67.6	175.7	0	0	0	112.1	V70 L75 I79 I90 S96 E97 I98 L118	V70-L94 HydrophobicContact CG2-CD2 4.19Å; L75-L94 HydrophobicContact CD1-CD2 4.21Å; I79-L94 HydrophobicContact CD1-CD1 4.03Å; I79-L94 HydrophobicContact CG1-CD1 3.63Å; I90-L94 HydrophobicContact CG2-CD1 4.23Å; I90-L94 HydrophobicContact CG2-CG 4.41Å; I90-L94 WeakPolarHBondContact O-CG 3.31Å; I90-L94 PolarHBondContact O-N 3.36Å; L94-S96 PolarHBondContact O-N 3.34Å; L94-E97 PolarHBondContact O-N 3.33Å; L94-I98 WeakPolarHBondContact O-CG1 3.47Å; L94-I98 PolarHBondContact O-N 2.87Å; L94-L118 HydrophobicContact CB-CD1 4.32Å
95	S	91.9	Very high	92	Very high	35 Å²	35	48.7 Å²	48.7	25%	0.245	25%	0.25	C	C	.	.	H	α-helix	trans	-64.2	-27.8	175.8	-57.8	0	0	0	0	113.2	L91 K92 L93 I98	L91-S95 PolarHBondContact O-N 2.94Å; L91-S95 PolarHBondContact O-OG 3.37Å; K92-S95 WeakPolarHBondContact O-CB 3.34Å; K92-S95 PolarHBondContact O-N 2.82Å; L93-S95 VanDerWaalsContact C-N 3.26Å; L93-S95 PolarHBondContact O-N 3.02Å; S95-I98 WeakPolarHBondContact O-CD1 3.44Å
96	S	91	Very high	92	Very high	89 Å²	89	48.7 Å²	48.7	62%	0.622	25%	0.25	S	C	*	.	H	α-helix	trans	-86.1	-17.2	176.3	69.1	0	0	0	0	114	K92 L93 L94	K92-S96 PolarHBondContact O-N 3.49Å; K92-S96 VanDerWaalsContact O-N 3.15Å; L93-S96 WeakPolarHBondContact O-CA 3.42Å; L93-S96 PolarHBondContact O-N 2.89Å; L93-S96 PolarHBondContact O-OG 3.07Å; L94-S96 PolarHBondContact O-N 3.34Å
97	E	90.3	Very high	92.1	Very high	79 Å²	79	44.8 Å²	44.8	37%	0.369	23%	0.231	S	C	.	.	S	Bend	trans	-110.3	26.9	-177.3	-65.5	-159.9	-162	0	0	113.3	L93 L94 R99 N102	L93-E97 HydrophobicContact CD1-CG 4.45Å; L93-E97 PolarHBondContact O-N 3.33Å; L93-E97 VanDerWaalsContact O-N 3.09Å; L94-E97 PolarHBondContact O-N 3.33Å; E97-R99 WeakPolarHBondContact O-CG 3.36Å; E97-R99 PolarHBondContact O-N 2.89Å; E97-R99 IonicContact OE2-NH2 3.88Å; E97-R99 PolarHBondContact OE2-NH2 2.93Å; E97-N102 PolarHBondContact O-ND2 3.48Å
98	I	93.3	Very high	92.2	Very high	18 Å²	18	47.4 Å²	47.4	9%	0.092	25%	0.25	C	C	.	.			trans	-67.2	128.4	174.4	-57.5	174.2	0	0	0	109.4	L94 S95 C103 L106 A121 Y125	L94-I98 WeakPolarHBondContact O-CG1 3.47Å; L94-I98 PolarHBondContact O-N 2.87Å; S95-I98 WeakPolarHBondContact O-CD1 3.44Å; I98-C103 HydrophobicContact CG2-CB 3.69Å; I98-C103 WeakPolarHBondContact CG2-SG 3.36Å; I98-L106 HydrophobicContact CG1-CD1 4.2Å; I98-A121 HydrophobicContact CD1-CB 3.59Å; I98-Y125 HydrophobicContact CB-CD2 4.16Å; I98-Y125 HydrophobicContact CB-CG 4.29Å; I98-Y125 HydrophobicContact CG2-CD1 3.71Å; I98-Y125 HydrophobicContact CG2-CD2 3.81Å; I98-Y125 HydrophobicContact CG2-CE1 4.24Å; I98-Y125 HydrophobicContact CG2-CE2 4.32Å; I98-Y125 HydrophobicContact CG2-CG 3.48Å; I98-Y125 VanDerWaalsContact CG2-CG 3.48Å; I98-Y125 WeakPolarHBondContact O-CE2 3.45Å
99	R	92.3	Very high	92.3	Very high	129 Å²	129	45.3 Å²	45.3	49%	0.487	24%	0.236	S	C	.	.			trans	-132.1	163.2	-178.8	-58.6	173.6	-149.8	-167.3	5.1	109.6	E97 E101 N102 C103	E97-R99 WeakPolarHBondContact O-CG 3.36Å; E97-R99 PolarHBondContact O-N 2.89Å; E97-R99 IonicContact OE2-NH2 3.88Å; E97-R99 PolarHBondContact OE2-NH2 2.93Å; R99-E101 WeakPolarHBondContact CB-OE2 3.43Å; R99-E101 PolarHBondContact O-N 3.34Å; R99-E101 VanDerWaalsContact O-N 3.14Å; R99-N102 PolarHBondContact N-OD1 2.86Å; R99-N102 PolarHBondContact O-N 3.44Å; R99-N102 PolarHBondContact O-OD1 3Å; R99-C103 VanDerWaalsContact O-CB 3.23Å; R99-C103 WeakPolarHBondContact O-CB 3.5Å; R99-C103 PolarHBondContact O-N 3.29Å
100	P	91.4	Very high	92.5	Very high	40 Å²	40	43.2 Å²	43.2	26%	0.26	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-28	179.5	-21.5	35	0	0	0	112.9	Y125 M133	P100-Y125 WeakPolarHBondContact CD-OH 3.39Å; P100-Y125 HydrophobicContact CG-CE1 4.42Å; P100-Y125 WeakPolarHBondContact CG-OH 3.4Å; P100-M133 HydrophobicContact CB-SD 4.45Å
101	E	90.2	Very high	92.6	Very high	105 Å²	105	47.1 Å²	47.1	49%	0.491	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-34	-177.5	-61.1	60.4	-123.6	0	0	113.2	R99 R136	R99-E101 WeakPolarHBondContact CB-OE2 3.43Å; R99-E101 PolarHBondContact O-N 3.34Å; R99-E101 VanDerWaalsContact O-N 3.14Å; E101-R136 VanDerWaalsContact CG-NH2 3.31Å; E101-R136 IonicContact OE1-NH2 3.55Å; E101-R136 PolarHBondContact OE1-NH2 3.48Å
102	N	91.6	Very high	92.8	Very high	22 Å²	22	51.1 Å²	51.1	12%	0.118	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-12.3	-172.7	67.7	5.9	0	0	0	113.4	E97 R99 V104 E105 L106	E97-N102 PolarHBondContact O-ND2 3.48Å; R99-N102 PolarHBondContact N-OD1 2.86Å; R99-N102 PolarHBondContact O-N 3.44Å; R99-N102 PolarHBondContact O-OD1 3Å; N102-V104 PolarHBondContact O-N 3.44Å; N102-E105 PolarHBondContact O-N 3.15Å; N102-L106 HydrophobicContact CB-CD1 4.15Å; N102-L106 HydrophobicContact CB-CG 4.31Å; N102-L106 WeakPolarHBondContact O-CB 3.45Å; N102-L106 VanDerWaalsContact O-CG 3.24Å; N102-L106 WeakPolarHBondContact O-CG 3.35Å; N102-L106 PolarHBondContact O-N 3.43Å
103	C	94.6	Very high	92.9	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-40.1	-168.1	-170.9	0	0	0	0	114.3	I98 R99 Y107 C122 Y125 M126	I98-C103 HydrophobicContact CG2-CB 3.69Å; I98-C103 WeakPolarHBondContact CG2-SG 3.36Å; R99-C103 VanDerWaalsContact O-CB 3.23Å; R99-C103 WeakPolarHBondContact O-CB 3.5Å; R99-C103 PolarHBondContact O-N 3.29Å; C103-Y107 WeakPolarHBondContact O-CB 3.45Å; C103-Y107 PolarHBondContact O-N 3.27Å; C103-C122 PolarHBondContact SG-O 3.19Å; C103-Y125 HydrophobicContact CB-CD1 4.06Å; C103-Y125 HydrophobicContact CB-CE1 4.42Å; C103-M126 HydrophobicContact CB-CG 4.47Å; C103-M126 WeakPolarHBondContact SG-CG 3.49Å
104	V	94.8	Very high	93	Very high	13 Å²	13	46.9 Å²	46.9	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-70.1	-40.5	-179.1	178.9	0	0	0	0	111.4	N102 Y107 S108 M126 M133 E138 L142	N102-V104 PolarHBondContact O-N 3.44Å; V104-Y107 WeakPolarHBondContact O-CB 3.25Å; V104-Y107 PolarHBondContact O-N 3.03Å; V104-S108 PolarHBondContact O-N 2.81Å; V104-S108 PolarHBondContact O-OG 3.26Å; V104-M126 HydrophobicContact CG2-SD 4.23Å; V104-M133 HydrophobicContact CG2-CE 3.55Å; V104-E138 HydrophobicContact CB-CB 4.13Å; V104-E138 HydrophobicContact CG1-CB 4.03Å; V104-E138 WeakPolarHBondContact CG1-O 3.4Å; V104-E138 HydrophobicContact CG2-CB 4.22Å; V104-L142 HydrophobicContact CG1-CD2 4.02Å; V104-L142 HydrophobicContact CG1-CG 4.22Å
105	E	93	Very high	93.2	Very high	70 Å²	70	47.2 Å²	47.2	33%	0.327	26%	0.257	S	S	.	.	H	α-helix	trans	-67.5	-48.2	176.9	-175.3	175	-164.7	0	0	110.6	L75 N102 Y107 S108 L109	L75-E105 HydrophobicContact CD2-CG 4.07Å; N102-E105 PolarHBondContact O-N 3.15Å; E105-Y107 VanDerWaalsContact C-N 3.25Å; E105-Y107 PolarHBondContact O-N 2.73Å; E105-S108 PolarHBondContact O-N 3.19Å; E105-L109 HydrophobicContact CG-CD1 3.98Å; E105-L109 HydrophobicContact CG-CG 4.45Å; E105-L109 WeakPolarHBondContact O-CG 3.14Å; E105-L109 PolarHBondContact O-N 2.99Å
106	L	94.3	Very high	93.3	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-54.9	-41.9	173.2	-73.1	176	0	0	0	112	L75 I79 I98 N102 S110 L118	L75-L106 HydrophobicContact CD1-CD2 3.71Å; L75-L106 HydrophobicContact CD2-CD2 3.84Å; L75-L106 HydrophobicContact CD2-CG 4.2Å; L75-L106 HydrophobicContact CG-CD2 4.21Å; I79-L106 HydrophobicContact CD1-CD2 3.59Å; I98-L106 HydrophobicContact CG1-CD1 4.2Å; N102-L106 HydrophobicContact CB-CD1 4.15Å; N102-L106 HydrophobicContact CB-CG 4.31Å; N102-L106 WeakPolarHBondContact O-CB 3.45Å; N102-L106 VanDerWaalsContact O-CG 3.24Å; N102-L106 WeakPolarHBondContact O-CG 3.35Å; N102-L106 PolarHBondContact O-N 3.43Å; L106-S110 WeakPolarHBondContact O-CB 3.4Å; L106-S110 PolarHBondContact O-N 3.28Å; L106-S110 PolarHBondContact O-OG 2.96Å; L106-L118 HydrophobicContact CD2-CD2 4.46Å
107	Y	95.8	Very high	93.4	Very high	15 Å²	15	52.8 Å²	52.8	6%	0.059	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-50.3	174.6	171.7	-96.5	0	0	0	111.4	C103 V104 E105 L109 S110 E111 R119 C122 L123 M126 L142 V146	C103-Y107 WeakPolarHBondContact O-CB 3.45Å; C103-Y107 PolarHBondContact O-N 3.27Å; V104-Y107 WeakPolarHBondContact O-CB 3.25Å; V104-Y107 PolarHBondContact O-N 3.03Å; E105-Y107 VanDerWaalsContact C-N 3.25Å; E105-Y107 PolarHBondContact O-N 2.73Å; Y107-L109 PolarHBondContact O-N 3.33Å; Y107-S110 WeakPolarHBondContact CA-OG 3.48Å; Y107-S110 PolarHBondContact O-N 2.87Å; Y107-S110 PolarHBondContact O-OG 3.2Å; Y107-E111 HydrophobicContact CE1-CG 4.15Å; Y107-E111 HydrophobicContact CE2-CG 4.28Å; Y107-E111 PolarHBondContact O-N 2.89Å; Y107-R119 HydrophobicContact CD2-CG 3.95Å; Y107-R119 HydrophobicContact CE2-CG 3.71Å; Y107-C122 HydrophobicContact CD2-CB 4.37Å; Y107-L123 HydrophobicContact CD2-CD2 4.01Å; Y107-L123 HydrophobicContact CD2-CG 3.98Å; Y107-L123 HydrophobicContact CE2-CD1 4.08Å; Y107-L123 HydrophobicContact CE2-CD2 3.53Å; Y107-L123 HydrophobicContact CE2-CG 3.68Å; Y107-M126 HydrophobicContact CD2-CE 4.02Å; Y107-M126 HydrophobicContact CG-CE 3.94Å; Y107-L142 HydrophobicContact CD1-CD2 3.88Å; Y107-L142 HydrophobicContact CE1-CD2 4.02Å; Y107-V146 HydrophobicContact CE1-CG1 4.27Å; Y107-V146 HydrophobicContact CE1-CG2 4.44Å; Y107-V146 WeakPolarHBondContact OH-CG2 3.47Å
108	S	94.7	Very high	93.7	Very high	55 Å²	55	49 Å²	49	39%	0.385	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-44.8	-178.5	-55.6	0	0	0	0	111.7	V104 E105 E111 V112	V104-S108 PolarHBondContact O-N 2.81Å; V104-S108 PolarHBondContact O-OG 3.26Å; E105-S108 PolarHBondContact O-N 3.19Å; S108-E111 WeakPolarHBondContact O-CB 3.45Å; S108-E111 PolarHBondContact O-N 3.02Å; S108-V112 WeakPolarHBondContact O-CG2 3.44Å; S108-V112 PolarHBondContact O-N 2.86Å; S108-V112 VanDerWaalsContact O-N 3.12Å
109	L	93.9	Very high	93.8	Very high	13 Å²	13	51.4 Å²	51.4	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-39.2	176.2	-65.1	171.5	0	0	0	111.6	L75 E76 I79 E105 Y107 E111 V112 Y113	L75-L109 HydrophobicContact CD2-CD1 4.33Å; L75-L109 HydrophobicContact CG-CD1 4.03Å; E76-L109 HydrophobicContact CB-CD1 4.22Å; E76-L109 HydrophobicContact CB-CD2 3.9Å; E76-L109 HydrophobicContact CG-CD2 3.71Å; I79-L109 HydrophobicContact CD1-CB 4.02Å; I79-L109 HydrophobicContact CD1-CD1 3.73Å; I79-L109 HydrophobicContact CG2-CB 4.32Å; E105-L109 HydrophobicContact CG-CD1 3.98Å; E105-L109 HydrophobicContact CG-CG 4.45Å; E105-L109 WeakPolarHBondContact O-CG 3.14Å; E105-L109 PolarHBondContact O-N 2.99Å; Y107-L109 PolarHBondContact O-N 3.33Å; L109-E111 PolarHBondContact O-N 2.92Å; L109-V112 PolarHBondContact O-N 3.06Å; L109-Y113 HydrophobicContact CB-CD2 4.37Å; L109-Y113 HydrophobicContact CD2-CE2 4.02Å; L109-Y113 WeakPolarHBondContact O-CD2 3.28Å; L109-Y113 PolarHBondContact O-N 2.99Å
110	S	95.3	Very high	94	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-29.7	176.6	74.8	0	0	0	0	113.1	L106 Y107 G114 I115 R119	L106-S110 WeakPolarHBondContact O-CB 3.4Å; L106-S110 PolarHBondContact O-N 3.28Å; L106-S110 PolarHBondContact O-OG 2.96Å; Y107-S110 WeakPolarHBondContact CA-OG 3.48Å; Y107-S110 PolarHBondContact O-N 2.87Å; Y107-S110 PolarHBondContact O-OG 3.2Å; S110-G114 CarbonylContact O-C 3.49Å; S110-G114 WeakPolarHBondContact O-CA 3.35Å; S110-G114 PolarHBondContact O-N 3.31Å; S110-G114 VanDerWaalsContact O-N 3.09Å; S110-I115 PolarHBondContact O-N 3.26Å; S110-R119 WeakPolarHBondContact OG-CA 3.43Å; S110-R119 VanDerWaalsContact OG-CB 3.23Å; S110-R119 WeakPolarHBondContact OG-CB 3.44Å; S110-R119 PolarHBondContact OG-N 3.46Å
111	E	93.9	Very high	94.2	Very high	83 Å²	83	48.4 Å²	48.4	39%	0.388	26%	0.262	S	S	.	.	H	α-helix	trans	-71.8	-46.9	173	-77.7	-76.7	78.6	0	0	111.4	Y107 S108 L109 Y113 G114 R119	Y107-E111 HydrophobicContact CE1-CG 4.15Å; Y107-E111 HydrophobicContact CE2-CG 4.28Å; Y107-E111 PolarHBondContact O-N 2.89Å; S108-E111 WeakPolarHBondContact O-CB 3.45Å; S108-E111 PolarHBondContact O-N 3.02Å; L109-E111 PolarHBondContact O-N 2.92Å; E111-Y113 PolarHBondContact O-N 3.28Å; E111-G114 PolarHBondContact O-N 3.42Å; E111-R119 VanDerWaalsContact CD-CD 3.49Å; E111-R119 WeakPolarHBondContact OE1-CD 3.48Å; E111-R119 IonicContact OE1-CZ 3.94Å; E111-R119 IonicContact OE1-NE 3.09Å; E111-R119 IonicContact OE1-NH1 2.75Å; E111-R119 PolarHBondContact OE1-NH1 3.22Å
112	V	94	Very high	94.5	Very high	109 Å²	109	43.4 Å²	43.4	66%	0.661	24%	0.239	S	C	*	.	H	α-helix	trans	-59.5	-45.7	179.4	172.3	0	0	0	0	111.3	S108 L109	S108-V112 WeakPolarHBondContact O-CG2 3.44Å; S108-V112 PolarHBondContact O-N 2.86Å; S108-V112 VanDerWaalsContact O-N 3.12Å; L109-V112 PolarHBondContact O-N 3.06Å
113	Y	93.2	Very high	94.8	Very high	57 Å²	57	42.8 Å²	42.8	22%	0.224	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	5.6	-176.8	-61.3	-67.3	0	0	0	114.1	I79 E80 L109 E111 I115	I79-Y113 HydrophobicContact CG2-CD2 3.64Å; I79-Y113 HydrophobicContact CG2-CE2 4.25Å; I79-Y113 HydrophobicContact CG2-CG 4.35Å; E80-Y113 HydrophobicContact CB-CE1 3.8Å; E80-Y113 HydrophobicContact CB-CE2 4.2Å; E80-Y113 HydrophobicContact CG-CE1 3.67Å; L109-Y113 HydrophobicContact CB-CD2 4.37Å; L109-Y113 HydrophobicContact CD2-CE2 4.02Å; L109-Y113 WeakPolarHBondContact O-CD2 3.28Å; L109-Y113 PolarHBondContact O-N 2.99Å; E111-Y113 PolarHBondContact O-N 3.28Å; Y113-I115 PolarHBondContact O-N 3.39Å
114	G	93.3	Very high	94.8	Very high	42 Å²	42	49.3 Å²	49.3	43%	0.433	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	28	175.3	0	0	0	0	0	115.3	S110 E111 H116	S110-G114 CarbonylContact O-C 3.49Å; S110-G114 WeakPolarHBondContact O-CA 3.35Å; S110-G114 PolarHBondContact O-N 3.31Å; S110-G114 VanDerWaalsContact O-N 3.09Å; E111-G114 PolarHBondContact O-N 3.42Å; G114-H116 PolarHBondContact O-N 2.88Å
115	I	94.3	Very high	94.9	Very high	17 Å²	17	51 Å²	51	9%	0.087	27%	0.269	C	S	.	.			trans	-89	83.4	-174.7	-47.5	177.5	0	0	0	110.3	I79 L91 S110 Y113 D117 L118 R119	I79-I115 HydrophobicContact CG2-CD1 3.59Å; L91-I115 HydrophobicContact CD1-CD1 4.16Å; L91-I115 HydrophobicContact CD1-CG2 3.97Å; L91-I115 HydrophobicContact CD2-CD1 3.77Å; S110-I115 PolarHBondContact O-N 3.26Å; Y113-I115 PolarHBondContact O-N 3.39Å; I115-D117 PolarHBondContact O-N 3.21Å; I115-L118 HydrophobicContact CB-CB 4.32Å; I115-L118 HydrophobicContact CG2-CB 3.7Å; I115-L118 PolarHBondContact O-N 3.03Å; I115-R119 WeakPolarHBondContact O-CB 3.4Å; I115-R119 PolarHBondContact O-N 3.39Å
116	H	94.1	Very high	95.1	Very high	110 Å²	110	47.7 Å²	47.7	51%	0.509	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-37.4	-171.3	-64.1	-35.3	0	0	0	115.5	G114 R119 T120	G114-H116 PolarHBondContact O-N 2.88Å; H116-R119 PolarHBondContact ND1-NH2 2.88Å; H116-T120 WeakPolarHBondContact O-CB 3.47Å; H116-T120 PolarHBondContact O-N 3.31Å; H116-T120 PolarHBondContact O-OG1 2.86Å
117	D	93.8	Very high	95.2	Very high	132 Å²	132	47.9 Å²	47.9	71%	0.706	26%	0.255	S	S	*	.	H	α-helix	trans	-67	-46.2	-179.2	-72	-18.2	0	0	0	111.3	I115 T120 A121	I115-D117 PolarHBondContact O-N 3.21Å; D117-T120 PolarHBondContact O-N 3.12Å; D117-A121 WeakPolarHBondContact O-CB 3.43Å; D117-A121 PolarHBondContact O-N 3.26Å
118	L	95	Very high	95.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-45.1	176.9	-179.3	60.1	0	0	0	110.6	I79 L94 L106 I115 T120 A121 C122	I79-L118 HydrophobicContact CD1-CD2 4.36Å; L94-L118 HydrophobicContact CB-CD1 4.32Å; L106-L118 HydrophobicContact CD2-CD2 4.46Å; I115-L118 HydrophobicContact CB-CB 4.32Å; I115-L118 HydrophobicContact CG2-CB 3.7Å; I115-L118 PolarHBondContact O-N 3.03Å; L118-T120 VanDerWaalsContact C-N 3.31Å; L118-T120 PolarHBondContact O-N 3.18Å; L118-A121 WeakPolarHBondContact O-CB 3.23Å; L118-A121 PolarHBondContact O-N 3.47Å; L118-A121 VanDerWaalsContact O-N 3.16Å; L118-C122 PolarHBondContact O-N 3.12Å; L118-C122 PolarHBondContact O-SG 3.39Å
119	R	96.1	Very high	95.3	Very high	68 Å²	68	47.2 Å²	47.2	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-53.7	-48.7	174.9	-175.3	179.1	70.6	-173.5	1.3	112.2	Y107 S110 E111 I115 H116 A121 C122 L123	Y107-R119 HydrophobicContact CD2-CG 3.95Å; Y107-R119 HydrophobicContact CE2-CG 3.71Å; S110-R119 WeakPolarHBondContact OG-CA 3.43Å; S110-R119 VanDerWaalsContact OG-CB 3.23Å; S110-R119 WeakPolarHBondContact OG-CB 3.44Å; S110-R119 PolarHBondContact OG-N 3.46Å; E111-R119 VanDerWaalsContact CD-CD 3.49Å; E111-R119 WeakPolarHBondContact OE1-CD 3.48Å; E111-R119 IonicContact OE1-CZ 3.94Å; E111-R119 IonicContact OE1-NE 3.09Å; E111-R119 IonicContact OE1-NH1 2.75Å; E111-R119 PolarHBondContact OE1-NH1 3.22Å; I115-R119 WeakPolarHBondContact O-CB 3.4Å; I115-R119 PolarHBondContact O-N 3.39Å; H116-R119 PolarHBondContact ND1-NH2 2.88Å; R119-A121 VanDerWaalsContact C-N 3.34Å; R119-C122 PolarHBondContact O-N 3.3Å; R119-L123 HydrophobicContact CG-CD1 4.28Å; R119-L123 WeakPolarHBondContact O-CG 3.16Å; R119-L123 PolarHBondContact O-N 2.94Å
120	T	95.9	Very high	95.4	Very high	78 Å²	78	46.6 Å²	46.6	48%	0.479	25%	0.245	S	C	.	.	H	α-helix	trans	-66	-39.5	-179.1	-56	0	0	0	0	111.1	H116 D117 L118 L123 K124	H116-T120 WeakPolarHBondContact O-CB 3.47Å; H116-T120 PolarHBondContact O-N 3.31Å; H116-T120 PolarHBondContact O-OG1 2.86Å; D117-T120 PolarHBondContact O-N 3.12Å; L118-T120 VanDerWaalsContact C-N 3.31Å; L118-T120 PolarHBondContact O-N 3.18Å; T120-L123 PolarHBondContact O-N 3.22Å; T120-K124 WeakPolarHBondContact O-CB 3.34Å; T120-K124 PolarHBondContact O-N 2.95Å
121	A	96.3	Very high	95.4	Very high	28 Å²	28	46.8 Å²	46.8	23%	0.231	25%	0.246	C	C	.	.	H	α-helix	trans	-62.6	-43.9	174.7	0	0	0	0	0	111.8	I98 D117 L118 R119 K124 Y125	I98-A121 HydrophobicContact CD1-CB 3.59Å; D117-A121 WeakPolarHBondContact O-CB 3.43Å; D117-A121 PolarHBondContact O-N 3.26Å; L118-A121 WeakPolarHBondContact O-CB 3.23Å; L118-A121 PolarHBondContact O-N 3.47Å; L118-A121 VanDerWaalsContact O-N 3.16Å; R119-A121 VanDerWaalsContact C-N 3.34Å; A121-K124 PolarHBondContact O-N 3.18Å; A121-Y125 WeakPolarHBondContact O-CB 3.35Å; A121-Y125 PolarHBondContact O-N 3.3Å
122	C	97.2	Very high	95.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-47.7	175.6	-67.1	0	0	0	0	112.1	C103 Y107 L118 R119 K124 Y125 M126	C103-C122 PolarHBondContact SG-O 3.19Å; Y107-C122 HydrophobicContact CD2-CB 4.37Å; L118-C122 PolarHBondContact O-N 3.12Å; L118-C122 PolarHBondContact O-SG 3.39Å; R119-C122 PolarHBondContact O-N 3.3Å; C122-K124 VanDerWaalsContact C-N 3.33Å; C122-K124 PolarHBondContact O-N 2.89Å; C122-Y125 WeakPolarHBondContact O-CB 3.24Å; C122-Y125 PolarHBondContact O-N 3.29Å; C122-M126 HydrophobicContact CB-CE 4.49Å; C122-M126 WeakPolarHBondContact O-CG 3.41Å; C122-M126 PolarHBondContact O-N 3.4Å
123	L	97	Very high	95.6	Very high	9 Å²	9	40.6 Å²	40.6	5%	0.047	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-44.4	176.4	-72.7	171.4	0	0	0	111.8	Y107 R119 T120 Y125 M126 S127 V146 L150 M153	Y107-L123 HydrophobicContact CD2-CD2 4.01Å; Y107-L123 HydrophobicContact CD2-CG 3.98Å; Y107-L123 HydrophobicContact CE2-CD1 4.08Å; Y107-L123 HydrophobicContact CE2-CD2 3.53Å; Y107-L123 HydrophobicContact CE2-CG 3.68Å; R119-L123 HydrophobicContact CG-CD1 4.28Å; R119-L123 WeakPolarHBondContact O-CG 3.16Å; R119-L123 PolarHBondContact O-N 2.94Å; T120-L123 PolarHBondContact O-N 3.22Å; L123-Y125 PolarHBondContact O-N 2.91Å; L123-M126 HydrophobicContact CD2-CE 4.03Å; L123-M126 PolarHBondContact O-N 3.47Å; L123-S127 VanDerWaalsContact O-CB 3.26Å; L123-S127 WeakPolarHBondContact O-CB 3.07Å; L123-S127 PolarHBondContact O-N 3.49Å; L123-V146 HydrophobicContact CD2-CG1 3.93Å; L123-L150 HydrophobicContact CB-CD2 4.28Å; L123-L150 HydrophobicContact CD2-CD2 3.82Å; L123-L150 HydrophobicContact CD2-CG 4.39Å; L123-L150 WeakPolarHBondContact O-CD2 3.27Å; L123-M153 HydrophobicContact CB-CE 4.22Å; L123-M153 HydrophobicContact CB-SD 4.15Å
124	K	95.5	Very high	95.6	Very high	137 Å²	137	39.1 Å²	39.1	60%	0.596	21%	0.211	S	C	*	.	H	α-helix	trans	-61.4	-44.6	176	-175.3	178.6	179.4	-177.9	0	111.3	T120 A121 C122 S127 C128 M153	T120-K124 WeakPolarHBondContact O-CB 3.34Å; T120-K124 PolarHBondContact O-N 2.95Å; A121-K124 PolarHBondContact O-N 3.18Å; C122-K124 VanDerWaalsContact C-N 3.33Å; C122-K124 PolarHBondContact O-N 2.89Å; K124-S127 PolarHBondContact O-N 3.09Å; K124-C128 WeakPolarHBondContact O-CB 3.49Å; K124-C128 PolarHBondContact O-N 3.15Å; K124-C128 PolarHBondContact O-SG 2.87Å; K124-M153 HydrophobicContact CB-CE 4.46Å
125	Y	96.5	Very high	95.7	Very high	48 Å²	48	41.6 Å²	41.6	19%	0.188	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-52	177.6	-174.5	-87	0	0	0	111.6	I98 P100 C103 A121 C122 L123 S127 C128 H129	I98-Y125 HydrophobicContact CB-CD2 4.16Å; I98-Y125 HydrophobicContact CB-CG 4.29Å; I98-Y125 HydrophobicContact CG2-CD1 3.71Å; I98-Y125 HydrophobicContact CG2-CD2 3.81Å; I98-Y125 HydrophobicContact CG2-CE1 4.24Å; I98-Y125 HydrophobicContact CG2-CE2 4.32Å; I98-Y125 HydrophobicContact CG2-CG 3.48Å; I98-Y125 VanDerWaalsContact CG2-CG 3.48Å; I98-Y125 WeakPolarHBondContact O-CE2 3.45Å; P100-Y125 WeakPolarHBondContact CD-OH 3.39Å; P100-Y125 HydrophobicContact CG-CE1 4.42Å; P100-Y125 WeakPolarHBondContact CG-OH 3.4Å; C103-Y125 HydrophobicContact CB-CD1 4.06Å; C103-Y125 HydrophobicContact CB-CE1 4.42Å; A121-Y125 WeakPolarHBondContact O-CB 3.35Å; A121-Y125 PolarHBondContact O-N 3.3Å; C122-Y125 WeakPolarHBondContact O-CB 3.24Å; C122-Y125 PolarHBondContact O-N 3.29Å; L123-Y125 PolarHBondContact O-N 2.91Å; Y125-S127 VanDerWaalsContact C-N 3.3Å; Y125-S127 PolarHBondContact O-N 2.69Å; Y125-C128 PolarHBondContact O-N 3.05Å; Y125-C128 VanDerWaalsContact O-N 3.13Å; Y125-H129 AromaticContact CD2-CD2 3.95Å; Y125-H129 HydrophobicContact CE1-CB 4.33Å; Y125-H129 AromaticContact CE1-CD2 3.84Å; Y125-H129 AromaticContact CE2-CD2 3.68Å; Y125-H129 AromaticContact CE2-NE2 3.73Å; Y125-H129 AromaticContact CZ-CD2 3.6Å; Y125-H129 AromaticContact CZ-NE2 3.87Å; Y125-H129 PolarHBondContact O-CD2 3.43Å; Y125-H129 PolarHBondContact O-N 3.19Å
126	M	97.2	Very high	95.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59	-41.9	178.2	-69.6	-171.1	-77.5	0	0	111.9	C103 V104 Y107 C122 L123 H129 Y130 M133 F139 L142 L150	C103-M126 HydrophobicContact CB-CG 4.47Å; C103-M126 WeakPolarHBondContact SG-CG 3.49Å; V104-M126 HydrophobicContact CG2-SD 4.23Å; Y107-M126 HydrophobicContact CD2-CE 4.02Å; Y107-M126 HydrophobicContact CG-CE 3.94Å; C122-M126 HydrophobicContact CB-CE 4.49Å; C122-M126 WeakPolarHBondContact O-CG 3.41Å; C122-M126 PolarHBondContact O-N 3.4Å; L123-M126 HydrophobicContact CD2-CE 4.03Å; L123-M126 PolarHBondContact O-N 3.47Å; M126-H129 CarbonylContact O-C 3.59Å; M126-H129 VanDerWaalsContact O-C 3.32Å; M126-H129 PolarHBondContact O-N 3.32Å; M126-Y130 WeakPolarHBondContact O-CA 3.26Å; M126-Y130 PolarHBondContact O-N 2.96Å; M126-M133 HydrophobicContact CB-CG 4.37Å; M126-M133 HydrophobicContact CG-CE 4.15Å; M126-M133 HydrophobicContact CG-CG 4.35Å; M126-M133 HydrophobicContact SD-CE 4.38Å; M126-F139 HydrophobicContact CB-CE2 4.38Å; M126-F139 HydrophobicContact SD-CD2 4.17Å; M126-F139 HydrophobicContact SD-CE2 4.09Å; M126-L142 HydrophobicContact CE-CD1 4.48Å; M126-L142 HydrophobicContact SD-CD1 3.89Å; M126-L150 HydrophobicContact CB-CD1 3.9Å; M126-L150 HydrophobicContact CB-CD2 3.83Å; M126-L150 HydrophobicContact CE-CD1 4.41Å; M126-L150 HydrophobicContact SD-CD1 4.29Å
127	S	96.7	Very high	95.5	Very high	5 Å²	5	43.7 Å²	43.7	4%	0.035	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-43.8	175.6	175.9	0	0	0	0	111.5	L123 K124 Y125 H129 L150 M153 R154	L123-S127 VanDerWaalsContact O-CB 3.26Å; L123-S127 WeakPolarHBondContact O-CB 3.07Å; L123-S127 PolarHBondContact O-N 3.49Å; K124-S127 PolarHBondContact O-N 3.09Å; Y125-S127 VanDerWaalsContact C-N 3.3Å; Y125-S127 PolarHBondContact O-N 2.69Å; S127-H129 VanDerWaalsContact C-N 3.32Å; S127-H129 PolarHBondContact O-N 3.14Å; S127-L150 PolarHBondContact OG-O 3.46Å; S127-M153 WeakPolarHBondContact OG-CB 3.33Å; S127-R154 VanDerWaalsContact O-CD 3.3Å; S127-R154 WeakPolarHBondContact O-CD 3.27Å; S127-R154 VanDerWaalsContact O-CG 3.29Å; S127-R154 WeakPolarHBondContact O-CG 3.46Å; S127-R154 PolarHBondContact O-NH1 3.27Å; S127-R154 VanDerWaalsContact OG-CG 3.3Å; S127-R154 WeakPolarHBondContact OG-CG 3.48Å; S127-R154 PolarHBondContact OG-N 3.37Å
128	C	95.4	Very high	95.4	Very high	25 Å²	25	41.4 Å²	41.4	17%	0.169	21%	0.208	C	C	.	.	H	α-helix	trans	-67.5	-30.5	177	-71.3	0	0	0	0	112.9	K124 Y125 Y218 N239 C241	K124-C128 WeakPolarHBondContact O-CB 3.49Å; K124-C128 PolarHBondContact O-N 3.15Å; K124-C128 PolarHBondContact O-SG 2.87Å; Y125-C128 PolarHBondContact O-N 3.05Å; Y125-C128 VanDerWaalsContact O-N 3.13Å; C128-Y218 PolarHBondContact O-OH 3.2Å; C128-N239 PolarHBondContact O-ND2 2.96Å; C128-C241 HydrophobicContact CB-CB 4.17Å
129	H	95.8	Very high	95.4	Very high	30 Å²	30	41.5 Å²	41.5	14%	0.139	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.7	30.4	-178.3	-69.8	-87.6	0	0	0	113.2	Y125 M126 S127 H131 P132 M133 R242	Y125-H129 AromaticContact CD2-CD2 3.95Å; Y125-H129 HydrophobicContact CE1-CB 4.33Å; Y125-H129 AromaticContact CE1-CD2 3.84Å; Y125-H129 AromaticContact CE2-CD2 3.68Å; Y125-H129 AromaticContact CE2-NE2 3.73Å; Y125-H129 AromaticContact CZ-CD2 3.6Å; Y125-H129 AromaticContact CZ-NE2 3.87Å; Y125-H129 PolarHBondContact O-CD2 3.43Å; Y125-H129 PolarHBondContact O-N 3.19Å; M126-H129 CarbonylContact O-C 3.59Å; M126-H129 VanDerWaalsContact O-C 3.32Å; M126-H129 PolarHBondContact O-N 3.32Å; S127-H129 VanDerWaalsContact C-N 3.32Å; S127-H129 PolarHBondContact O-N 3.14Å; H129-H131 PolarHBondContact O-N 3.49Å; H129-P132 WeakPolarHBondContact O-CD 3.48Å; H129-M133 HydrophobicContact CB-CG 4.32Å; H129-M133 VanDerWaalsContact O-CG 3.29Å; H129-M133 WeakPolarHBondContact O-CG 3.43Å; H129-M133 PolarHBondContact O-N 3.39Å; H129-R242 VanDerWaalsContact CE1-CD 3.48Å; H129-R242 WeakPolarHBondContact CE1-CD 3.38Å; H129-R242 VanDerWaalsContact CE1-CZ 3.49Å; H129-R242 PolarHBondContact CE1-NE 2.89Å; H129-R242 PolarHBondContact CE1-NH1 2.82Å; H129-R242 PolarHBondContact NE2-NH1 2.97Å
130	Y	96.6	Very high	95.1	Very high	1 Å²	1	40.6 Å²	40.6	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-57.5	-49.6	-165.1	-178.7	-108.4	0	0	0	115.1	M126 M133 L134 F139 L150 R151 R154 D216 Y218	M126-Y130 WeakPolarHBondContact O-CA 3.26Å; M126-Y130 PolarHBondContact O-N 2.96Å; Y130-M133 WeakPolarHBondContact O-CB 3.48Å; Y130-M133 PolarHBondContact O-N 2.78Å; Y130-M133 VanDerWaalsContact O-N 3.15Å; Y130-L134 HydrophobicContact CD1-CD1 4.28Å; Y130-L134 HydrophobicContact CE1-CD1 3.81Å; Y130-L134 HydrophobicContact CE1-CD2 4.46Å; Y130-L134 HydrophobicContact CE1-CG 4.26Å; Y130-L134 HydrophobicContact CE2-CD2 4.31Å; Y130-L134 WeakPolarHBondContact O-CG 3.49Å; Y130-L134 PolarHBondContact O-N 2.81Å; Y130-F139 HydrophobicContact CD2-CZ 4.08Å; Y130-F139 HydrophobicContact CE2-CE1 4.19Å; Y130-F139 AromaticContact CE2-CZ 3.86Å; Y130-F139 HydrophobicContact CE2-CZ 3.86Å; Y130-L150 HydrophobicContact CD2-CB 4.42Å; Y130-L150 HydrophobicContact CE2-CB 4.45Å; Y130-R151 HydrophobicContact CE1-CG 4.31Å; Y130-R151 HydrophobicContact CE2-CG 4.06Å; Y130-R151 WeakPolarHBondContact OH-CG 3.37Å; Y130-R151 PolarHBondContact OH-NE 2.91Å; Y130-R151 PolarHBondContact OH-NH2 3.41Å; Y130-R151 VanDerWaalsContact OH-NH2 3.13Å; Y130-R154 VanDerWaalsContact CB-CD 3.47Å; Y130-D216 HydrophobicContact CD1-CB 4.1Å; Y130-D216 HydrophobicContact CE1-CB 4.07Å; Y130-Y218 HydrophobicContact CD1-CE2 4.47Å; Y130-Y218 PolarHBondContact N-OH 3.09Å; Y130-Y218 VanDerWaalsContact N-OH 3.17Å
131	H	95.8	Very high	94.8	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.019	23%	0.23	C	C	.	.	H	α-helix	trans	-64.1	-45.2	178.5	-76.7	-172.9	0	0	0	113.7	H129 M133 L134 D216 Y218 F220	H129-H131 PolarHBondContact O-N 3.49Å; H131-M133 VanDerWaalsContact C-N 3.27Å; H131-M133 PolarHBondContact O-N 2.61Å; H131-L134 WeakPolarHBondContact O-CB 3.42Å; H131-L134 PolarHBondContact O-N 3.37Å; H131-D216 IonicContact CD2-OD2 3.74Å; H131-D216 IonicContact CE1-OD2 3.76Å; H131-D216 IonicContact NE2-OD2 2.76Å; H131-D216 PolarHBondContact NE2-OD2 3.36Å; H131-Y218 HydrophobicContact CB-CE2 4.32Å; H131-Y218 AromaticContact CD2-CE2 3.71Å; H131-Y218 AromaticContact CE1-CD2 3.62Å; H131-Y218 AromaticContact CG-CE2 3.74Å; H131-Y218 PolarHBondContact N-OH 3.48Å; H131-Y218 AromaticContact ND1-CD2 3.81Å; H131-Y218 AromaticContact NE2-CD2 3.75Å; H131-Y218 AromaticContact NE2-CE2 3.94Å; H131-F220 AromaticContact CE1-CE2 3.79Å; H131-F220 AromaticContact CE1-CZ 3.57Å; H131-F220 AromaticContact ND1-CZ 3.58Å
132	P	95	Very high	94.8	Very high	61 Å²	61	40.6 Å²	40.6	40%	0.396	22%	0.221	S	C	.	.	H	α-helix	trans	-54.9	-39.8	168.2	-29.5	34	0	0	0	113.9	H129 R135	H129-P132 WeakPolarHBondContact O-CD 3.48Å; P132-R135 PolarHBondContact O-N 3.47Å
133	M	96	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-34.3	178	-68.9	-52.9	-60	0	0	112.7	P100 V104 M126 H129 Y130 H131 R135 R136 F139	P100-M133 HydrophobicContact CB-SD 4.45Å; V104-M133 HydrophobicContact CG2-CE 3.55Å; M126-M133 HydrophobicContact CB-CG 4.37Å; M126-M133 HydrophobicContact CG-CE 4.15Å; M126-M133 HydrophobicContact CG-CG 4.35Å; M126-M133 HydrophobicContact SD-CE 4.38Å; H129-M133 HydrophobicContact CB-CG 4.32Å; H129-M133 VanDerWaalsContact O-CG 3.29Å; H129-M133 WeakPolarHBondContact O-CG 3.43Å; H129-M133 PolarHBondContact O-N 3.39Å; Y130-M133 WeakPolarHBondContact O-CB 3.48Å; Y130-M133 PolarHBondContact O-N 2.78Å; Y130-M133 VanDerWaalsContact O-N 3.15Å; H131-M133 VanDerWaalsContact C-N 3.27Å; H131-M133 PolarHBondContact O-N 2.61Å; M133-R135 PolarHBondContact O-N 3.25Å; M133-R135 VanDerWaalsContact O-N 3.09Å; M133-R136 VanDerWaalsContact O-CB 3.31Å; M133-R136 WeakPolarHBondContact O-CB 3.45Å; M133-R136 PolarHBondContact O-N 3.36Å; M133-F139 HydrophobicContact CB-CD2 3.62Å; M133-F139 HydrophobicContact CB-CE2 3.85Å; M133-F139 HydrophobicContact CB-CG 4.02Å; M133-F139 HydrophobicContact CB-CZ 4.45Å; M133-F139 HydrophobicContact CE-CB 4.43Å; M133-F139 HydrophobicContact CE-CD2 3.92Å; M133-F139 HydrophobicContact CG-CD2 4.38Å; M133-F139 WeakPolarHBondContact O-CB 3.43Å; M133-F139 WeakPolarHBondContact O-CG 3.43Å
134	L	94.9	Very high	94.6	Very high	27 Å²	27	47.5 Å²	47.5	14%	0.141	27%	0.266	C	S	.	.	H	α-helix	trans	-58.8	-23.4	176.7	-72	174.6	0	0	0	113.9	Y130 H131 R136 F139 P283 E284	Y130-L134 HydrophobicContact CD1-CD1 4.28Å; Y130-L134 HydrophobicContact CE1-CD1 3.81Å; Y130-L134 HydrophobicContact CE1-CD2 4.46Å; Y130-L134 HydrophobicContact CE1-CG 4.26Å; Y130-L134 HydrophobicContact CE2-CD2 4.31Å; Y130-L134 WeakPolarHBondContact O-CG 3.49Å; Y130-L134 PolarHBondContact O-N 2.81Å; H131-L134 WeakPolarHBondContact O-CB 3.42Å; H131-L134 PolarHBondContact O-N 3.37Å; L134-R136 VanDerWaalsContact C-N 3.28Å; L134-F139 HydrophobicContact CD2-CD1 4.08Å; L134-F139 HydrophobicContact CD2-CE1 3.7Å; L134-P283 HydrophobicContact CD1-CB 3.88Å; L134-E284 HydrophobicContact CB-CG 4.08Å; L134-E284 HydrophobicContact CD2-CG 4.47Å
135	R	94.1	Very high	94.6	Very high	94 Å²	94	44.3 Å²	44.3	36%	0.355	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-9.6	179.6	-54.7	166.9	-167	-165.6	-6.8	112.5	P132 M133 Y281 P283 E284 D286	P132-R135 PolarHBondContact O-N 3.47Å; M133-R135 PolarHBondContact O-N 3.25Å; M133-R135 VanDerWaalsContact O-N 3.09Å; R135-Y281 PolarHBondContact NH2-OH 2.9Å; R135-P283 WeakPolarHBondContact CG-O 3.46Å; R135-P283 PolarHBondContact NE-O 3.12Å; R135-E284 WeakPolarHBondContact CA-O 3.44Å; R135-E284 WeakPolarHBondContact CG-O 3.3Å; R135-D286 VanDerWaalsContact CZ-CB 3.42Å; R135-D286 IonicContact CZ-OD2 3.47Å; R135-D286 IonicContact NH1-OD2 2.74Å; R135-D286 PolarHBondContact NH1-OD2 3.3Å; R135-D286 IonicContact NH2-OD1 3.21Å; R135-D286 PolarHBondContact NH2-OD1 3.01Å; R135-D286 IonicContact NH2-OD2 3.68Å; R135-D286 PolarHBondContact NH2-OD2 3.23Å
136	R	92.9	Very high	94.6	Very high	70 Å²	70	42.6 Å²	42.6	26%	0.264	26%	0.26	S	S	.	.			trans	-89.4	127.3	-178.1	-65.4	-57.2	-139.4	131	-5.7	110.2	E101 M133 L134 E138 F139 G140	E101-R136 VanDerWaalsContact CG-NH2 3.31Å; E101-R136 IonicContact OE1-NH2 3.55Å; E101-R136 PolarHBondContact OE1-NH2 3.48Å; M133-R136 VanDerWaalsContact O-CB 3.31Å; M133-R136 WeakPolarHBondContact O-CB 3.45Å; M133-R136 PolarHBondContact O-N 3.36Å; L134-R136 VanDerWaalsContact C-N 3.28Å; R136-E138 WeakPolarHBondContact CB-OE2 3.39Å; R136-E138 IonicContact NH1-OE2 2.9Å; R136-E138 PolarHBondContact O-N 2.84Å; R136-F139 HydrophobicContact CB-CB 4.16Å; R136-F139 WeakPolarHBondContact O-CB 3.2Å; R136-F139 PolarHBondContact O-N 2.82Å; R136-F139 VanDerWaalsContact O-N 3.1Å; R136-G140 PolarHBondContact O-N 3.07Å
137	P	92	Very high	94.5	Very high	101 Å²	101	46.7 Å²	46.7	66%	0.656	28%	0.276	S	S	*	.	H	α-helix	trans	-61.4	-33.6	178	24.7	-32.9	0	0	0	112	F139 G140 S141	P137-F139 VanDerWaalsContact C-N 3.26Å; P137-F139 PolarHBondContact O-N 3.39Å; P137-G140 PolarHBondContact O-N 3.35Å; P137-G140 VanDerWaalsContact O-N 3.09Å; P137-S141 PolarHBondContact O-N 3.1Å
138	E	92.3	Very high	94.4	Very high	84 Å²	84	50.6 Å²	50.6	39%	0.393	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-31.5	177.8	-51.1	81.8	-176.9	0	0	111.5	V104 R136 G140 S141	V104-E138 HydrophobicContact CB-CB 4.13Å; V104-E138 HydrophobicContact CG1-CB 4.03Å; V104-E138 WeakPolarHBondContact CG1-O 3.4Å; V104-E138 HydrophobicContact CG2-CB 4.22Å; R136-E138 WeakPolarHBondContact CB-OE2 3.39Å; R136-E138 IonicContact NH1-OE2 2.9Å; R136-E138 PolarHBondContact O-N 2.84Å; E138-G140 VanDerWaalsContact C-N 3.3Å; E138-G140 PolarHBondContact O-N 3.05Å; E138-S141 PolarHBondContact O-N 3.15Å; E138-S141 PolarHBondContact O-OG 3.16Å
139	F	93.7	Very high	94.4	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.009	30%	0.304	C	S	.	.	H	α-helix	trans	-68.8	-33.3	174.9	-170.4	-95.4	0	0	0	111.9	M126 Y130 M133 L134 R136 P137 S141 L142 R147 L150	M126-F139 HydrophobicContact CB-CE2 4.38Å; M126-F139 HydrophobicContact SD-CD2 4.17Å; M126-F139 HydrophobicContact SD-CE2 4.09Å; Y130-F139 HydrophobicContact CD2-CZ 4.08Å; Y130-F139 HydrophobicContact CE2-CE1 4.19Å; Y130-F139 AromaticContact CE2-CZ 3.86Å; Y130-F139 HydrophobicContact CE2-CZ 3.86Å; M133-F139 HydrophobicContact CB-CD2 3.62Å; M133-F139 HydrophobicContact CB-CE2 3.85Å; M133-F139 HydrophobicContact CB-CG 4.02Å; M133-F139 HydrophobicContact CB-CZ 4.45Å; M133-F139 HydrophobicContact CE-CB 4.43Å; M133-F139 HydrophobicContact CE-CD2 3.92Å; M133-F139 HydrophobicContact CG-CD2 4.38Å; M133-F139 WeakPolarHBondContact O-CB 3.43Å; M133-F139 WeakPolarHBondContact O-CG 3.43Å; L134-F139 HydrophobicContact CD2-CD1 4.08Å; L134-F139 HydrophobicContact CD2-CE1 3.7Å; R136-F139 HydrophobicContact CB-CB 4.16Å; R136-F139 WeakPolarHBondContact O-CB 3.2Å; R136-F139 PolarHBondContact O-N 2.82Å; R136-F139 VanDerWaalsContact O-N 3.1Å; P137-F139 VanDerWaalsContact C-N 3.26Å; P137-F139 PolarHBondContact O-N 3.39Å; F139-S141 PolarHBondContact O-N 3.44Å; F139-L142 HydrophobicContact CD2-CD1 3.68Å; F139-L142 HydrophobicContact CE2-CD1 3.89Å; F139-L142 HydrophobicContact CG-CD1 4.32Å; F139-L142 WeakPolarHBondContact O-CB 3.4Å; F139-L142 PolarHBondContact O-N 3.42Å; F139-R147 HydrophobicContact CE1-CG 4.05Å; F139-R147 HydrophobicContact CZ-CG 4.27Å; F139-L150 HydrophobicContact CE2-CD1 3.42Å; F139-L150 VanDerWaalsContact CE2-CD1 3.42Å; F139-L150 HydrophobicContact CZ-CD1 3.55Å
140	G	90.1	Very high	94.4	Very high	49 Å²	49	51.3 Å²	51.3	51%	0.505	30%	0.297	S	S	.	.	H	α-helix	trans	-65.5	-24.7	177.2	0	0	0	0	0	113.7	R136 P137 E138 L142	R136-G140 PolarHBondContact O-N 3.07Å; P137-G140 PolarHBondContact O-N 3.35Å; P137-G140 VanDerWaalsContact O-N 3.09Å; E138-G140 VanDerWaalsContact C-N 3.3Å; E138-G140 PolarHBondContact O-N 3.05Å; G140-L142 VanDerWaalsContact C-N 3.33Å
141	S	90.6	Very high	94.3	Very high	98 Å²	98	56 Å²	56	69%	0.685	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-10.2	177.4	68.9	0	0	0	0	113.6	P137 E138 F139	P137-S141 PolarHBondContact O-N 3.1Å; E138-S141 PolarHBondContact O-N 3.15Å; E138-S141 PolarHBondContact O-OG 3.16Å; F139-S141 PolarHBondContact O-N 3.44Å
142	L	94.6	Very high	94.3	Very high	8 Å²	8	61.6 Å²	61.6	4%	0.042	34%	0.341	C	S	.	.	S	Bend	trans	-64	142.7	177.2	-71.3	174.2	0	0	0	111.7	V104 Y107 M126 F139 G140 V146 R147	V104-L142 HydrophobicContact CG1-CD2 4.02Å; V104-L142 HydrophobicContact CG1-CG 4.22Å; Y107-L142 HydrophobicContact CD1-CD2 3.88Å; Y107-L142 HydrophobicContact CE1-CD2 4.02Å; M126-L142 HydrophobicContact CE-CD1 4.48Å; M126-L142 HydrophobicContact SD-CD1 3.89Å; F139-L142 HydrophobicContact CD2-CD1 3.68Å; F139-L142 HydrophobicContact CE2-CD1 3.89Å; F139-L142 HydrophobicContact CG-CD1 4.32Å; F139-L142 WeakPolarHBondContact O-CB 3.4Å; F139-L142 PolarHBondContact O-N 3.42Å; G140-L142 VanDerWaalsContact C-N 3.33Å; L142-V146 HydrophobicContact CD1-CG1 4.47Å; L142-R147 HydrophobicContact CB-CG 4.2Å; L142-R147 PolarHBondContact O-NE 3.22Å
143	P	95	Very high	94.3	Very high	72 Å²	72	60.5 Å²	60.5	47%	0.468	33%	0.331	S	S	.	.			trans	-53.7	142.2	175.8	-25.1	33.4	0	0	0	111.9	A145 V146 R147	P143-A145 PolarHBondContact O-N 3Å; P143-V146 HydrophobicContact CB-CG2 4.17Å; P143-V146 HydrophobicContact CG-CG2 4.24Å; P143-V146 WeakPolarHBondContact O-CB 3.48Å; P143-V146 PolarHBondContact O-N 3.49Å; P143-R147 PolarHBondContact O-N 3.33Å
144	P	95.4	Very high	94.2	Very high	81 Å²	81	60.6 Å²	60.6	53%	0.526	33%	0.331	S	S	.	.	H	α-helix	trans	-51.5	-42.3	178.8	-27.1	33.9	0	0	0	113.4	V146 R147 D148	P144-V146 VanDerWaalsContact C-N 3.25Å; P144-V146 PolarHBondContact O-N 3.28Å; P144-R147 PolarHBondContact O-N 3.31Å; P144-D148 PolarHBondContact O-N 2.8Å
145	A	95.9	Very high	94.1	Very high	71 Å²	71	63.4 Å²	63.4	59%	0.587	35%	0.345	S	S	*	.	H	α-helix	trans	-57.4	-35.9	178.1	0	0	0	0	0	113.4	P143 Q149	P143-A145 PolarHBondContact O-N 3Å; A145-Q149 WeakPolarHBondContact O-CB 3.23Å; A145-Q149 PolarHBondContact O-N 2.87Å
146	V	95.9	Very high	93.9	Very high	12 Å²	12	65.4 Å²	65.4	7%	0.073	36%	0.356	C	S	.	.	H	α-helix	trans	-71.4	-41.7	176.7	179.7	0	0	0	0	110.1	Y107 L123 L142 P143 P144 D148 Q149 L150	Y107-V146 HydrophobicContact CE1-CG1 4.27Å; Y107-V146 HydrophobicContact CE1-CG2 4.44Å; Y107-V146 WeakPolarHBondContact OH-CG2 3.47Å; L123-V146 HydrophobicContact CD2-CG1 3.93Å; L142-V146 HydrophobicContact CD1-CG1 4.47Å; P143-V146 HydrophobicContact CB-CG2 4.17Å; P143-V146 HydrophobicContact CG-CG2 4.24Å; P143-V146 WeakPolarHBondContact O-CB 3.48Å; P143-V146 PolarHBondContact O-N 3.49Å; P144-V146 VanDerWaalsContact C-N 3.25Å; P144-V146 PolarHBondContact O-N 3.28Å; V146-D148 VanDerWaalsContact C-N 3.32Å; V146-D148 PolarHBondContact O-N 3.29Å; V146-Q149 WeakPolarHBondContact O-CB 3.3Å; V146-Q149 PolarHBondContact O-N 3.46Å; V146-L150 HydrophobicContact CG1-CD1 4.46Å; V146-L150 VanDerWaalsContact O-CG 3.28Å; V146-L150 WeakPolarHBondContact O-CG 3.3Å; V146-L150 PolarHBondContact O-N 3.49Å
147	R	94.9	Very high	93.7	Very high	86 Å²	86	63.7 Å²	63.7	33%	0.325	36%	0.36	S	S	.	.	H	α-helix	trans	-64	-38.9	177.2	-67.1	-174.4	-73.4	157.6	-0.7	111.7	F139 L142 P143 P144 L150 R151	F139-R147 HydrophobicContact CE1-CG 4.05Å; F139-R147 HydrophobicContact CZ-CG 4.27Å; L142-R147 HydrophobicContact CB-CG 4.2Å; L142-R147 PolarHBondContact O-NE 3.22Å; P143-R147 PolarHBondContact O-N 3.33Å; P144-R147 PolarHBondContact O-N 3.31Å; R147-L150 PolarHBondContact O-N 3.05Å; R147-R151 WeakPolarHBondContact O-CG 3.29Å; R147-R151 PolarHBondContact O-N 2.94Å; R147-R151 VanDerWaalsContact O-N 3.07Å
148	D	94.9	Very high	93.7	Very high	86 Å²	86	62.5 Å²	62.5	46%	0.46	35%	0.351	S	S	.	.	H	α-helix	trans	-65.8	-44.7	174.2	-64.9	-27.5	0	0	0	111	P144 V146 L150 R151 E152	P144-D148 PolarHBondContact O-N 2.8Å; V146-D148 VanDerWaalsContact C-N 3.32Å; V146-D148 PolarHBondContact O-N 3.29Å; D148-L150 VanDerWaalsContact C-N 3.28Å; D148-L150 PolarHBondContact O-N 3.13Å; D148-R151 WeakPolarHBondContact O-CB 3.46Å; D148-R151 PolarHBondContact O-N 3.14Å; D148-R151 VanDerWaalsContact O-N 3.12Å; D148-E152 WeakPolarHBondContact O-CG 3.5Å; D148-E152 PolarHBondContact O-N 3.25Å
149	Q	96.4	Very high	93.8	Very high	71 Å²	71	59.3 Å²	59.3	33%	0.332	34%	0.339	S	S	.	.	H	α-helix	trans	-56.6	-41.5	173.5	-178.7	-175.3	0.5	0	0	112.2	A145 V146 E152 M153	A145-Q149 WeakPolarHBondContact O-CB 3.23Å; A145-Q149 PolarHBondContact O-N 2.87Å; V146-Q149 WeakPolarHBondContact O-CB 3.3Å; V146-Q149 PolarHBondContact O-N 3.46Å; Q149-E152 PolarHBondContact O-N 2.98Å; Q149-M153 HydrophobicContact CG-SD 4.26Å; Q149-M153 WeakPolarHBondContact O-CB 3.4Å; Q149-M153 VanDerWaalsContact O-CG 3.23Å; Q149-M153 WeakPolarHBondContact O-CG 3.49Å; Q149-M153 PolarHBondContact O-N 2.93Å
150	L	96.4	Very high	93.8	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65.3	-41.3	177.2	-69.2	174.1	0	0	0	111.9	L123 M126 S127 Y130 F139 V146 R147 D148 M153 R154	L123-L150 HydrophobicContact CB-CD2 4.28Å; L123-L150 HydrophobicContact CD2-CD2 3.82Å; L123-L150 HydrophobicContact CD2-CG 4.39Å; L123-L150 WeakPolarHBondContact O-CD2 3.27Å; M126-L150 HydrophobicContact CB-CD1 3.9Å; M126-L150 HydrophobicContact CB-CD2 3.83Å; M126-L150 HydrophobicContact CE-CD1 4.41Å; M126-L150 HydrophobicContact SD-CD1 4.29Å; S127-L150 PolarHBondContact OG-O 3.46Å; Y130-L150 HydrophobicContact CD2-CB 4.42Å; Y130-L150 HydrophobicContact CE2-CB 4.45Å; F139-L150 HydrophobicContact CE2-CD1 3.42Å; F139-L150 VanDerWaalsContact CE2-CD1 3.42Å; F139-L150 HydrophobicContact CZ-CD1 3.55Å; V146-L150 HydrophobicContact CG1-CD1 4.46Å; V146-L150 VanDerWaalsContact O-CG 3.28Å; V146-L150 WeakPolarHBondContact O-CG 3.3Å; V146-L150 PolarHBondContact O-N 3.49Å; R147-L150 PolarHBondContact O-N 3.05Å; D148-L150 VanDerWaalsContact C-N 3.28Å; D148-L150 PolarHBondContact O-N 3.13Å; L150-M153 PolarHBondContact O-N 2.76Å; L150-R154 PolarHBondContact O-N 3.42Å
151	R	93.8	Very high	94	Very high	99 Å²	99	57.4 Å²	57.4	37%	0.374	32%	0.318	S	S	.	.	H	α-helix	trans	-61	-47	173.6	-70.6	174.8	-176.6	-121	-1.8	110.9	Y130 R147 D148 M153 R154 M155 D216	Y130-R151 HydrophobicContact CE1-CG 4.31Å; Y130-R151 HydrophobicContact CE2-CG 4.06Å; Y130-R151 WeakPolarHBondContact OH-CG 3.37Å; Y130-R151 PolarHBondContact OH-NE 2.91Å; Y130-R151 PolarHBondContact OH-NH2 3.41Å; Y130-R151 VanDerWaalsContact OH-NH2 3.13Å; R147-R151 WeakPolarHBondContact O-CG 3.29Å; R147-R151 PolarHBondContact O-N 2.94Å; R147-R151 VanDerWaalsContact O-N 3.07Å; D148-R151 WeakPolarHBondContact O-CB 3.46Å; D148-R151 PolarHBondContact O-N 3.14Å; D148-R151 VanDerWaalsContact O-N 3.12Å; R151-M153 VanDerWaalsContact C-N 3.32Å; R151-M153 PolarHBondContact O-N 3.36Å; R151-R154 WeakPolarHBondContact O-CB 3.45Å; R151-R154 PolarHBondContact O-N 3.28Å; R151-R154 VanDerWaalsContact O-N 3.16Å; R151-M155 PolarHBondContact O-N 3.38Å; R151-D216 IonicContact NH1-OD1 2.67Å
152	E	94.8	Very high	94.2	Very high	121 Å²	121	52.7 Å²	52.7	57%	0.565	29%	0.285	S	S	*	.	H	α-helix	trans	-59.9	-42.3	176.5	-72.2	178	-176.9	0	0	111.9	D148 Q149 R154 M155 K156	D148-E152 WeakPolarHBondContact O-CG 3.5Å; D148-E152 PolarHBondContact O-N 3.25Å; Q149-E152 PolarHBondContact O-N 2.98Å; E152-R154 PolarHBondContact O-N 3.35Å; E152-M155 CarbonylContact O-C 3.47Å; E152-M155 WeakPolarHBondContact O-CA 3.46Å; E152-M155 WeakPolarHBondContact O-CB 3.47Å; E152-M155 PolarHBondContact O-N 3.11Å; E152-K156 PolarHBondContact O-N 3.5Å
153	M	95.1	Very high	94.2	Very high	39 Å²	39	52.3 Å²	52.3	19%	0.192	28%	0.283	C	S	.	.	H	α-helix	trans	-59.5	-31.9	177.4	-77.6	178.1	66.6	0	0	112.8	L123 K124 S127 Q149 L150 R151 M155 K156	L123-M153 HydrophobicContact CB-CE 4.22Å; L123-M153 HydrophobicContact CB-SD 4.15Å; K124-M153 HydrophobicContact CB-CE 4.46Å; S127-M153 WeakPolarHBondContact OG-CB 3.33Å; Q149-M153 HydrophobicContact CG-SD 4.26Å; Q149-M153 WeakPolarHBondContact O-CB 3.4Å; Q149-M153 VanDerWaalsContact O-CG 3.23Å; Q149-M153 WeakPolarHBondContact O-CG 3.49Å; Q149-M153 PolarHBondContact O-N 2.93Å; L150-M153 PolarHBondContact O-N 2.76Å; R151-M153 VanDerWaalsContact C-N 3.32Å; R151-M153 PolarHBondContact O-N 3.36Å; M153-M155 VanDerWaalsContact C-N 3.27Å; M153-M155 PolarHBondContact O-N 3.24Å; M153-K156 HydrophobicContact CG-CD 4.32Å; M153-K156 WeakPolarHBondContact O-CB 3.21Å; M153-K156 PolarHBondContact O-N 3.36Å
154	R	94.3	Very high	94.1	Very high	2 Å²	2	49 Å²	49	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-70.3	-24.8	173.8	-67.8	-171.5	60	66.8	10.9	113.8	S127 Y130 L150 R151 E152 K156 D216 N217 Y218	S127-R154 VanDerWaalsContact O-CD 3.3Å; S127-R154 WeakPolarHBondContact O-CD 3.27Å; S127-R154 VanDerWaalsContact O-CG 3.29Å; S127-R154 WeakPolarHBondContact O-CG 3.46Å; S127-R154 PolarHBondContact O-NH1 3.27Å; S127-R154 VanDerWaalsContact OG-CG 3.3Å; S127-R154 WeakPolarHBondContact OG-CG 3.48Å; S127-R154 PolarHBondContact OG-N 3.37Å; Y130-R154 VanDerWaalsContact CB-CD 3.47Å; L150-R154 PolarHBondContact O-N 3.42Å; R151-R154 WeakPolarHBondContact O-CB 3.45Å; R151-R154 PolarHBondContact O-N 3.28Å; R151-R154 VanDerWaalsContact O-N 3.16Å; E152-R154 PolarHBondContact O-N 3.35Å; R154-K156 VanDerWaalsContact C-N 3.32Å; R154-D216 PolarHBondContact NE-O 2.95Å; R154-D216 PolarHBondContact NH2-O 3.37Å; R154-D216 VanDerWaalsContact NH2-O 3.09Å; R154-N217 PolarHBondContact O-ND2 3.05Å; R154-Y218 VanDerWaalsContact NE-CE2 3.34Å; R154-Y218 PolarHBondContact NH1-OH 2.75Å; R154-Y218 VanDerWaalsContact NH2-CZ 3.29Å
155	M	93.6	Very high	93.8	Very high	85 Å²	85	45.1 Å²	45.1	42%	0.419	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-2.1	175.5	-52.5	-56.1	-77.1	0	0	111.8	R151 E152 M153 N217 Y465	R151-M155 PolarHBondContact O-N 3.38Å; E152-M155 CarbonylContact O-C 3.47Å; E152-M155 WeakPolarHBondContact O-CA 3.46Å; E152-M155 WeakPolarHBondContact O-CB 3.47Å; E152-M155 PolarHBondContact O-N 3.11Å; M153-M155 VanDerWaalsContact C-N 3.27Å; M153-M155 PolarHBondContact O-N 3.24Å; M155-N217 HydrophobicContact SD-CB 3.79Å; M155-Y465 HydrophobicContact CE-CD2 3.53Å; M155-Y465 HydrophobicContact CE-CE2 3.22Å; M155-Y465 WeakPolarHBondContact O-CD1 3.46Å; M155-Y465 HydrophobicContact SD-CD2 4.11Å; M155-Y465 HydrophobicContact SD-CE2 4.36Å
156	K	89.5	Confident	93.2	Very high	137 Å²	137	42.5 Å²	42.5	60%	0.596	21%	0.212	S	C	*	.			trans	-79.1	122.4	172.7	-66.5	180	-172.7	178.6	0	109.5	E152 M153 R154	E152-K156 PolarHBondContact O-N 3.5Å; M153-K156 HydrophobicContact CG-CD 4.32Å; M153-K156 WeakPolarHBondContact O-CB 3.21Å; M153-K156 PolarHBondContact O-N 3.36Å; R154-K156 VanDerWaalsContact C-N 3.32Å
157	G	88.4	Confident	92.7	Very high	34 Å²	34	42.3 Å²	42.3	35%	0.351	21%	0.21	S	C	.	.	S	Bend	trans	155.2	-167.9	179.2	0	0	0	0	0	111	L466	G157-L466 WeakPolarHBondContact CA-O 3.4Å
158	T	91.9	Very high	91.7	Very high	75 Å²	75	43.4 Å²	43.4	46%	0.46	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	115.9	173.9	-57.1	0	0	0	0	108.3	T160 L466 N468	T158-T160 PolarHBondContact O-N 2.76Å; T158-T160 PolarHBondContact O-OG1 2.84Å; T158-L466 PolarHBondContact N-O 3.12Å; T158-L466 PolarHBondContact O-N 3.06Å; T158-N468 PolarHBondContact OG1-OD1 3.27Å; T158-N468 VanDerWaalsContact OG1-OD1 3.05Å
159	A	93.6	Very high	90.3	Very high	18 Å²	18	42.7 Å²	42.7	15%	0.149	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	122.8	168.3	0	0	0	0	0	107.7	H414 Y465	A159-H414 VanDerWaalsContact C-CE1 3.48Å; A159-H414 PolarHBondContact O-CE1 2.9Å; A159-Y465 HydrophobicContact CB-CD1 4.12Å; A159-Y465 HydrophobicContact CB-CE1 3.82Å
160	T	94.3	Very high	89	Confident	9 Å²	9	41.2 Å²	41.2	6%	0.055	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	132.5	-171.7	-55.2	0	0	0	0	109.9	T158 V162 R185 L464 L466	T158-T160 PolarHBondContact O-N 2.76Å; T158-T160 PolarHBondContact O-OG1 2.84Å; T160-V162 HydrophobicContact CG2-CG2 4.48Å; T160-R185 HydrophobicContact CG2-CB 3.83Å; T160-L464 PolarHBondContact N-O 2.81Å; T160-L464 PolarHBondContact O-N 2.9Å; T160-L466 HydrophobicContact CG2-CD1 3.67Å; T160-L466 HydrophobicContact CG2-CG 4.42Å
161	L	94.4	Very high	87.4	Confident	1 Å²	1	46 Å²	46	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	128.9	168.1	-73.9	164.7	0	0	0	110.3	R185 Y186 T412 H414 Y419 F449 L461	L161-R185 CarbonylContact O-C 3.52Å; L161-R185 WeakPolarHBondContact O-CA 3.29Å; L161-Y186 PolarHBondContact O-N 2.84Å; L161-T412 HydrophobicContact CD2-CG2 3.57Å; L161-H414 HydrophobicContact CD1-CB 4.45Å; L161-H414 HydrophobicContact CD2-CB 3.45Å; L161-H414 VanDerWaalsContact CD2-CB 3.45Å; L161-H414 HydrophobicContact CG-CB 3.96Å; L161-H414 VanDerWaalsContact CG-CD2 3.48Å; L161-H414 WeakPolarHBondContact CG-CD2 3.49Å; L161-Y419 HydrophobicContact CD1-CD1 3.3Å; L161-Y419 HydrophobicContact CD1-CD2 4.03Å; L161-Y419 HydrophobicContact CD1-CE1 3.32Å; L161-Y419 HydrophobicContact CD1-CE2 4.07Å; L161-Y419 HydrophobicContact CD1-CG 3.64Å; L161-Y419 HydrophobicContact CD2-CD2 4.31Å; L161-Y419 HydrophobicContact CD2-CG 4.12Å; L161-F449 HydrophobicContact CD1-CE2 4.36Å; L161-F449 HydrophobicContact CD1-CZ 4.18Å; L161-L461 HydrophobicContact CD2-CD1 4.19Å; L161-L461 HydrophobicContact CD2-CG 4.39Å
162	V	94.9	Very high	86	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.1	178	179.2	0	0	0	0	109.1	T160 I164 M183 L184 R185 L196 C462 L464 L466	T160-V162 HydrophobicContact CG2-CG2 4.48Å; V162-I164 HydrophobicContact CG1-CG2 4.24Å; V162-M183 HydrophobicContact CG1-CE 4.32Å; V162-L184 CarbonylContact C-O 3.6Å; V162-L184 WeakPolarHBondContact CA-O 3.45Å; V162-R185 HydrophobicContact CG2-CB 4.4Å; V162-L196 HydrophobicContact CG1-CD2 4.11Å; V162-L196 HydrophobicContact CG2-CD2 4.47Å; V162-C462 PolarHBondContact N-O 3.27Å; V162-C462 PolarHBondContact O-N 2.94Å; V162-L464 HydrophobicContact CB-CD1 4.36Å; V162-L464 HydrophobicContact CG2-CB 4.38Å; V162-L464 HydrophobicContact CG2-CD1 4.18Å; V162-L466 HydrophobicContact CG2-CD1 4.25Å
163	V	93.6	Very high	84.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.2	170.8	172.8	0	0	0	0	108.6	F167 M183 L184 W193 M421 F452 M459 L460 L461	V163-F167 HydrophobicContact CG1-CE1 4.11Å; V163-F167 HydrophobicContact CG1-CZ 3.94Å; V163-M183 CarbonylContact O-C 3.54Å; V163-M183 WeakPolarHBondContact O-CA 3.47Å; V163-L184 PolarHBondContact N-O 3.23Å; V163-L184 PolarHBondContact O-N 2.87Å; V163-W193 HydrophobicContact CB-CH2 4.22Å; V163-W193 HydrophobicContact CB-CZ3 4.13Å; V163-W193 HydrophobicContact CG2-CH2 3.33Å; V163-W193 HydrophobicContact CG2-CZ2 4.13Å; V163-W193 HydrophobicContact CG2-CZ3 3.73Å; V163-M421 HydrophobicContact CB-CE 4.41Å; V163-M421 HydrophobicContact CG1-CE 3.65Å; V163-M421 HydrophobicContact CG1-SD 4.12Å; V163-M421 HydrophobicContact CG2-CE 3.81Å; V163-M421 HydrophobicContact CG2-SD 3.73Å; V163-F452 HydrophobicContact CB-CE2 3.88Å; V163-F452 HydrophobicContact CB-CZ 4.36Å; V163-F452 HydrophobicContact CG1-CE2 3.7Å; V163-F452 HydrophobicContact CG1-CZ 3.71Å; V163-F452 HydrophobicContact CG2-CE2 4.07Å; V163-M459 HydrophobicContact CG1-CB 4.25Å; V163-L460 VanDerWaalsContact CA-O 3.3Å; V163-L460 WeakPolarHBondContact CA-O 3.49Å; V163-L461 HydrophobicContact CG2-CD1 3.33Å
164	I	93.2	Very high	82.7	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	148.7	169.9	65.4	165.7	0	0	0	109.6	V162 S182 M183 L200 Y210 L219 I221 M459 L460	V162-I164 HydrophobicContact CG1-CG2 4.24Å; I164-S182 WeakPolarHBondContact CA-O 3.44Å; I164-M183 HydrophobicContact CG2-CB 4.44Å; I164-M183 HydrophobicContact CG2-CE 3.68Å; I164-M183 HydrophobicContact CG2-CG 3.86Å; I164-M183 HydrophobicContact CG2-SD 4.46Å; I164-L200 HydrophobicContact CB-CD2 4.46Å; I164-L200 HydrophobicContact CD1-CD2 4.35Å; I164-Y210 HydrophobicContact CD1-CE2 4.28Å; I164-L219 HydrophobicContact CD1-CD2 4.05Å; I164-L219 HydrophobicContact CG2-CD2 3.87Å; I164-I221 HydrophobicContact CD1-CG2 3.57Å; I164-M459 CarbonylContact O-C 3.48Å; I164-M459 VanDerWaalsContact O-CA 3.23Å; I164-M459 WeakPolarHBondContact O-CA 3.44Å; I164-L460 HydrophobicContact CD1-CB 4.37Å; I164-L460 HydrophobicContact CD1-CD1 4.45Å; I164-L460 HydrophobicContact CG1-CB 3.86Å; I164-L460 PolarHBondContact N-O 2.65Å; I164-L460 PolarHBondContact O-N 2.84Å
165	G	88.8	Confident	80.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.5	176.2	174.4	0	0	0	0	0	113.4	F167 S182	G165-F167 PolarHBondContact O-N 2.94Å; G165-S182 PolarHBondContact N-O 3.16Å; G165-S182 WeakPolarHBondContact O-CA 3.29Å
166	D	84.6	Confident	79	Confident	16 Å²	16	55.7 Å²	55.7	9%	0.086	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	96.6	175.8	-63.1	-44	0	0	0	108.9	N206 G456 Q457	D166-N206 PolarHBondContact OD1-N 3.41Å; D166-N206 VanDerWaalsContact OD2-CA 3.23Å; D166-N206 WeakPolarHBondContact OD2-CA 3.44Å; D166-N206 PolarHBondContact OD2-N 2.73Å; D166-G456 WeakPolarHBondContact O-CA 3.32Å; D166-Q457 PolarHBondContact N-O 3.34Å; D166-Q457 PolarHBondContact O-N 2.81Å
167	F	85.1	Confident	77.5	Confident	9 Å²	9	54.6 Å²	54.6	4%	0.039	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	132.9	179.6	-48.7	-37.9	0	0	0	111.2	V163 G165 L170 W181 S182 L184 F452 A454 L455 M459	V163-F167 HydrophobicContact CG1-CE1 4.11Å; V163-F167 HydrophobicContact CG1-CZ 3.94Å; G165-F167 PolarHBondContact O-N 2.94Å; F167-L170 HydrophobicContact CB-CD1 4.13Å; F167-L170 HydrophobicContact CB-CD2 4.45Å; F167-L170 HydrophobicContact CB-CG 4.11Å; F167-L170 HydrophobicContact CD2-CD1 4.44Å; F167-L170 HydrophobicContact CD2-CD2 4.06Å; F167-W181 WeakPolarHBondContact CD2-O 3.38Å; F167-S182 VanDerWaalsContact CE2-C 3.44Å; F167-L184 HydrophobicContact CD2-CD1 4.4Å; F167-L184 HydrophobicContact CD2-CG 4.34Å; F167-L184 HydrophobicContact CE2-CD1 4.09Å; F167-L184 HydrophobicContact CE2-CG 3.74Å; F167-L184 HydrophobicContact CZ-CG 4.35Å; F167-F452 HydrophobicContact CD1-CE1 4.29Å; F167-F452 HydrophobicContact CD1-CZ 4.17Å; F167-F452 HydrophobicContact CE1-CE1 4.14Å; F167-F452 AromaticContact CE1-CZ 3.64Å; F167-F452 HydrophobicContact CE1-CZ 3.64Å; F167-F452 AromaticContact CZ-CZ 3.93Å; F167-F452 HydrophobicContact CZ-CZ 3.93Å; F167-A454 HydrophobicContact CB-CB 4.14Å; F167-A454 HydrophobicContact CD1-CB 4.35Å; F167-A454 HydrophobicContact CG-CB 4.14Å; F167-L455 CarbonylContact C-O 3.56Å; F167-L455 WeakPolarHBondContact CA-O 3.49Å; F167-M459 HydrophobicContact CD1-CG 4.39Å; F167-M459 HydrophobicContact CD1-SD 4.1Å; F167-M459 HydrophobicContact CE1-CG 3.96Å; F167-M459 HydrophobicContact CE1-SD 3.89Å
168	T	73.2	Confident	76.1	Confident	108 Å²	108	61.5 Å²	61.5	66%	0.663	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	-17.5	-175.7	51.4	0	0	0	0	113.5	L455	T168-L455 PolarHBondContact N-O 2.83Å; T168-L455 PolarHBondContact OG1-O 2.94Å
169	C	65.9	Low	74.8	Confident	71 Å²	71	64 Å²	64	48%	0.48	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	107.6	176.7	-177.2	0	0	0	0	108	A454 L455	C169-A454 CarbonylContact O-C 3.53Å; C169-A454 WeakPolarHBondContact O-CA 3.44Å; C169-A454 WeakPolarHBondContact O-CB 3.3Å; C169-L455 HydrophobicContact CB-CB 4.19Å; C169-L455 HydrophobicContact CB-CD1 4.16Å; C169-L455 HydrophobicContact CB-CG 4.26Å; C169-L455 PolarHBondContact O-N 2.74Å
170	L	70.3	Confident	73.6	Confident	41 Å²	41	66.7 Å²	66.7	22%	0.215	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.9	177.3	-78.6	145.1	0	0	0	109.1	F167 L172 P180 W181 L184 A454	F167-L170 HydrophobicContact CB-CD1 4.13Å; F167-L170 HydrophobicContact CB-CD2 4.45Å; F167-L170 HydrophobicContact CB-CG 4.11Å; F167-L170 HydrophobicContact CD2-CD1 4.44Å; F167-L170 HydrophobicContact CD2-CD2 4.06Å; L170-L172 HydrophobicContact CD2-CD1 3.94Å; L170-L172 PolarHBondContact O-N 2.85Å; L170-P180 HydrophobicContact CD1-CB 3.55Å; L170-W181 HydrophobicContact CD1-CB 4.45Å; L170-W181 HydrophobicContact CD1-CE3 3.97Å; L170-W181 HydrophobicContact CD2-CE3 4.45Å; L170-L184 HydrophobicContact CD2-CD1 4Å; L170-L184 HydrophobicContact CD2-CD2 4.16Å; L170-A454 HydrophobicContact CD2-CB 3.79Å; L170-A454 HydrophobicContact CG-CB 4.08Å
171	S	62.1	Low	72.9	Confident	99 Å²	99	67.6 Å²	67.6	69%	0.692	38%	0.379	S	S	*	.			trans	-97.9	70.5	171.4	-172.5	0	0	0	0	109.1	P453	S171-P453 PolarHBondContact N-O 3.17Å
172	L	63.5	Low	72.4	Confident	36 Å²	36	68.2 Å²	68.2	19%	0.188	38%	0.383	C	S	.	.			trans	-116.3	135.1	174.1	-72.7	173.2	0	0	0	108.9	L170 V174 W181 L184 W193 P195 P453	L170-L172 HydrophobicContact CD2-CD1 3.94Å; L170-L172 PolarHBondContact O-N 2.85Å; L172-V174 HydrophobicContact CB-CG2 3.83Å; L172-V174 PolarHBondContact O-N 3.34Å; L172-W181 HydrophobicContact CD1-CE3 4.27Å; L172-W181 HydrophobicContact CD1-CZ3 4.44Å; L172-L184 HydrophobicContact CD1-CD2 3.85Å; L172-W193 WeakPolarHBondContact CD2-O 3.44Å; L172-P195 HydrophobicContact CD1-CG 4.06Å; L172-P453 HydrophobicContact CD1-CG 4.4Å; L172-P453 HydrophobicContact CD2-CB 3.82Å; L172-P453 HydrophobicContact CD2-CG 3.8Å; L172-P453 HydrophobicContact CG-CB 4.03Å; L172-P453 HydrophobicContact CG-CG 4.02Å
173	D	59.7	Low	72.3	Confident	178 Å²	178	68.2 Å²	68.2	95%	0.952	38%	0.383	S	S	*	.			trans	-74.4	67.4	174.2	-63.5	-34.7	0	0	0	110.2
174	V	61.3	Low	72.2	Confident	55 Å²	55	68.2 Å²	68.2	33%	0.333	38%	0.383	S	S	.	.			trans	-128.9	141.8	-176.2	-174.6	0	0	0	0	107.9	L172 W181 P195	L172-V174 HydrophobicContact CB-CG2 3.83Å; L172-V174 PolarHBondContact O-N 3.34Å; V174-W181 HydrophobicContact CB-CH2 3.57Å; V174-W181 HydrophobicContact CB-CZ2 4.34Å; V174-W181 HydrophobicContact CB-CZ3 4.15Å; V174-W181 HydrophobicContact CG1-CH2 3.32Å; V174-W181 HydrophobicContact CG1-CZ2 3.59Å; V174-W181 HydrophobicContact CG1-CZ3 4.29Å; V174-W181 HydrophobicContact CG2-CH2 4.32Å; V174-P195 HydrophobicContact CG2-CG 4.3Å
175	P	56.7	Low	72.2	Confident	109 Å²	109	71.2 Å²	71.2	71%	0.708	40%	0.395	S	S	*	.			trans	-53.4	142.2	177.9	18.4	-31.9	0	0	0	112	Q177	P175-Q177 PolarHBondContact O-N 3.44Å
176	D	53.9	Low	72.3	Confident	172 Å²	172	71.6 Å²	71.6	92%	0.92	40%	0.396	S	S	*	.			trans	-48.6	125.1	179.4	-108.7	-19.8	0	0	0	110.8
177	Q	58.3	Low	72.4	Confident	114 Å²	114	71.1 Å²	71.1	53%	0.533	40%	0.395	S	S	.	.			trans	-114.4	149.6	165.4	-69.7	-164.6	-10	0	0	108.5	P175 E179 W181	P175-Q177 PolarHBondContact O-N 3.44Å; Q177-E179 PolarHBondContact O-N 2.88Å; Q177-W181 HydrophobicContact CG-CZ2 3.95Å; Q177-W181 VanDerWaalsContact OE1-NE1 3.1Å
178	D	58.5	Low	72.3	Confident	179 Å²	179	74.3 Å²	74.3	96%	0.957	41%	0.41	S	S	*	.	S	Bend	trans	-64	-23.7	-179.2	-69.6	-38.1	0	0	0	113
179	E	64.1	Low	72.9	Confident	128 Å²	128	75.8 Å²	75.8	60%	0.598	42%	0.419	S	S	*	.	S	Bend	trans	-127.9	140.9	178.5	-69.2	-173.5	171.9	0	0	112.5	Q177	Q177-E179 PolarHBondContact O-N 2.88Å
180	P	69.1	Low	73.7	Confident	74 Å²	74	76.4 Å²	76.4	48%	0.481	41%	0.414	S	S	.	.			trans	-67.8	139.2	175.4	28.5	-33.3	0	0	0	110.8	L170	L170-P180 HydrophobicContact CD1-CB 3.55Å
181	W	79.1	Confident	74.5	Confident	29 Å²	29	78.8 Å²	78.8	11%	0.11	43%	0.425	C	S	.	.			trans	-55.3	143.9	172	-62.4	-69.5	0	0	0	110.8	F167 L170 L172 V174 Q177 L184 P195 N199	F167-W181 WeakPolarHBondContact CD2-O 3.38Å; L170-W181 HydrophobicContact CD1-CB 4.45Å; L170-W181 HydrophobicContact CD1-CE3 3.97Å; L170-W181 HydrophobicContact CD2-CE3 4.45Å; L172-W181 HydrophobicContact CD1-CE3 4.27Å; L172-W181 HydrophobicContact CD1-CZ3 4.44Å; V174-W181 HydrophobicContact CB-CH2 3.57Å; V174-W181 HydrophobicContact CB-CZ2 4.34Å; V174-W181 HydrophobicContact CB-CZ3 4.15Å; V174-W181 HydrophobicContact CG1-CH2 3.32Å; V174-W181 HydrophobicContact CG1-CZ2 3.59Å; V174-W181 HydrophobicContact CG1-CZ3 4.29Å; V174-W181 HydrophobicContact CG2-CH2 4.32Å; Q177-W181 HydrophobicContact CG-CZ2 3.95Å; Q177-W181 VanDerWaalsContact OE1-NE1 3.1Å; W181-L184 HydrophobicContact CB-CD2 4.46Å; W181-P195 HydrophobicContact CD2-CB 3.7Å; W181-P195 HydrophobicContact CD2-CG 3.61Å; W181-P195 HydrophobicContact CE3-CB 4.39Å; W181-P195 HydrophobicContact CE3-CG 3.82Å; W181-P195 HydrophobicContact CG-CB 3.73Å; W181-P195 HydrophobicContact CG-CG 4.17Å; W181-P195 HydrophobicContact CH2-CG 4.29Å; W181-P195 HydrophobicContact CZ2-CB 4.47Å; W181-P195 HydrophobicContact CZ2-CG 4.04Å; W181-P195 HydrophobicContact CZ3-CG 4.17Å; W181-N199 WeakPolarHBondContact CA-OD1 3.49Å
182	S	85.1	Confident	75.7	Confident	13 Å²	13	81.3 Å²	81.3	9%	0.091	42%	0.419	C	S	.	.	S	Bend	trans	-105.5	-2.2	171.5	-35.8	0	0	0	0	113.2	I164 G165 F167 N199 L200	I164-S182 WeakPolarHBondContact CA-O 3.44Å; G165-S182 PolarHBondContact N-O 3.16Å; G165-S182 WeakPolarHBondContact O-CA 3.29Å; F167-S182 VanDerWaalsContact CE2-C 3.44Å; S182-N199 PolarHBondContact N-OD1 3.18Å; S182-N199 VanDerWaalsContact N-OD1 3.09Å; S182-L200 PolarHBondContact OG-N 3Å
183	M	91.9	Very high	76.9	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	127.9	-178.2	-55.4	-177.1	73.1	0	0	110.8	V162 V163 I164 L196 N198 Y238 W245	V162-M183 HydrophobicContact CG1-CE 4.32Å; V163-M183 CarbonylContact O-C 3.54Å; V163-M183 WeakPolarHBondContact O-CA 3.47Å; I164-M183 HydrophobicContact CG2-CB 4.44Å; I164-M183 HydrophobicContact CG2-CE 3.68Å; I164-M183 HydrophobicContact CG2-CG 3.86Å; I164-M183 HydrophobicContact CG2-SD 4.46Å; M183-L196 HydrophobicContact CB-CB 4.01Å; M183-L196 HydrophobicContact CB-CD2 4.4Å; M183-L196 HydrophobicContact CE-CD2 3.83Å; M183-L196 PolarHBondContact O-N 3.29Å; M183-N198 WeakPolarHBondContact CG-O 3.36Å; M183-N198 HydrophobicContact SD-CB 4.27Å; M183-Y238 HydrophobicContact CE-CD1 3.91Å; M183-Y238 HydrophobicContact CE-CD2 4.05Å; M183-Y238 HydrophobicContact CE-CE1 3.91Å; M183-Y238 HydrophobicContact CE-CE2 4.05Å; M183-Y238 HydrophobicContact CE-CG 3.98Å; M183-Y238 HydrophobicContact SD-CD2 4.32Å; M183-Y238 HydrophobicContact SD-CE2 4.21Å; M183-W245 HydrophobicContact CE-CZ2 3.94Å; M183-W245 HydrophobicContact SD-CZ2 3.92Å; M183-W245 PolarHBondContact SD-NE1 3.22Å; M183-W245 VanDerWaalsContact SD-NE1 3.43Å
184	L	91.6	Very high	78.2	Confident	0 Å²	0	74 Å²	74	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.5	175.2	-61.8	-179.4	0	0	0	110.1	V162 V163 F167 L170 L172 W181 W193 K194 F452 P453	V162-L184 CarbonylContact C-O 3.6Å; V162-L184 WeakPolarHBondContact CA-O 3.45Å; V163-L184 PolarHBondContact N-O 3.23Å; V163-L184 PolarHBondContact O-N 2.87Å; F167-L184 HydrophobicContact CD2-CD1 4.4Å; F167-L184 HydrophobicContact CD2-CG 4.34Å; F167-L184 HydrophobicContact CE2-CD1 4.09Å; F167-L184 HydrophobicContact CE2-CG 3.74Å; F167-L184 HydrophobicContact CZ-CG 4.35Å; L170-L184 HydrophobicContact CD2-CD1 4Å; L170-L184 HydrophobicContact CD2-CD2 4.16Å; L172-L184 HydrophobicContact CD1-CD2 3.85Å; W181-L184 HydrophobicContact CB-CD2 4.46Å; L184-W193 HydrophobicContact CB-CE3 3.76Å; L184-W193 HydrophobicContact CB-CZ3 4.32Å; L184-K194 CarbonylContact C-O 3.53Å; L184-K194 WeakPolarHBondContact CA-O 3.44Å; L184-F452 HydrophobicContact CB-CE2 4.47Å; L184-F452 HydrophobicContact CD1-CD2 4.41Å; L184-F452 HydrophobicContact CD1-CE2 3.6Å; L184-F452 HydrophobicContact CD1-CZ 3.71Å; L184-P453 HydrophobicContact CD1-CG 3.86Å
185	R	92.6	Very high	79.5	Confident	65 Å²	65	73 Å²	73	25%	0.245	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.6	172.8	67.4	178	-178.9	114	-9	110.9	T160 L161 V162 W193 K194 L466	T160-R185 HydrophobicContact CG2-CB 3.83Å; L161-R185 CarbonylContact O-C 3.52Å; L161-R185 WeakPolarHBondContact O-CA 3.29Å; V162-R185 HydrophobicContact CG2-CB 4.4Å; R185-W193 VanDerWaalsContact C-CE3 3.49Å; R185-W193 CarbonylContact O-C 3.32Å; R185-W193 WeakPolarHBondContact O-CA 3.47Å; R185-K194 HydrophobicContact CG-CB 4.15Å; R185-K194 PolarHBondContact N-O 2.87Å; R185-K194 PolarHBondContact O-N 3.25Å; R185-L466 HydrophobicContact CB-CD1 4.24Å
186	Y	91.3	Very high	80.9	Confident	8 Å²	8	67.9 Å²	67.9	3%	0.031	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	119.4	176.3	-170.6	-107.6	0	0	0	110.8	L161 E188 Q191 W193 F449	L161-Y186 PolarHBondContact O-N 2.84Å; Y186-E188 HydrophobicContact CD1-CG 4.08Å; Y186-E188 HydrophobicContact CE1-CG 4.26Å; Y186-Q191 WeakPolarHBondContact OH-CA 3.39Å; Y186-Q191 VanDerWaalsContact OH-CD 3.26Å; Y186-Q191 PolarHBondContact OH-OE1 3.2Å; Y186-W193 AromaticContact CD2-CD2 3.96Å; Y186-W193 HydrophobicContact CD2-CD2 3.96Å; Y186-W193 AromaticContact CD2-CE2 3.8Å; Y186-W193 HydrophobicContact CD2-CE3 4.48Å; Y186-W193 HydrophobicContact CD2-CG 4.22Å; Y186-W193 HydrophobicContact CD2-CZ2 4.28Å; Y186-W193 AromaticContact CD2-NE1 3.89Å; Y186-F449 AromaticContact CD1-CE2 3.77Å; Y186-F449 HydrophobicContact CD1-CE2 3.77Å; Y186-F449 HydrophobicContact CD1-CZ 4.21Å; Y186-F449 AromaticContact CD2-CE2 3.68Å; Y186-F449 HydrophobicContact CD2-CE2 3.68Å; Y186-F449 AromaticContact CD2-CZ 3.63Å; Y186-F449 HydrophobicContact CD2-CZ 3.63Å; Y186-F449 HydrophobicContact CE1-CD2 4.4Å; Y186-F449 AromaticContact CE1-CE2 3.54Å; Y186-F449 HydrophobicContact CE1-CE2 3.54Å; Y186-F449 HydrophobicContact CE1-CZ 4.38Å; Y186-F449 HydrophobicContact CE2-CD2 4.32Å; Y186-F449 AromaticContact CE2-CE2 3.44Å; Y186-F449 HydrophobicContact CE2-CE2 3.44Å; Y186-F449 VanDerWaalsContact CE2-CE2 3.44Å; Y186-F449 AromaticContact CE2-CZ 3.82Å; Y186-F449 HydrophobicContact CE2-CZ 3.82Å; Y186-F449 AromaticContact CG-CE2 3.82Å; Y186-F449 HydrophobicContact CG-CE2 3.82Å; Y186-F449 AromaticContact CG-CZ 3.83Å; Y186-F449 HydrophobicContact CG-CZ 3.83Å; Y186-F449 AromaticContact CZ-CE2 3.35Å
187	G	87.9	Confident	81.9	Confident	6 Å²	6	63.1 Å²	63.1	6%	0.062	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	107.4	170	0	0	0	0	0	110.1	V189 E190 Q191 R192	G187-V189 PolarHBondContact O-N 2.85Å; G187-E190 PolarHBondContact O-N 3.43Å; G187-Q191 VanDerWaalsContact O-CA 3.29Å; G187-Q191 WeakPolarHBondContact O-CA 3.31Å; G187-Q191 PolarHBondContact O-N 3.5Å; G187-R192 PolarHBondContact N-O 3.2Å; G187-R192 PolarHBondContact O-N 3.32Å
188	E	82.7	Confident	83	Confident	75 Å²	75	60 Å²	60	35%	0.35	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-39.5	-178.7	-66	-163.9	139.7	0	0	112.8	Y186 Q191 H414 N415	Y186-E188 HydrophobicContact CD1-CG 4.08Å; Y186-E188 HydrophobicContact CE1-CG 4.26Å; E188-Q191 WeakPolarHBondContact O-CG 3.05Å; E188-Q191 PolarHBondContact O-N 2.84Å; E188-Q191 PolarHBondContact O-NE2 3.04Å; E188-H414 IonicContact OE1-CD2 2.69Å; E188-H414 IonicContact OE1-NE2 3.17Å; E188-H414 PolarHBondContact OE1-NE2 2.91Å; E188-N415 PolarHBondContact OE1-ND2 3.3Å
189	V	84.8	Confident	84.2	Confident	139 Å²	139	53.4 Å²	53.4	84%	0.842	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-44.8	-179.8	179.2	0	0	0	0	110.9	G187 Q191	G187-V189 PolarHBondContact O-N 2.85Å; V189-Q191 VanDerWaalsContact C-N 3.33Å
190	E	83.9	Confident	85.4	Confident	84 Å²	84	47.7 Å²	47.7	39%	0.393	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.5	-179	-50	98.6	154.9	0	0	113.7	G187 R192 K194	G187-E190 PolarHBondContact O-N 3.43Å; E190-R192 HydrophobicContact CB-CG 3.96Å; E190-R192 PolarHBondContact O-N 3.09Å; E190-K194 IonicContact OE1-NZ 2.72Å; E190-K194 PolarHBondContact OE1-NZ 2.98Å; E190-K194 IonicContact OE2-NZ 3.49Å; E190-K194 PolarHBondContact OE2-NZ 3.47Å
191	Q	85.6	Confident	86.4	Confident	92 Å²	92	45 Å²	45	43%	0.43	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	40.1	-178.1	-66.1	-77.8	-51.8	0	0	112.7	Y186 G187 E188 V189	Y186-Q191 WeakPolarHBondContact OH-CA 3.39Å; Y186-Q191 VanDerWaalsContact OH-CD 3.26Å; Y186-Q191 PolarHBondContact OH-OE1 3.2Å; G187-Q191 VanDerWaalsContact O-CA 3.29Å; G187-Q191 WeakPolarHBondContact O-CA 3.31Å; G187-Q191 PolarHBondContact O-N 3.5Å; E188-Q191 WeakPolarHBondContact O-CG 3.05Å; E188-Q191 PolarHBondContact O-N 2.84Å; E188-Q191 PolarHBondContact O-NE2 3.04Å; V189-Q191 VanDerWaalsContact C-N 3.33Å
192	R	87.4	Confident	86.8	Confident	152 Å²	152	51.9 Å²	51.9	57%	0.574	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.5	-175.6	79.7	-179.6	73.8	177.7	5.2	112.7	G187 E190 K194	G187-R192 PolarHBondContact N-O 3.2Å; G187-R192 PolarHBondContact O-N 3.32Å; E190-R192 HydrophobicContact CB-CG 3.96Å; E190-R192 PolarHBondContact O-N 3.09Å; R192-K194 HydrophobicContact CG-CG 4.18Å
193	W	88.7	Confident	86.9	Confident	11 Å²	11	53.1 Å²	53.1	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	137.9	169.5	-69.1	96.6	0	0	0	110.5	V163 L172 L184 R185 Y186 F449 F452 P453 L461	V163-W193 HydrophobicContact CB-CH2 4.22Å; V163-W193 HydrophobicContact CB-CZ3 4.13Å; V163-W193 HydrophobicContact CG2-CH2 3.33Å; V163-W193 HydrophobicContact CG2-CZ2 4.13Å; V163-W193 HydrophobicContact CG2-CZ3 3.73Å; L172-W193 WeakPolarHBondContact CD2-O 3.44Å; L184-W193 HydrophobicContact CB-CE3 3.76Å; L184-W193 HydrophobicContact CB-CZ3 4.32Å; R185-W193 VanDerWaalsContact C-CE3 3.49Å; R185-W193 CarbonylContact O-C 3.32Å; R185-W193 WeakPolarHBondContact O-CA 3.47Å; Y186-W193 AromaticContact CD2-CD2 3.96Å; Y186-W193 HydrophobicContact CD2-CD2 3.96Å; Y186-W193 AromaticContact CD2-CE2 3.8Å; Y186-W193 HydrophobicContact CD2-CE3 4.48Å; Y186-W193 HydrophobicContact CD2-CG 4.22Å; Y186-W193 HydrophobicContact CD2-CZ2 4.28Å; Y186-W193 AromaticContact CD2-NE1 3.89Å; W193-F449 AromaticContact CE2-CZ 3.96Å; W193-F449 HydrophobicContact CH2-CE1 4.37Å; W193-F449 HydrophobicContact CH2-CZ 4.17Å; W193-F449 AromaticContact CZ2-CE1 3.46Å; W193-F449 HydrophobicContact CZ2-CE1 3.46Å; W193-F449 VanDerWaalsContact CZ2-CE1 3.46Å; W193-F449 AromaticContact CZ2-CZ 3.45Å; W193-F449 HydrophobicContact CZ2-CZ 3.45Å; W193-F449 VanDerWaalsContact CZ2-CZ 3.45Å; W193-F452 AromaticContact CD2-CD2 3.99Å; W193-F452 HydrophobicContact CD2-CD2 3.99Å; W193-F452 HydrophobicContact CD2-CE2 4.35Å; W193-F452 AromaticContact CE2-CD2 3.67Å; W193-F452 HydrophobicContact CE3-CE2 4.48Å; W193-F452 HydrophobicContact CG-CD2 4.33Å; W193-F452 AromaticContact CZ2-CD2 3.9Å; W193-F452 HydrophobicContact CZ2-CD2 3.9Å; W193-F452 HydrophobicContact CZ2-CE2 4.44Å; W193-F452 AromaticContact NE1-CD2 3.89Å; W193-P453 HydrophobicContact CB-CG 3.79Å; W193-P453 VanDerWaalsContact CD1-CD 3.47Å; W193-P453 HydrophobicContact CG-CG 4.26Å; W193-L461 HydrophobicContact CH2-CD1 4.33Å
194	K	88	Confident	86.8	Confident	49 Å²	49	53.1 Å²	53.1	21%	0.213	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149.5	175.8	-64.5	179.6	-179.6	172.9	0	109.1	L184 R185 E190 R192	L184-K194 CarbonylContact C-O 3.53Å; L184-K194 WeakPolarHBondContact CA-O 3.44Å; R185-K194 HydrophobicContact CG-CB 4.15Å; R185-K194 PolarHBondContact N-O 2.87Å; R185-K194 PolarHBondContact O-N 3.25Å; E190-K194 IonicContact OE1-NZ 2.72Å; E190-K194 PolarHBondContact OE1-NZ 2.98Å; E190-K194 IonicContact OE2-NZ 3.49Å; E190-K194 PolarHBondContact OE2-NZ 3.47Å; R192-K194 HydrophobicContact CG-CG 4.18Å
195	P	87.8	Confident	86.6	Confident	34 Å²	34	56.3 Å²	56.3	22%	0.221	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	141.7	169	-25.2	36.6	0	0	0	111.7	L172 V174 W181	L172-P195 HydrophobicContact CD1-CG 4.06Å; V174-P195 HydrophobicContact CG2-CG 4.3Å; W181-P195 HydrophobicContact CD2-CB 3.7Å; W181-P195 HydrophobicContact CD2-CG 3.61Å; W181-P195 HydrophobicContact CE3-CB 4.39Å; W181-P195 HydrophobicContact CE3-CG 3.82Å; W181-P195 HydrophobicContact CG-CB 3.73Å; W181-P195 HydrophobicContact CG-CG 4.17Å; W181-P195 HydrophobicContact CH2-CG 4.29Å; W181-P195 HydrophobicContact CZ2-CB 4.47Å; W181-P195 HydrophobicContact CZ2-CG 4.04Å; W181-P195 HydrophobicContact CZ3-CG 4.17Å
196	L	87.4	Confident	86.3	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	30%	0.296	C	S	.	.			trans	-102.1	128	161.2	-173.9	65.3	0	0	0	106.2	V162 M183 N198 Y238 L466 L470	V162-L196 HydrophobicContact CG1-CD2 4.11Å; V162-L196 HydrophobicContact CG2-CD2 4.47Å; M183-L196 HydrophobicContact CB-CB 4.01Å; M183-L196 HydrophobicContact CB-CD2 4.4Å; M183-L196 HydrophobicContact CE-CD2 3.83Å; M183-L196 PolarHBondContact O-N 3.29Å; L196-N198 PolarHBondContact O-N 3.37Å; L196-Y238 HydrophobicContact CD2-CE1 4.07Å; L196-Y238 WeakPolarHBondContact CD2-OH 3.28Å; L196-L466 HydrophobicContact CD1-CD1 4.14Å; L196-L470 HydrophobicContact CD1-CD1 3.92Å; L196-L470 HydrophobicContact CD1-CD2 4.01Å
197	A	73.3	Confident	86.2	Confident	71 Å²	71	57 Å²	57	59%	0.587	30%	0.295	S	S	*	.	S	Bend	trans	-75.1	60.7	-166.2	0	0	0	0	0	113.1	N243	A197-N243 PolarHBondContact O-ND2 3.41Å; A197-N243 PolarHBondContact O-OD1 3.47Å
198	N	82.1	Confident	86.4	Confident	50 Å²	50	59.8 Å²	59.8	27%	0.267	30%	0.303	S	S	.	.			trans	-161	153.8	165.3	-151.4	-30	0	0	0	109	M183 L196 Y238 N243	M183-N198 WeakPolarHBondContact CG-O 3.36Å; M183-N198 HydrophobicContact SD-CB 4.27Å; L196-N198 PolarHBondContact O-N 3.37Å; N198-Y238 HydrophobicContact CB-CE2 4.18Å; N198-N243 PolarHBondContact ND2-O 2.63Å
199	N	84.4	Confident	86.7	Confident	40 Å²	40	57.1 Å²	57.1	21%	0.214	30%	0.296	C	S	.	.			trans	-106.2	167	177.1	-72.6	-24.4	0	0	0	110.3	W181 S182 W245	W181-N199 WeakPolarHBondContact CA-OD1 3.49Å; S182-N199 PolarHBondContact N-OD1 3.18Å; S182-N199 VanDerWaalsContact N-OD1 3.09Å; N199-W245 PolarHBondContact O-NE1 2.82Å
200	L	88.3	Confident	87.2	Confident	7 Å²	7	51.2 Å²	51.2	4%	0.037	26%	0.258	C	S	.	.			trans	-61.4	145.9	173.3	-77.8	169	0	0	0	109.7	I164 S182 Q202 I221 W245	I164-L200 HydrophobicContact CB-CD2 4.46Å; I164-L200 HydrophobicContact CD1-CD2 4.35Å; S182-L200 PolarHBondContact OG-N 3Å; L200-Q202 PolarHBondContact O-N 3.2Å; L200-I221 HydrophobicContact CD2-CD1 3.93Å; L200-W245 HydrophobicContact CD2-CH2 4.48Å; L200-W245 HydrophobicContact CD2-CZ2 4.06Å
201	P	91.2	Very high	87.7	Confident	17 Å²	17	47.4 Å²	47.4	11%	0.11	24%	0.241	C	C	.	.			trans	-51.8	140	169.9	-26.6	35.5	0	0	0	111.2	D203 M204 I205 H236 W245	P201-D203 VanDerWaalsContact CB-OD1 3.24Å; P201-D203 WeakPolarHBondContact CB-OD1 3.45Å; P201-D203 PolarHBondContact O-N 3.02Å; P201-D203 VanDerWaalsContact O-N 3.09Å; P201-M204 HydrophobicContact CB-CB 4.38Å; P201-M204 HydrophobicContact CB-CG 4.16Å; P201-M204 HydrophobicContact CG-CG 4.44Å; P201-M204 WeakPolarHBondContact O-CA 3.03Å; P201-M204 WeakPolarHBondContact O-CB 3.2Å; P201-M204 PolarHBondContact O-N 3.26Å; P201-I205 PolarHBondContact O-N 2.86Å; P201-H236 HydrophobicContact CG-CB 3.95Å; P201-W245 HydrophobicContact CG-CB 3.93Å; P201-W245 HydrophobicContact CG-CD2 3.81Å; P201-W245 HydrophobicContact CG-CE3 4Å; P201-W245 HydrophobicContact CG-CG 3.8Å
202	Q	87.2	Confident	88.2	Confident	175 Å²	175	44.8 Å²	44.8	82%	0.818	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-55.7	-33.8	-173	-71.4	-175.4	-12.2	0	0	113.7	L200 M204	L200-Q202 PolarHBondContact O-N 3.2Å; Q202-M204 VanDerWaalsContact C-N 3.27Å; Q202-M204 PolarHBondContact O-N 3.22Å
203	D	87.6	Confident	88.6	Confident	39 Å²	39	38.1 Å²	38.1	21%	0.209	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-74.9	-17.2	178.7	62.2	-30.5	0	0	0	113.7	P201 V207 R226 A234 H236	P201-D203 VanDerWaalsContact CB-OD1 3.24Å; P201-D203 WeakPolarHBondContact CB-OD1 3.45Å; P201-D203 PolarHBondContact O-N 3.02Å; P201-D203 VanDerWaalsContact O-N 3.09Å; D203-V207 VanDerWaalsContact O-CG2 3.31Å; D203-V207 WeakPolarHBondContact O-CG2 3.37Å; D203-R226 PolarHBondContact O-NH1 3.04Å; D203-R226 PolarHBondContact O-NH2 3.45Å; D203-A234 WeakPolarHBondContact OD2-CB 3.5Å; D203-H236 IonicContact OD1-CD2 3.89Å; D203-H236 IonicContact OD1-CE1 2.85Å; D203-H236 PolarHBondContact OD1-CE1 2.71Å; D203-H236 IonicContact OD1-NE2 2.73Å; D203-H236 PolarHBondContact OD1-NE2 3.23Å; D203-H236 IonicContact OD2-CD2 3.04Å; D203-H236 IonicContact OD2-CE1 3.99Å; D203-H236 IonicContact OD2-NE2 3.34Å; D203-H236 PolarHBondContact OD2-NE2 3.38Å
204	M	89.8	Confident	89.1	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-96.1	-7.5	177.5	-62	-58.6	-62.2	0	0	113.7	P201 Q202 V207 Y210 I221 I232	P201-M204 HydrophobicContact CB-CB 4.38Å; P201-M204 HydrophobicContact CB-CG 4.16Å; P201-M204 HydrophobicContact CG-CG 4.44Å; P201-M204 WeakPolarHBondContact O-CA 3.03Å; P201-M204 WeakPolarHBondContact O-CB 3.2Å; P201-M204 PolarHBondContact O-N 3.26Å; Q202-M204 VanDerWaalsContact C-N 3.27Å; Q202-M204 PolarHBondContact O-N 3.22Å; M204-V207 HydrophobicContact CE-CG1 4.31Å; M204-V207 WeakPolarHBondContact O-CB 3.29Å; M204-V207 PolarHBondContact O-N 3.13Å; M204-Y210 HydrophobicContact CE-CD1 4.15Å; M204-Y210 HydrophobicContact CE-CD2 4.19Å; M204-Y210 HydrophobicContact CE-CG 3.85Å; M204-I221 HydrophobicContact CB-CD1 3.99Å; M204-I221 HydrophobicContact CE-CB 4.23Å; M204-I221 HydrophobicContact CE-CD1 3.95Å; M204-I221 HydrophobicContact CE-CG1 4.03Å; M204-I221 HydrophobicContact CG-CD1 3.7Å; M204-I221 HydrophobicContact CG-CG1 4.35Å; M204-I232 HydrophobicContact SD-CD1 3.89Å
205	I	86.3	Confident	89.5	Confident	66 Å²	66	38.1 Å²	38.1	34%	0.338	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	134.6	173.1	-59	176	0	0	0	109.7	P201 V207	P201-I205 PolarHBondContact O-N 2.86Å; I205-V207 PolarHBondContact O-N 3.23Å
206	N	86.2	Confident	89.9	Confident	88 Å²	88	38 Å²	38	47%	0.471	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	25.8	-177.9	-60.6	-55.2	0	0	0	114.1	D166 M227	D166-N206 PolarHBondContact OD1-N 3.41Å; D166-N206 VanDerWaalsContact OD2-CA 3.23Å; D166-N206 WeakPolarHBondContact OD2-CA 3.44Å; D166-N206 PolarHBondContact OD2-N 2.73Å; N206-M227 HydrophobicContact CB-CG 4.13Å
207	V	90.6	Very high	90.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	133.2	173.2	179.1	0	0	0	0	109.2	D203 M204 I205 Y210 R226 I232 N458	D203-V207 VanDerWaalsContact O-CG2 3.31Å; D203-V207 WeakPolarHBondContact O-CG2 3.37Å; M204-V207 HydrophobicContact CE-CG1 4.31Å; M204-V207 WeakPolarHBondContact O-CB 3.29Å; M204-V207 PolarHBondContact O-N 3.13Å; I205-V207 PolarHBondContact O-N 3.23Å; V207-Y210 HydrophobicContact CB-CD1 4.33Å; V207-Y210 HydrophobicContact CG1-CD1 4.06Å; V207-Y210 WeakPolarHBondContact O-CD1 3.12Å; V207-Y210 VanDerWaalsContact O-CE1 3.26Å; V207-Y210 WeakPolarHBondContact O-CE1 3.38Å; V207-R226 HydrophobicContact CG2-CG 4.41Å; V207-I232 HydrophobicContact CB-CD1 4.49Å; V207-I232 HydrophobicContact CG1-CD1 3.81Å; V207-I232 HydrophobicContact CG1-CG1 4.4Å; V207-I232 HydrophobicContact CG2-CD1 3.86Å; V207-N458 PolarHBondContact O-ND2 3.15Å
208	R	90.9	Very high	91.5	Very high	65 Å²	65	35 Å²	35	25%	0.245	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	154.7	179	-53.8	-133.4	178.8	152.9	-2.8	111.5	Y210 G224 Y225 M227 N458	R208-Y210 PolarHBondContact O-N 3.09Å; R208-Y210 VanDerWaalsContact O-N 3.15Å; R208-G224 CarbonylContact O-C 3.51Å; R208-G224 WeakPolarHBondContact O-CA 3.45Å; R208-Y225 HydrophobicContact CB-CD1 4.16Å; R208-Y225 HydrophobicContact CB-CD2 4.4Å; R208-Y225 HydrophobicContact CB-CE1 3.62Å; R208-Y225 HydrophobicContact CB-CE2 3.88Å; R208-Y225 VanDerWaalsContact CB-CZ 3.46Å; R208-Y225 HydrophobicContact CG-CE2 4.36Å; R208-Y225 PolarHBondContact N-O 2.97Å; R208-Y225 WeakPolarHBondContact O-CD1 3.24Å; R208-Y225 WeakPolarHBondContact O-CE1 3.3Å; R208-Y225 PolarHBondContact O-N 2.97Å; R208-M227 HydrophobicContact CG-SD 4.4Å; R208-N458 WeakPolarHBondContact CA-OD1 3.45Å; R208-N458 WeakPolarHBondContact CB-OD1 3.43Å; R208-N458 WeakPolarHBondContact CD-ND2 3.31Å; R208-N458 WeakPolarHBondContact CD-OD1 3.23Å; R208-N458 VanDerWaalsContact CG-ND2 3.28Å; R208-N458 WeakPolarHBondContact CG-ND2 3.28Å
209	G	90.1	Very high	92.2	Very high	18 Å²	18	32.7 Å²	32.7	19%	0.186	18%	0.175	C	C	.	.	S	Bend	trans	62.2	23.9	170.3	0	0	0	0	0	114.8	N257	G209-N257 PolarHBondContact O-N 2.98Å
210	Y	93.8	Very high	92.9	Very high	15 Å²	15	30.8 Å²	30.8	6%	0.059	16%	0.164	C	C	.	.			trans	-72.3	150.1	170.2	58.8	-91.8	0	0	0	110.3	I164 M204 V207 R208 I221 A222 G223 N458 L460	I164-Y210 HydrophobicContact CD1-CE2 4.28Å; M204-Y210 HydrophobicContact CE-CD1 4.15Å; M204-Y210 HydrophobicContact CE-CD2 4.19Å; M204-Y210 HydrophobicContact CE-CG 3.85Å; V207-Y210 HydrophobicContact CB-CD1 4.33Å; V207-Y210 HydrophobicContact CG1-CD1 4.06Å; V207-Y210 WeakPolarHBondContact O-CD1 3.12Å; V207-Y210 VanDerWaalsContact O-CE1 3.26Å; V207-Y210 WeakPolarHBondContact O-CE1 3.38Å; R208-Y210 PolarHBondContact O-N 3.09Å; R208-Y210 VanDerWaalsContact O-N 3.15Å; Y210-I221 HydrophobicContact CD2-CB 3.86Å; Y210-I221 HydrophobicContact CD2-CG2 4Å; Y210-I221 HydrophobicContact CE2-CB 4.03Å; Y210-I221 HydrophobicContact CE2-CG2 3.72Å; Y210-A222 CarbonylContact C-O 3.57Å; Y210-A222 WeakPolarHBondContact CA-O 3.34Å; Y210-A222 VanDerWaalsContact CB-O 3.31Å; Y210-A222 WeakPolarHBondContact CB-O 3.38Å; Y210-G223 VanDerWaalsContact CB-O 3.29Å; Y210-G223 WeakPolarHBondContact CB-O 3.34Å; Y210-N458 HydrophobicContact CE1-CB 4.04Å; Y210-N458 PolarHBondContact OH-O 3.38Å; Y210-L460 HydrophobicContact CD2-CD1 3.79Å; Y210-L460 HydrophobicContact CE2-CD1 3.16Å; Y210-L460 HydrophobicContact CE2-CG 4.27Å
211	G	94.4	Very high	93.3	Very high	4 Å²	4	30.4 Å²	30.4	4%	0.041	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	147.6	174.2	0	0	0	0	0	110.9	I221 A222	G211-I221 CarbonylContact O-C 3.58Å; G211-I221 WeakPolarHBondContact O-CA 3.15Å; G211-A222 PolarHBondContact N-O 2.9Å; G211-A222 PolarHBondContact O-N 2.93Å
212	S	95.9	Very high	93.6	Very high	38 Å²	38	29.6 Å²	29.6	27%	0.266	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143	172.7	64.8	0	0	0	0	111.9	F220	S212-F220 WeakPolarHBondContact CA-O 3.31Å
213	A	97.4	Very high	94	Very high	11 Å²	11	21.3 Å²	21.3	9%	0.091	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	154.7	173.9	0	0	0	0	0	110.9	F220 L260 L267	A213-F220 PolarHBondContact N-O 2.88Å; A213-F220 VanDerWaalsContact N-O 3.14Å; A213-F220 PolarHBondContact O-N 3.15Å; A213-L260 HydrophobicContact CB-CB 4.31Å; A213-L260 HydrophobicContact CB-CD2 3.9Å; A213-L260 HydrophobicContact CB-CG 3.77Å; A213-L267 HydrophobicContact CB-CD2 3.78Å
214	V	97.5	Very high	94.4	Very high	52 Å²	52	19.4 Å²	19.4	32%	0.315	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124	172	179.2	0	0	0	0	108.8	Y218 L219 A262 C462 L464	V214-Y218 CarbonylContact C-O 3.59Å; V214-Y218 VanDerWaalsContact CA-O 3.26Å; V214-Y218 WeakPolarHBondContact CA-O 3.23Å; V214-L219 HydrophobicContact CG2-CD1 4.2Å; V214-A262 WeakPolarHBondContact O-CB 3.37Å; V214-C462 HydrophobicContact CG2-CB 4.04Å; V214-L464 HydrophobicContact CB-CD2 4.49Å; V214-L464 HydrophobicContact CG1-CD2 3.75Å; V214-L464 HydrophobicContact CG2-CD2 3.84Å
215	L	97.4	Very high	94.5	Very high	9 Å²	9	22.5 Å²	22.5	5%	0.047	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	126.2	176.7	173	66.9	0	0	0	109.3	N217 Y218 F220 A262 L267 P283	L215-N217 PolarHBondContact O-N 3.49Å; L215-Y218 PolarHBondContact N-O 2.84Å; L215-Y218 WeakPolarHBondContact O-CB 3.31Å; L215-Y218 PolarHBondContact O-N 2.91Å; L215-F220 HydrophobicContact CB-CD2 4.29Å; L215-F220 HydrophobicContact CB-CE2 3.98Å; L215-A262 HydrophobicContact CB-CB 4.07Å; L215-A262 HydrophobicContact CD1-CB 4.21Å; L215-L267 HydrophobicContact CB-CD2 3.83Å; L215-L267 HydrophobicContact CB-CG 4.39Å; L215-L267 HydrophobicContact CD2-CD2 4.12Å; L215-L267 HydrophobicContact CD2-CG 3.84Å; L215-P283 HydrophobicContact CD2-CG 3.72Å
216	D	96.4	Very high	94.8	Very high	32 Å²	32	23.4 Å²	23.4	17%	0.171	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	41.1	-176.9	-52.4	-47	0	0	0	112.8	Y130 H131 R151 R154 Y218	Y130-D216 HydrophobicContact CD1-CB 4.1Å; Y130-D216 HydrophobicContact CE1-CB 4.07Å; H131-D216 IonicContact CD2-OD2 3.74Å; H131-D216 IonicContact CE1-OD2 3.76Å; H131-D216 IonicContact NE2-OD2 2.76Å; H131-D216 PolarHBondContact NE2-OD2 3.36Å; R151-D216 IonicContact NH1-OD1 2.67Å; R154-D216 PolarHBondContact NE-O 2.95Å; R154-D216 PolarHBondContact NH2-O 3.37Å; R154-D216 VanDerWaalsContact NH2-O 3.09Å; D216-Y218 HydrophobicContact CB-CD2 4.2Å; D216-Y218 VanDerWaalsContact O-CD2 3.3Å; D216-Y218 WeakPolarHBondContact O-CD2 3.06Å; D216-Y218 PolarHBondContact O-N 3.15Å; D216-Y218 VanDerWaalsContact O-N 3.15Å
217	N	96.9	Very high	94.7	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.021	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	20.1	-174.2	-163.3	37	0	0	0	114.8	R154 M155 L215 P240 Y465	R154-N217 PolarHBondContact O-ND2 3.05Å; M155-N217 HydrophobicContact SD-CB 3.79Å; L215-N217 PolarHBondContact O-N 3.49Å; N217-P240 WeakPolarHBondContact ND2-CG 3.48Å; N217-P240 WeakPolarHBondContact O-CD 3.01Å; N217-P240 WeakPolarHBondContact O-CG 3.38Å; N217-Y465 PolarHBondContact ND2-O 3.18Å; N217-Y465 PolarHBondContact OD1-N 3.04Å
218	Y	97.4	Very high	94.6	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.016	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	135.2	164.3	-67.7	-93.9	0	0	0	109.2	C128 Y130 H131 R154 V214 L215 D216 Y238 N239	C128-Y218 PolarHBondContact O-OH 3.2Å; Y130-Y218 HydrophobicContact CD1-CE2 4.47Å; Y130-Y218 PolarHBondContact N-OH 3.09Å; Y130-Y218 VanDerWaalsContact N-OH 3.17Å; H131-Y218 HydrophobicContact CB-CE2 4.32Å; H131-Y218 AromaticContact CD2-CE2 3.71Å; H131-Y218 AromaticContact CE1-CD2 3.62Å; H131-Y218 AromaticContact CG-CE2 3.74Å; H131-Y218 PolarHBondContact N-OH 3.48Å; H131-Y218 AromaticContact ND1-CD2 3.81Å; H131-Y218 AromaticContact NE2-CD2 3.75Å; H131-Y218 AromaticContact NE2-CE2 3.94Å; R154-Y218 VanDerWaalsContact NE-CE2 3.34Å; R154-Y218 PolarHBondContact NH1-OH 2.75Å; R154-Y218 VanDerWaalsContact NH2-CZ 3.29Å; V214-Y218 CarbonylContact C-O 3.59Å; V214-Y218 VanDerWaalsContact CA-O 3.26Å; V214-Y218 WeakPolarHBondContact CA-O 3.23Å; L215-Y218 PolarHBondContact N-O 2.84Å; L215-Y218 WeakPolarHBondContact O-CB 3.31Å; L215-Y218 PolarHBondContact O-N 2.91Å; D216-Y218 HydrophobicContact CB-CD2 4.2Å; D216-Y218 VanDerWaalsContact O-CD2 3.3Å; D216-Y218 WeakPolarHBondContact O-CD2 3.06Å; D216-Y218 PolarHBondContact O-N 3.15Å; D216-Y218 VanDerWaalsContact O-N 3.15Å; Y218-Y238 WeakPolarHBondContact CA-O 3.42Å; Y218-N239 HydrophobicContact CD1-CB 3.85Å; Y218-N239 HydrophobicContact CE1-CB 3.56Å
219	L	97.6	Very high	94.3	Very high	2 Å²	2	31 Å²	31	1%	0.01	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	118.5	172.1	168.3	65.1	0	0	0	109.3	I164 V214 C237 Y238 W245 C462 L464	I164-L219 HydrophobicContact CD1-CD2 4.05Å; I164-L219 HydrophobicContact CG2-CD2 3.87Å; V214-L219 HydrophobicContact CG2-CD1 4.2Å; L219-C237 CarbonylContact O-C 3.55Å; L219-C237 VanDerWaalsContact O-CA 3.28Å; L219-C237 WeakPolarHBondContact O-CA 3.48Å; L219-Y238 PolarHBondContact N-O 3.27Å; L219-Y238 VanDerWaalsContact N-O 3.1Å; L219-Y238 PolarHBondContact O-N 3.17Å; L219-W245 HydrophobicContact CD2-CH2 4.18Å; L219-W245 HydrophobicContact CG-CH2 4.36Å; L219-C462 HydrophobicContact CD1-CB 4.29Å; L219-L464 HydrophobicContact CB-CD1 4.14Å; L219-L464 HydrophobicContact CB-CD2 4.23Å; L219-L464 HydrophobicContact CD2-CD1 4.49Å
220	F	98	Very high	94.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	140.8	175.1	-72.3	-100.6	0	0	0	111	H131 S212 A213 L215 V235 H236 C237 V248 L260 L267 Y281	H131-F220 AromaticContact CE1-CE2 3.79Å; H131-F220 AromaticContact CE1-CZ 3.57Å; H131-F220 AromaticContact ND1-CZ 3.58Å; S212-F220 WeakPolarHBondContact CA-O 3.31Å; A213-F220 PolarHBondContact N-O 2.88Å; A213-F220 VanDerWaalsContact N-O 3.14Å; A213-F220 PolarHBondContact O-N 3.15Å; L215-F220 HydrophobicContact CB-CD2 4.29Å; L215-F220 HydrophobicContact CB-CE2 3.98Å; F220-V235 HydrophobicContact CD1-CG1 4.28Å; F220-H236 WeakPolarHBondContact CA-O 3.33Å; F220-C237 HydrophobicContact CD1-CB 3.63Å; F220-C237 HydrophobicContact CD2-CB 4.3Å; F220-C237 HydrophobicContact CE1-CB 3.46Å; F220-C237 VanDerWaalsContact CE1-CB 3.46Å; F220-C237 HydrophobicContact CE2-CB 4.14Å; F220-C237 HydrophobicContact CG-CB 4.06Å; F220-C237 HydrophobicContact CZ-CB 3.72Å; F220-V248 HydrophobicContact CD1-CG2 4.49Å; F220-V248 HydrophobicContact CE1-CG2 4.24Å; F220-L260 HydrophobicContact CB-CD2 4.09Å; F220-L267 HydrophobicContact CB-CD1 3.94Å; F220-L267 HydrophobicContact CD1-CD1 3.43Å; F220-L267 VanDerWaalsContact CD1-CD1 3.43Å; F220-L267 HydrophobicContact CD2-CD1 3.7Å; F220-L267 HydrophobicContact CE1-CD1 3.74Å; F220-L267 HydrophobicContact CE2-CD1 3.99Å; F220-L267 HydrophobicContact CG-CD1 3.4Å; F220-L267 VanDerWaalsContact CG-CD1 3.4Å; F220-L267 HydrophobicContact CZ-CD1 4.02Å; F220-Y281 AromaticContact CE1-CE1 3.98Å; F220-Y281 HydrophobicContact CE1-CE1 3.98Å; F220-Y281 HydrophobicContact CZ-CE1 4.28Å
221	I	97	Very high	94.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.7	166.1	61.6	-178.1	0	0	0	108.7	I164 L200 M204 Y210 G211 V235 H236 W245	I164-I221 HydrophobicContact CD1-CG2 3.57Å; L200-I221 HydrophobicContact CD2-CD1 3.93Å; M204-I221 HydrophobicContact CB-CD1 3.99Å; M204-I221 HydrophobicContact CE-CB 4.23Å; M204-I221 HydrophobicContact CE-CD1 3.95Å; M204-I221 HydrophobicContact CE-CG1 4.03Å; M204-I221 HydrophobicContact CG-CD1 3.7Å; M204-I221 HydrophobicContact CG-CG1 4.35Å; Y210-I221 HydrophobicContact CD2-CB 3.86Å; Y210-I221 HydrophobicContact CD2-CG2 4Å; Y210-I221 HydrophobicContact CE2-CB 4.03Å; Y210-I221 HydrophobicContact CE2-CG2 3.72Å; G211-I221 CarbonylContact O-C 3.58Å; G211-I221 WeakPolarHBondContact O-CA 3.15Å; I221-V235 WeakPolarHBondContact O-CA 3.46Å; I221-H236 HydrophobicContact CD1-CB 4.32Å; I221-H236 HydrophobicContact CG1-CB 3.91Å; I221-H236 PolarHBondContact N-O 3.23Å; I221-H236 PolarHBondContact O-N 3.45Å; I221-W245 HydrophobicContact CD1-CE3 4.38Å; I221-W245 HydrophobicContact CD1-CH2 3.69Å; I221-W245 HydrophobicContact CD1-CZ2 4.46Å; I221-W245 HydrophobicContact CD1-CZ3 3.65Å; I221-W245 HydrophobicContact CG1-CH2 4.09Å; I221-W245 HydrophobicContact CG1-CZ3 3.73Å; I221-W245 HydrophobicContact CG2-CH2 4.11Å; I221-W245 HydrophobicContact CG2-CZ3 4.42Å
222	A	97.2	Very high	94.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	136.7	-170.7	0	0	0	0	0	112.7	Y210 G211 V235 L251 F258 L260	Y210-A222 CarbonylContact C-O 3.57Å; Y210-A222 WeakPolarHBondContact CA-O 3.34Å; Y210-A222 VanDerWaalsContact CB-O 3.31Å; Y210-A222 WeakPolarHBondContact CB-O 3.38Å; G211-A222 PolarHBondContact N-O 2.9Å; G211-A222 PolarHBondContact O-N 2.93Å; A222-V235 HydrophobicContact CB-CB 4.4Å; A222-V235 HydrophobicContact CB-CG1 4.02Å; A222-V235 HydrophobicContact CB-CG2 3.82Å; A222-L251 HydrophobicContact CB-CD1 4.43Å; A222-F258 HydrophobicContact CB-CZ 3.85Å; A222-F258 WeakPolarHBondContact O-CE1 3.44Å; A222-F258 WeakPolarHBondContact O-CZ 3.38Å; A222-L260 HydrophobicContact CB-CD2 3.99Å
223	G	96.2	Very high	94.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.			trans	63.8	-141.2	172.7	0	0	0	0	0	113.3	Y210 I232 A234	Y210-G223 VanDerWaalsContact CB-O 3.29Å; Y210-G223 WeakPolarHBondContact CB-O 3.34Å; G223-I232 WeakPolarHBondContact CA-O 3.47Å; G223-I232 WeakPolarHBondContact O-CD1 3.31Å; G223-I232 VanDerWaalsContact O-CG1 3.3Å; G223-I232 WeakPolarHBondContact O-CG1 3.43Å; G223-A234 PolarHBondContact N-O 3Å
224	G	94.8	Very high	94.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.201	C	C	.	.			trans	97	-169.9	-173.8	0	0	0	0	0	112.7	R208 E231 I232 R255	R208-G224 CarbonylContact O-C 3.51Å; R208-G224 WeakPolarHBondContact O-CA 3.45Å; G224-E231 WeakPolarHBondContact O-CA 3.33Å; G224-I232 PolarHBondContact O-N 2.9Å; G224-R255 PolarHBondContact N-O 2.84Å
225	Y	93.1	Very high	94.4	Very high	65 Å²	65	35.3 Å²	35.3	26%	0.255	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	142.7	178.5	65.2	-80.2	0	0	0	111.1	R208 Q230	R208-Y225 HydrophobicContact CB-CD1 4.16Å; R208-Y225 HydrophobicContact CB-CD2 4.4Å; R208-Y225 HydrophobicContact CB-CE1 3.62Å; R208-Y225 HydrophobicContact CB-CE2 3.88Å; R208-Y225 VanDerWaalsContact CB-CZ 3.46Å; R208-Y225 HydrophobicContact CG-CE2 4.36Å; R208-Y225 PolarHBondContact N-O 2.97Å; R208-Y225 WeakPolarHBondContact O-CD1 3.24Å; R208-Y225 WeakPolarHBondContact O-CE1 3.3Å; R208-Y225 PolarHBondContact O-N 2.97Å; Y225-Q230 CarbonylContact C-O 3.55Å; Y225-Q230 VanDerWaalsContact CA-O 3.29Å; Y225-Q230 WeakPolarHBondContact CA-O 3.21Å
226	R	91.2	Very high	94.4	Very high	84 Å²	84	35.5 Å²	35.5	32%	0.317	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	166.1	175.7	-64	-177.6	-179.7	-78.5	-7.2	110.5	D203 V207 T228 S229 Q230 I232	D203-R226 PolarHBondContact O-NH1 3.04Å; D203-R226 PolarHBondContact O-NH2 3.45Å; V207-R226 HydrophobicContact CG2-CG 4.41Å; R226-T228 PolarHBondContact O-N 2.76Å; R226-S229 WeakPolarHBondContact O-CA 3.28Å; R226-S229 PolarHBondContact O-N 2.93Å; R226-Q230 PolarHBondContact N-O 3.02Å; R226-I232 HydrophobicContact CG-CG2 4.19Å
227	M	85	Confident	94.5	Very high	112 Å²	112	34.3 Å²	34.3	55%	0.552	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-23.7	171.7	-66.3	-60.3	-69	0	0	113.8	N206 R208 S229	N206-M227 HydrophobicContact CB-CG 4.13Å; R208-M227 HydrophobicContact CG-SD 4.4Å; M227-S229 PolarHBondContact O-N 2.73Å
228	T	87.5	Confident	94.5	Very high	107 Å²	107	34.1 Å²	34.1	66%	0.656	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	4.9	172	56.4	0	0	0	0	114	R226 Q230	R226-T228 PolarHBondContact O-N 2.76Å; T228-Q230 PolarHBondContact O-N 2.82Å
229	S	86	Confident	94.4	Very high	95 Å²	95	34.1 Å²	34.1	66%	0.664	18%	0.18	S	C	*	.	S	Bend	trans	62.2	15.9	-171.6	-52.1	0	0	0	0	114.7	R226 M227	R226-S229 WeakPolarHBondContact O-CA 3.28Å; R226-S229 PolarHBondContact O-N 2.93Å; M227-S229 PolarHBondContact O-N 2.73Å
230	Q	90.9	Very high	94.3	Very high	103 Å²	103	34.1 Å²	34.1	48%	0.481	18%	0.18	S	C	.	.			trans	-80.8	119.1	173.8	-174.6	-175.7	25.5	0	0	110.2	Y225 R226 T228	Y225-Q230 CarbonylContact C-O 3.55Å; Y225-Q230 VanDerWaalsContact CA-O 3.29Å; Y225-Q230 WeakPolarHBondContact CA-O 3.21Å; R226-Q230 PolarHBondContact N-O 3.02Å; T228-Q230 PolarHBondContact O-N 2.82Å
231	E	94.1	Very high	94	Very high	65 Å²	65	35.9 Å²	35.9	30%	0.304	19%	0.192	S	C	.	.	B	Isolated β-bridge	trans	-71.1	146.3	172.1	-60.2	-173.2	125.8	0	0	111.9	G224 K254 S256	G224-E231 WeakPolarHBondContact O-CA 3.33Å; E231-K254 HydrophobicContact CB-CB 3.89Å; E231-K254 HydrophobicContact CB-CD 4.44Å; E231-K254 VanDerWaalsContact O-CD 3.32Å; E231-K254 WeakPolarHBondContact O-CD 3.17Å; E231-K254 PolarHBondContact O-NZ 2.92Å; E231-S256 WeakPolarHBondContact OE1-CB 3.25Å; E231-S256 PolarHBondContact OE1-OG 2.86Å
232	I	95.3	Very high	93.7	Very high	15 Å²	15	40.4 Å²	40.4	8%	0.077	21%	0.209	C	C	.	.			trans	-123.3	160.2	178.9	68	173.7	0	0	0	110.8	M204 V207 G223 G224 R226 A234	M204-I232 HydrophobicContact SD-CD1 3.89Å; V207-I232 HydrophobicContact CB-CD1 4.49Å; V207-I232 HydrophobicContact CG1-CD1 3.81Å; V207-I232 HydrophobicContact CG1-CG1 4.4Å; V207-I232 HydrophobicContact CG2-CD1 3.86Å; G223-I232 WeakPolarHBondContact CA-O 3.47Å; G223-I232 WeakPolarHBondContact O-CD1 3.31Å; G223-I232 VanDerWaalsContact O-CG1 3.3Å; G223-I232 WeakPolarHBondContact O-CG1 3.43Å; G224-I232 PolarHBondContact O-N 2.9Å; R226-I232 HydrophobicContact CG-CG2 4.19Å; I232-A234 HydrophobicContact CD1-CB 4.38Å
233	S	96.3	Very high	93.5	Very high	30 Å²	30	41.9 Å²	41.9	21%	0.21	22%	0.217	C	C	.	.			trans	-117.9	4.5	176.5	52.7	0	0	0	0	112.6	P250 L251	S233-P250 CarbonylContact O-C 3.6Å; S233-P250 VanDerWaalsContact O-CA 3.23Å; S233-P250 WeakPolarHBondContact O-CA 3.37Å; S233-P250 VanDerWaalsContact O-CB 3.29Å; S233-P250 WeakPolarHBondContact O-CB 3.46Å; S233-L251 WeakPolarHBondContact CB-O 3.13Å; S233-L251 PolarHBondContact O-N 2.72Å
234	A	97.3	Very high	93.3	Very high	14 Å²	14	45.2 Å²	45.2	12%	0.116	23%	0.232	C	C	.	.			trans	-60.4	141.8	-179.1	0	0	0	0	0	110.9	D203 G223 I232	D203-A234 WeakPolarHBondContact OD2-CB 3.5Å; G223-A234 PolarHBondContact N-O 3Å; I232-A234 HydrophobicContact CD1-CB 4.38Å
235	V	98.1	Very high	93.4	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.2	177.1	-173.8	0	0	0	0	108.2	F220 I221 A222 V248 L251 W288	F220-V235 HydrophobicContact CD1-CG1 4.28Å; I221-V235 WeakPolarHBondContact O-CA 3.46Å; A222-V235 HydrophobicContact CB-CB 4.4Å; A222-V235 HydrophobicContact CB-CG1 4.02Å; A222-V235 HydrophobicContact CB-CG2 3.82Å; V235-V248 HydrophobicContact CB-CG2 3.72Å; V235-V248 HydrophobicContact CG1-CG2 3.38Å; V235-V248 PolarHBondContact O-N 2.8Å; V235-L251 HydrophobicContact CG2-CG 3.93Å; V235-W288 HydrophobicContact CG1-CZ2 4.34Å; V235-W288 HydrophobicContact CG2-CZ2 4.09Å
236	H	97.3	Very high	93.4	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.056	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	146.9	177.1	-68.4	-92.1	0	0	0	110.3	P201 D203 F220 I221 W245 N246	P201-H236 HydrophobicContact CG-CB 3.95Å; D203-H236 IonicContact OD1-CD2 3.89Å; D203-H236 IonicContact OD1-CE1 2.85Å; D203-H236 PolarHBondContact OD1-CE1 2.71Å; D203-H236 IonicContact OD1-NE2 2.73Å; D203-H236 PolarHBondContact OD1-NE2 3.23Å; D203-H236 IonicContact OD2-CD2 3.04Å; D203-H236 IonicContact OD2-CE1 3.99Å; D203-H236 IonicContact OD2-NE2 3.34Å; D203-H236 PolarHBondContact OD2-NE2 3.38Å; F220-H236 WeakPolarHBondContact CA-O 3.33Å; I221-H236 HydrophobicContact CD1-CB 4.32Å; I221-H236 HydrophobicContact CG1-CB 3.91Å; I221-H236 PolarHBondContact N-O 3.23Å; I221-H236 PolarHBondContact O-N 3.45Å; H236-W245 HydrophobicContact CB-CE3 3.81Å; H236-W245 HydrophobicContact CB-CZ3 4.16Å; H236-N246 CarbonylContact C-O 3.53Å; H236-N246 WeakPolarHBondContact CA-O 3.39Å
237	C	96.9	Very high	93.7	Very high	7 Å²	7	49.8 Å²	49.8	5%	0.047	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.7	171.7	72.9	0	0	0	0	111	L219 F220 W245 N246 V248	L219-C237 CarbonylContact O-C 3.55Å; L219-C237 VanDerWaalsContact O-CA 3.28Å; L219-C237 WeakPolarHBondContact O-CA 3.48Å; F220-C237 HydrophobicContact CD1-CB 3.63Å; F220-C237 HydrophobicContact CD2-CB 4.3Å; F220-C237 HydrophobicContact CE1-CB 3.46Å; F220-C237 VanDerWaalsContact CE1-CB 3.46Å; F220-C237 HydrophobicContact CE2-CB 4.14Å; F220-C237 HydrophobicContact CG-CB 4.06Å; F220-C237 HydrophobicContact CZ-CB 3.72Å; C237-W245 VanDerWaalsContact C-CE3 3.5Å; C237-W245 CarbonylContact O-C 3.59Å; C237-W245 WeakPolarHBondContact O-CA 3.25Å; C237-N246 PolarHBondContact N-O 2.83Å; C237-N246 PolarHBondContact O-N 3.2Å; C237-V248 HydrophobicContact CB-CG1 4.44Å
238	Y	97.1	Very high	94.3	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	129.1	173.4	176.2	-105.8	0	0	0	109.7	M183 L196 N198 Y218 L219 P240 N243 E244 W245 L464	M183-Y238 HydrophobicContact CE-CD1 3.91Å; M183-Y238 HydrophobicContact CE-CD2 4.05Å; M183-Y238 HydrophobicContact CE-CE1 3.91Å; M183-Y238 HydrophobicContact CE-CE2 4.05Å; M183-Y238 HydrophobicContact CE-CG 3.98Å; M183-Y238 HydrophobicContact SD-CD2 4.32Å; M183-Y238 HydrophobicContact SD-CE2 4.21Å; L196-Y238 HydrophobicContact CD2-CE1 4.07Å; L196-Y238 WeakPolarHBondContact CD2-OH 3.28Å; N198-Y238 HydrophobicContact CB-CE2 4.18Å; Y218-Y238 WeakPolarHBondContact CA-O 3.42Å; L219-Y238 PolarHBondContact N-O 3.27Å; L219-Y238 VanDerWaalsContact N-O 3.1Å; L219-Y238 PolarHBondContact O-N 3.17Å; Y238-P240 HydrophobicContact CE1-CB 4.03Å; Y238-P240 WeakPolarHBondContact O-CD 3.4Å; Y238-N243 PolarHBondContact OH-OD1 3.32Å; Y238-E244 WeakPolarHBondContact CA-O 3.48Å; Y238-W245 AromaticContact CD2-CD1 3.88Å; Y238-W245 HydrophobicContact CD2-CD2 4.05Å; Y238-W245 AromaticContact CD2-CE2 3.8Å; Y238-W245 HydrophobicContact CD2-CG 4.1Å; Y238-W245 HydrophobicContact CD2-CZ2 4.37Å; Y238-W245 AromaticContact CD2-NE1 3.66Å; Y238-W245 HydrophobicContact CG-CD2 4.32Å; Y238-W245 HydrophobicContact CG-CZ2 4.23Å; Y238-L464 HydrophobicContact CD1-CD1 4.19Å; Y238-L464 HydrophobicContact CE1-CD1 4.34Å
239	N	95.6	Very high	94.8	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.027	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	105.4	176.9	-172.9	-1.7	0	0	0	110.5	C128 Y218 C241 R242 N243 E244	C128-N239 PolarHBondContact O-ND2 2.96Å; Y218-N239 HydrophobicContact CD1-CB 3.85Å; Y218-N239 HydrophobicContact CE1-CB 3.56Å; N239-C241 PolarHBondContact O-N 2.94Å; N239-C241 WeakPolarHBondContact OD1-CB 3.37Å; N239-C241 PolarHBondContact OD1-N 3.16Å; N239-R242 PolarHBondContact O-N 3.43Å; N239-N243 WeakPolarHBondContact O-CA 3.31Å; N239-N243 PolarHBondContact O-N 2.87Å; N239-E244 PolarHBondContact N-O 3.37Å; N239-E244 PolarHBondContact O-N 2.88Å
240	P	94.7	Very high	95.4	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23	-178.5	26.5	-34.5	0	0	0	113.4	N217 Y238 R242 L466 P467	N217-P240 WeakPolarHBondContact ND2-CG 3.48Å; N217-P240 WeakPolarHBondContact O-CD 3.01Å; N217-P240 WeakPolarHBondContact O-CG 3.38Å; Y238-P240 HydrophobicContact CE1-CB 4.03Å; Y238-P240 WeakPolarHBondContact O-CD 3.4Å; P240-R242 VanDerWaalsContact C-N 3.28Å; P240-R242 PolarHBondContact O-N 3.47Å; P240-L466 HydrophobicContact CB-CD2 3.56Å; P240-P467 VanDerWaalsContact O-CD 3.27Å; P240-P467 WeakPolarHBondContact O-CD 3.4Å; P240-P467 WeakPolarHBondContact O-CG 3.29Å
241	C	92.8	Very high	95.7	Very high	37 Å²	37	34.7 Å²	34.7	25%	0.25	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-28.4	177.7	-59.1	0	0	0	0	113	C128 N239	C128-C241 HydrophobicContact CB-CB 4.17Å; N239-C241 PolarHBondContact O-N 2.94Å; N239-C241 WeakPolarHBondContact OD1-CB 3.37Å; N239-C241 PolarHBondContact OD1-N 3.16Å
242	R	91.2	Very high	95.8	Very high	96 Å²	96	35.5 Å²	35.5	36%	0.362	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-9.6	-178.1	-65.9	179.4	56	78.7	16.9	112.8	H129 N239 P240 E244	H129-R242 VanDerWaalsContact CE1-CD 3.48Å; H129-R242 WeakPolarHBondContact CE1-CD 3.38Å; H129-R242 VanDerWaalsContact CE1-CZ 3.49Å; H129-R242 PolarHBondContact CE1-NE 2.89Å; H129-R242 PolarHBondContact CE1-NH1 2.82Å; H129-R242 PolarHBondContact NE2-NH1 2.97Å; N239-R242 PolarHBondContact O-N 3.43Å; P240-R242 VanDerWaalsContact C-N 3.28Å; P240-R242 PolarHBondContact O-N 3.47Å; R242-E244 VanDerWaalsContact C-N 3.3Å; R242-E244 HydrophobicContact CB-CB 4.26Å; R242-E244 HydrophobicContact CB-CG 4.28Å; R242-E244 IonicContact CZ-OE1 2.79Å; R242-E244 IonicContact CZ-OE2 2.61Å; R242-E244 VanDerWaalsContact CZ-OE2 3.25Å; R242-E244 IonicContact NE-OE1 2.94Å; R242-E244 IonicContact NE-OE2 3.41Å; R242-E244 PolarHBondContact NE-OE2 2.81Å; R242-E244 VanDerWaalsContact NH2-CD 3.28Å; R242-E244 IonicContact NH2-OE1 2.98Å; R242-E244 PolarHBondContact NH2-OE1 2.85Å; R242-E244 IonicContact NH2-OE2 3.94Å; R242-E244 PolarHBondContact NH2-OE2 2.86Å; R242-E244 PolarHBondContact O-N 2.75Å
243	N	92.2	Very high	95.8	Very high	30 Å²	30	38.2 Å²	38.2	16%	0.16	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	47.1	-173.2	-175.9	33.7	0	0	0	111.9	A197 N198 Y238 N239	A197-N243 PolarHBondContact O-ND2 3.41Å; A197-N243 PolarHBondContact O-OD1 3.47Å; N198-N243 PolarHBondContact ND2-O 2.63Å; Y238-N243 PolarHBondContact OH-OD1 3.32Å; N239-N243 WeakPolarHBondContact O-CA 3.31Å; N239-N243 PolarHBondContact O-N 2.87Å
244	E	92.9	Very high	95.7	Very high	71 Å²	71	41.2 Å²	41.2	33%	0.332	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	141	-173.5	-77.1	168.9	-178	0	0	111.5	Y238 N239 R242	Y238-E244 WeakPolarHBondContact CA-O 3.48Å; N239-E244 PolarHBondContact N-O 3.37Å; N239-E244 PolarHBondContact O-N 2.88Å; R242-E244 VanDerWaalsContact C-N 3.3Å; R242-E244 HydrophobicContact CB-CB 4.26Å; R242-E244 HydrophobicContact CB-CG 4.28Å; R242-E244 IonicContact CZ-OE1 2.79Å; R242-E244 IonicContact CZ-OE2 2.61Å; R242-E244 VanDerWaalsContact CZ-OE2 3.25Å; R242-E244 IonicContact NE-OE1 2.94Å; R242-E244 IonicContact NE-OE2 3.41Å; R242-E244 PolarHBondContact NE-OE2 2.81Å; R242-E244 VanDerWaalsContact NH2-CD 3.28Å; R242-E244 IonicContact NH2-OE1 2.98Å; R242-E244 PolarHBondContact NH2-OE1 2.85Å; R242-E244 IonicContact NH2-OE2 3.94Å; R242-E244 PolarHBondContact NH2-OE2 2.86Å; R242-E244 PolarHBondContact O-N 2.75Å
245	W	95.4	Very high	95.6	Very high	35 Å²	35	40.6 Å²	40.6	13%	0.133	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	140.9	166.3	-72.3	97.7	0	0	0	110.7	M183 N199 L200 P201 L219 I221 H236 C237 Y238	M183-W245 HydrophobicContact CE-CZ2 3.94Å; M183-W245 HydrophobicContact SD-CZ2 3.92Å; M183-W245 PolarHBondContact SD-NE1 3.22Å; M183-W245 VanDerWaalsContact SD-NE1 3.43Å; N199-W245 PolarHBondContact O-NE1 2.82Å; L200-W245 HydrophobicContact CD2-CH2 4.48Å; L200-W245 HydrophobicContact CD2-CZ2 4.06Å; P201-W245 HydrophobicContact CG-CB 3.93Å; P201-W245 HydrophobicContact CG-CD2 3.81Å; P201-W245 HydrophobicContact CG-CE3 4Å; P201-W245 HydrophobicContact CG-CG 3.8Å; L219-W245 HydrophobicContact CD2-CH2 4.18Å; L219-W245 HydrophobicContact CG-CH2 4.36Å; I221-W245 HydrophobicContact CD1-CE3 4.38Å; I221-W245 HydrophobicContact CD1-CH2 3.69Å; I221-W245 HydrophobicContact CD1-CZ2 4.46Å; I221-W245 HydrophobicContact CD1-CZ3 3.65Å; I221-W245 HydrophobicContact CG1-CH2 4.09Å; I221-W245 HydrophobicContact CG1-CZ3 3.73Å; I221-W245 HydrophobicContact CG2-CH2 4.11Å; I221-W245 HydrophobicContact CG2-CZ3 4.42Å; H236-W245 HydrophobicContact CB-CE3 3.81Å; H236-W245 HydrophobicContact CB-CZ3 4.16Å; C237-W245 VanDerWaalsContact C-CE3 3.5Å; C237-W245 CarbonylContact O-C 3.59Å; C237-W245 WeakPolarHBondContact O-CA 3.25Å; Y238-W245 AromaticContact CD2-CD1 3.88Å; Y238-W245 HydrophobicContact CD2-CD2 4.05Å; Y238-W245 AromaticContact CD2-CE2 3.8Å; Y238-W245 HydrophobicContact CD2-CG 4.1Å; Y238-W245 HydrophobicContact CD2-CZ2 4.37Å; Y238-W245 AromaticContact CD2-NE1 3.66Å; Y238-W245 HydrophobicContact CG-CD2 4.32Å; Y238-W245 HydrophobicContact CG-CZ2 4.23Å
246	N	94.8	Very high	95.4	Very high	78 Å²	78	40.7 Å²	40.7	42%	0.417	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.3	173.3	-64.7	-85.5	0	0	0	109.5	H236 C237	H236-N246 CarbonylContact C-O 3.53Å; H236-N246 WeakPolarHBondContact CA-O 3.39Å; C237-N246 PolarHBondContact N-O 2.83Å; C237-N246 PolarHBondContact O-N 3.2Å
247	Q	96.4	Very high	95.2	Very high	132 Å²	132	43.8 Å²	43.8	62%	0.617	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	135	170.7	-168.6	174.2	7.9	0	0	109.4
248	V	97.4	Very high	95.2	Very high	11 Å²	11	43.9 Å²	43.9	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	179	173.8	-61.3	0	0	0	0	109.5	F220 V235 C237	F220-V248 HydrophobicContact CD1-CG2 4.49Å; F220-V248 HydrophobicContact CE1-CG2 4.24Å; V235-V248 HydrophobicContact CB-CG2 3.72Å; V235-V248 HydrophobicContact CG1-CG2 3.38Å; V235-V248 PolarHBondContact O-N 2.8Å; C237-V248 HydrophobicContact CB-CG1 4.44Å
249	A	97.8	Very high	95.2	Very high	14 Å²	14	45.6 Å²	45.6	12%	0.116	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-52.7	131.4	-179.1	0	0	0	0	0	112.3	Y281 D286 W288	A249-Y281 HydrophobicContact CB-CE2 4.42Å; A249-D286 WeakPolarHBondContact CB-O 3.48Å; A249-D286 WeakPolarHBondContact CB-OD1 3.48Å; A249-D286 PolarHBondContact N-OD1 2.76Å; A249-W288 PolarHBondContact O-NE1 3.38Å
250	P	98.1	Very high	95.3	Very high	68 Å²	68	45.9 Å²	45.9	44%	0.442	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-69.4	156	178.2	30.9	-35.2	0	0	0	110.5	S233	S233-P250 CarbonylContact O-C 3.6Å; S233-P250 VanDerWaalsContact O-CA 3.23Å; S233-P250 WeakPolarHBondContact O-CA 3.37Å; S233-P250 VanDerWaalsContact O-CB 3.29Å; S233-P250 WeakPolarHBondContact O-CB 3.46Å
251	L	97.8	Very high	95.4	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.031	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-56.7	143.3	171.1	-63.7	160.6	0	0	0	110.3	A222 S233 V235 Q253 R255 F258 A269 W288	A222-L251 HydrophobicContact CB-CD1 4.43Å; S233-L251 WeakPolarHBondContact CB-O 3.13Å; S233-L251 PolarHBondContact O-N 2.72Å; V235-L251 HydrophobicContact CG2-CG 3.93Å; L251-Q253 VanDerWaalsContact C-N 3.26Å; L251-Q253 WeakPolarHBondContact CB-O 3.47Å; L251-Q253 PolarHBondContact O-N 3.28Å; L251-R255 HydrophobicContact CD1-CB 4.23Å; L251-R255 HydrophobicContact CD1-CG 4.44Å; L251-F258 HydrophobicContact CD1-CZ 4.2Å; L251-A269 HydrophobicContact CD2-CB 3.8Å; L251-W288 HydrophobicContact CD2-CD2 3.83Å; L251-W288 HydrophobicContact CD2-CE3 3.89Å; L251-W288 HydrophobicContact CD2-CH2 3.76Å; L251-W288 HydrophobicContact CD2-CZ2 3.68Å; L251-W288 HydrophobicContact CD2-CZ3 3.87Å; L251-W288 HydrophobicContact CG-CZ2 4.48Å
252	N	96.5	Very high	95.7	Very high	83 Å²	83	46.5 Å²	46.5	44%	0.444	23%	0.234	S	C	.	.	S	Bend	trans	-65.6	-37	173.7	-60	-68.7	0	0	0	110.6	E279 W288	N252-E279 WeakPolarHBondContact CA-OE2 3.32Å; N252-E279 WeakPolarHBondContact CB-OE2 3.39Å; N252-E279 PolarHBondContact N-OE2 2.84Å; N252-E279 PolarHBondContact ND2-OE2 2.84Å; N252-W288 VanDerWaalsContact ND2-CB 3.28Å; N252-W288 WeakPolarHBondContact ND2-CB 3.45Å; N252-W288 PolarHBondContact ND2-O 2.86Å
253	Q	94.3	Very high	96	Very high	71 Å²	71	42 Å²	42	33%	0.332	22%	0.217	S	C	.	.	S	Bend	trans	-113.1	133.9	175.4	-169	169.7	16.1	0	0	110.5	L251 R255 L275 T277 E279	L251-Q253 VanDerWaalsContact C-N 3.26Å; L251-Q253 WeakPolarHBondContact CB-O 3.47Å; L251-Q253 PolarHBondContact O-N 3.28Å; Q253-R255 WeakPolarHBondContact O-CG 3.38Å; Q253-R255 PolarHBondContact O-N 3.27Å; Q253-L275 HydrophobicContact CG-CD1 4.06Å; Q253-T277 PolarHBondContact OE1-OG1 2.77Å; Q253-E279 WeakPolarHBondContact CB-OE1 3.32Å; Q253-E279 PolarHBondContact N-OE1 2.76Å
254	K	95.5	Very high	96.1	Very high	94 Å²	94	46.2 Å²	46.2	41%	0.409	24%	0.236	S	C	.	.			trans	-63.2	134.3	170.5	-65.1	172.2	168.2	-162.5	0	109.3	E231	E231-K254 HydrophobicContact CB-CB 3.89Å; E231-K254 HydrophobicContact CB-CD 4.44Å; E231-K254 VanDerWaalsContact O-CD 3.32Å; E231-K254 WeakPolarHBondContact O-CD 3.17Å; E231-K254 PolarHBondContact O-NZ 2.92Å
255	R	94.9	Very high	96.2	Very high	1 Å²	1	44 Å²	44	0%	0.004	23%	0.232	C	C	.	.			trans	-138.4	136.5	-174	-66.8	169.2	-175.2	-89.1	-6	110	G224 L251 Q253 F258 A269 G271 L275 T277 E279	G224-R255 PolarHBondContact N-O 2.84Å; L251-R255 HydrophobicContact CD1-CB 4.23Å; L251-R255 HydrophobicContact CD1-CG 4.44Å; Q253-R255 WeakPolarHBondContact O-CG 3.38Å; Q253-R255 PolarHBondContact O-N 3.27Å; R255-F258 HydrophobicContact CB-CB 4.36Å; R255-F258 HydrophobicContact CB-CD1 3.45Å; R255-F258 VanDerWaalsContact CB-CD1 3.45Å; R255-F258 HydrophobicContact CB-CE1 3.73Å; R255-F258 HydrophobicContact CB-CG 3.91Å; R255-F258 HydrophobicContact CB-CZ 4.4Å; R255-A269 PolarHBondContact NH1-O 2.59Å; R255-G271 PolarHBondContact NH1-O 2.99Å; R255-L275 HydrophobicContact CG-CD1 3.98Å; R255-T277 PolarHBondContact NH1-O 2.79Å; R255-T277 PolarHBondContact NH2-OG1 2.99Å; R255-E279 IonicContact CZ-OE1 2.84Å; R255-E279 IonicContact NE-OE1 3.82Å; R255-E279 PolarHBondContact NE-OE1 3.1Å; R255-E279 IonicContact NH2-OE1 3.88Å; R255-E279 PolarHBondContact NH2-OE1 2.93Å
256	S	94.6	Very high	96.3	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.014	24%	0.244	C	C	.	.	S	Bend	trans	-128.4	152.9	167.8	62.4	0	0	0	0	110.6	E231 F258 G272 Q273	E231-S256 WeakPolarHBondContact OE1-CB 3.25Å; E231-S256 PolarHBondContact OE1-OG 2.86Å; S256-F258 PolarHBondContact O-N 3.15Å; S256-F258 VanDerWaalsContact O-N 3.11Å; S256-G272 CarbonylContact O-C 3.58Å; S256-G272 VanDerWaalsContact O-CA 3.22Å; S256-G272 WeakPolarHBondContact O-CA 3.34Å; S256-Q273 PolarHBondContact O-N 2.89Å
257	N	93.1	Very high	96.5	Very high	77 Å²	77	42.9 Å²	42.9	41%	0.412	22%	0.224	S	C	.	.	S	Bend	trans	54.4	31.3	177.4	-60.7	-52.4	0	0	0	114.1	G209 Q273	G209-N257 PolarHBondContact O-N 2.98Å; N257-Q273 PolarHBondContact ND2-OE1 2.89Å
258	F	95.9	Very high	96.6	Very high	10 Å²	10	37.1 Å²	37.1	4%	0.044	20%	0.197	C	C	.	.			trans	-95.2	178.4	179.5	71.6	-81	0	0	0	111.3	A222 L251 R255 S256 L260 A269 V270 G271	A222-F258 HydrophobicContact CB-CZ 3.85Å; A222-F258 WeakPolarHBondContact O-CE1 3.44Å; A222-F258 WeakPolarHBondContact O-CZ 3.38Å; L251-F258 HydrophobicContact CD1-CZ 4.2Å; R255-F258 HydrophobicContact CB-CB 4.36Å; R255-F258 HydrophobicContact CB-CD1 3.45Å; R255-F258 VanDerWaalsContact CB-CD1 3.45Å; R255-F258 HydrophobicContact CB-CE1 3.73Å; R255-F258 HydrophobicContact CB-CG 3.91Å; R255-F258 HydrophobicContact CB-CZ 4.4Å; S256-F258 PolarHBondContact O-N 3.15Å; S256-F258 VanDerWaalsContact O-N 3.11Å; F258-L260 HydrophobicContact CE2-CB 4.01Å; F258-L260 HydrophobicContact CE2-CD1 4.2Å; F258-A269 HydrophobicContact CD2-CB 3.96Å; F258-A269 HydrophobicContact CE2-CB 3.71Å; F258-V270 WeakPolarHBondContact CB-O 3.41Å; F258-G271 VanDerWaalsContact CB-O 3.25Å; F258-G271 WeakPolarHBondContact CB-O 3.43Å
259	K	96.4	Very high	96.6	Very high	36 Å²	36	36.6 Å²	36.6	16%	0.157	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.3	174.9	-58.5	-62.1	177.9	179.5	0	110.1	V270 F301 A303	K259-V270 PolarHBondContact N-O 3.47Å; K259-V270 VanDerWaalsContact N-O 3.09Å; K259-V270 PolarHBondContact O-N 3.21Å; K259-F301 HydrophobicContact CB-CE2 4.16Å; K259-F301 WeakPolarHBondContact CE-O 3.27Å; K259-F301 HydrophobicContact CG-CD2 4.08Å; K259-F301 HydrophobicContact CG-CE2 3.47Å; K259-F301 VanDerWaalsContact CG-CE2 3.47Å; K259-F301 HydrophobicContact CG-CZ 3.98Å; K259-A303 HydrophobicContact CB-CB 3.88Å; K259-A303 HydrophobicContact CG-CB 3.76Å
260	L	97.9	Very high	96.7	Very high	10 Å²	10	36 Å²	36	5%	0.052	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	123.8	172.9	-171.5	68.6	0	0	0	108.1	A213 F220 A222 F258 L267 Y268 A269 W288	A213-L260 HydrophobicContact CB-CB 4.31Å; A213-L260 HydrophobicContact CB-CD2 3.9Å; A213-L260 HydrophobicContact CB-CG 3.77Å; F220-L260 HydrophobicContact CB-CD2 4.09Å; A222-L260 HydrophobicContact CB-CD2 3.99Å; F258-L260 HydrophobicContact CE2-CB 4.01Å; F258-L260 HydrophobicContact CE2-CD1 4.2Å; L260-L267 HydrophobicContact CD1-CB 4.23Å; L260-Y268 WeakPolarHBondContact CA-O 3.5Å; L260-A269 HydrophobicContact CD1-CB 4.25Å; L260-W288 HydrophobicContact CD1-CH2 3.87Å
261	L	98.1	Very high	96.5	Very high	20 Å²	20	32.7 Å²	32.7	11%	0.105	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	135.9	-173.7	-59.8	174.7	0	0	0	110.5	V263 L267 Y268 V270 A303 I310	L261-V263 HydrophobicContact CB-CG2 4.13Å; L261-L267 CarbonylContact O-C 3.56Å; L261-L267 VanDerWaalsContact O-CA 3.3Å; L261-L267 WeakPolarHBondContact O-CA 3.26Å; L261-Y268 PolarHBondContact N-O 3.41Å; L261-Y268 PolarHBondContact O-N 2.76Å; L261-V270 HydrophobicContact CD1-CG2 4.41Å; L261-A303 HydrophobicContact CD1-CB 3.97Å; L261-I310 HydrophobicContact CD1-CB 4.39Å; L261-I310 HydrophobicContact CD1-CD1 4.31Å; L261-I310 HydrophobicContact CD1-CG1 4.08Å; L261-I310 HydrophobicContact CD1-CG2 3.6Å
262	A	97.8	Very high	96	Very high	31 Å²	31	32.5 Å²	32.5	26%	0.256	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	119.7	169.9	0	0	0	0	0	109.3	V214 L215 K266 L267	V214-A262 WeakPolarHBondContact O-CB 3.37Å; L215-A262 HydrophobicContact CB-CB 4.07Å; L215-A262 HydrophobicContact CD1-CB 4.21Å; A262-K266 CarbonylContact C-O 3.58Å; A262-K266 WeakPolarHBondContact CA-O 3.13Å; A262-L267 HydrophobicContact CB-CD2 3.9Å
263	V	97.6	Very high	95.3	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	123.8	-177.3	-168.9	0	0	0	0	109.3	L261 G265 K266 Y268 E305 G308 I310 P330	L261-V263 HydrophobicContact CB-CG2 4.13Å; V263-G265 VanDerWaalsContact C-N 3.27Å; V263-G265 PolarHBondContact O-N 3.32Å; V263-G265 VanDerWaalsContact O-N 3.15Å; V263-K266 PolarHBondContact N-O 2.76Å; V263-K266 PolarHBondContact O-N 2.87Å; V263-Y268 HydrophobicContact CB-CD2 3.84Å; V263-Y268 HydrophobicContact CB-CE2 3.79Å; V263-Y268 HydrophobicContact CG2-CD2 3.88Å; V263-Y268 HydrophobicContact CG2-CE2 4.34Å; V263-E305 HydrophobicContact CB-CG 4.07Å; V263-E305 HydrophobicContact CG1-CG 3.81Å; V263-E305 HydrophobicContact CG2-CB 3.86Å; V263-E305 HydrophobicContact CG2-CG 3.64Å; V263-G308 VanDerWaalsContact CG1-O 3.31Å; V263-G308 WeakPolarHBondContact CG1-O 3.49Å; V263-I310 HydrophobicContact CG2-CD1 3.88Å; V263-I310 HydrophobicContact CG2-CG1 3.63Å; V263-P330 HydrophobicContact CG1-CG 3.95Å
264	Q	94.8	Very high	94.3	Very high	120 Å²	120	35.5 Å²	35.5	56%	0.561	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.1	44.3	175	-63.7	179.5	-17	0	0	113.9	K266	Q264-K266 VanDerWaalsContact C-N 3.35Å; Q264-K266 PolarHBondContact O-N 2.79Å
265	G	95.2	Very high	93.9	Very high	24 Å²	24	32.3 Å²	32.3	25%	0.247	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	82	4.7	177.8	0	0	0	0	0	115.7	V263	V263-G265 VanDerWaalsContact C-N 3.27Å; V263-G265 PolarHBondContact O-N 3.32Å; V263-G265 VanDerWaalsContact O-N 3.15Å
266	K	98	Very high	93.8	Very high	90 Å²	90	32.8 Å²	32.8	39%	0.391	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	163.7	179.2	-61.9	-173.1	-174.9	-178.9	0	111.1	A262 V263 Q264 Y268 C280 Y281	A262-K266 CarbonylContact C-O 3.58Å; A262-K266 WeakPolarHBondContact CA-O 3.13Å; V263-K266 PolarHBondContact N-O 2.76Å; V263-K266 PolarHBondContact O-N 2.87Å; Q264-K266 VanDerWaalsContact C-N 3.35Å; Q264-K266 PolarHBondContact O-N 2.79Å; K266-Y268 HydrophobicContact CB-CE2 3.95Å; K266-C280 VanDerWaalsContact CD-SG 3.52Å; K266-Y281 WeakPolarHBondContact CB-O 3.22Å
267	L	98.6	Very high	93.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	140.8	171.3	-61.8	170.5	0	0	0	110.7	A213 L215 F220 L260 L261 A262 C280 Y281 W288	A213-L267 HydrophobicContact CB-CD2 3.78Å; L215-L267 HydrophobicContact CB-CD2 3.83Å; L215-L267 HydrophobicContact CB-CG 4.39Å; L215-L267 HydrophobicContact CD2-CD2 4.12Å; L215-L267 HydrophobicContact CD2-CG 3.84Å; F220-L267 HydrophobicContact CB-CD1 3.94Å; F220-L267 HydrophobicContact CD1-CD1 3.43Å; F220-L267 VanDerWaalsContact CD1-CD1 3.43Å; F220-L267 HydrophobicContact CD2-CD1 3.7Å; F220-L267 HydrophobicContact CE1-CD1 3.74Å; F220-L267 HydrophobicContact CE2-CD1 3.99Å; F220-L267 HydrophobicContact CG-CD1 3.4Å; F220-L267 VanDerWaalsContact CG-CD1 3.4Å; F220-L267 HydrophobicContact CZ-CD1 4.02Å; L260-L267 HydrophobicContact CD1-CB 4.23Å; L261-L267 CarbonylContact O-C 3.56Å; L261-L267 VanDerWaalsContact O-CA 3.3Å; L261-L267 WeakPolarHBondContact O-CA 3.26Å; A262-L267 HydrophobicContact CB-CD2 3.9Å; L267-C280 CarbonylContact O-C 3.53Å; L267-C280 VanDerWaalsContact O-CA 3.27Å; L267-C280 WeakPolarHBondContact O-CA 3.05Å; L267-Y281 HydrophobicContact CB-CD1 4.41Å; L267-Y281 HydrophobicContact CD1-CD1 3.94Å; L267-Y281 HydrophobicContact CG-CD1 4.34Å; L267-Y281 PolarHBondContact N-O 3.01Å; L267-Y281 VanDerWaalsContact N-O 3.13Å; L267-Y281 PolarHBondContact O-N 2.8Å; L267-W288 HydrophobicContact CB-CH2 4.27Å
268	Y	98.6	Very high	94.2	Very high	11 Å²	11	31.1 Å²	31.1	4%	0.043	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.9	176.1	-69.2	-97.8	0	0	0	109.8	L260 L261 V263 K266 V278 E279 C280 V291 I310 Y328 P330	L260-Y268 WeakPolarHBondContact CA-O 3.5Å; L261-Y268 PolarHBondContact N-O 3.41Å; L261-Y268 PolarHBondContact O-N 2.76Å; V263-Y268 HydrophobicContact CB-CD2 3.84Å; V263-Y268 HydrophobicContact CB-CE2 3.79Å; V263-Y268 HydrophobicContact CG2-CD2 3.88Å; V263-Y268 HydrophobicContact CG2-CE2 4.34Å; K266-Y268 HydrophobicContact CB-CE2 3.95Å; Y268-V278 HydrophobicContact CD1-CG1 4.36Å; Y268-E279 CarbonylContact C-O 3.51Å; Y268-E279 VanDerWaalsContact CA-O 3.31Å; Y268-E279 WeakPolarHBondContact CA-O 3.28Å; Y268-C280 HydrophobicContact CD1-CB 3.96Å; Y268-C280 HydrophobicContact CE1-CB 3.68Å; Y268-C280 VanDerWaalsContact CZ-SG 3.58Å; Y268-V291 HydrophobicContact CD1-CG2 4.46Å; Y268-V291 HydrophobicContact CE1-CG2 4.47Å; Y268-I310 HydrophobicContact CD1-CD1 3.94Å; Y268-I310 HydrophobicContact CD2-CD1 3.99Å; Y268-I310 HydrophobicContact CG-CD1 3.55Å; Y268-Y328 HydrophobicContact CD1-CE1 4.16Å; Y268-Y328 AromaticContact CE1-CE1 3.74Å; Y268-Y328 HydrophobicContact CE1-CE1 3.74Å; Y268-P330 WeakPolarHBondContact OH-CB 3.23Å
269	A	98.3	Very high	94.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	100.5	170.1	0	0	0	0	0	108.5	L251 R255 F258 L260 V278 E279 W288	L251-A269 HydrophobicContact CD2-CB 3.8Å; R255-A269 PolarHBondContact NH1-O 2.59Å; F258-A269 HydrophobicContact CD2-CB 3.96Å; F258-A269 HydrophobicContact CE2-CB 3.71Å; L260-A269 HydrophobicContact CD1-CB 4.25Å; A269-V278 WeakPolarHBondContact O-CA 3.5Å; A269-E279 HydrophobicContact CB-CB 4.46Å; A269-E279 PolarHBondContact N-O 3.06Å; A269-E279 PolarHBondContact O-N 3.25Å; A269-W288 HydrophobicContact CB-CH2 4.18Å; A269-W288 HydrophobicContact CB-CZ3 3.73Å
270	V	97.9	Very high	94.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	119.8	-174.2	-176.3	0	0	0	0	109.6	F258 K259 L261 V278 M294 F301 I310 V312 W335	F258-V270 WeakPolarHBondContact CB-O 3.41Å; K259-V270 PolarHBondContact N-O 3.47Å; K259-V270 VanDerWaalsContact N-O 3.09Å; K259-V270 PolarHBondContact O-N 3.21Å; L261-V270 HydrophobicContact CD1-CG2 4.41Å; V270-V278 HydrophobicContact CG1-CG2 4.26Å; V270-V278 HydrophobicContact CG2-CG1 4.02Å; V270-M294 HydrophobicContact CG1-CE 4.45Å; V270-M294 HydrophobicContact CG1-CG 4.43Å; V270-M294 HydrophobicContact CG1-SD 3.8Å; V270-F301 HydrophobicContact CG1-CE2 4.23Å; V270-F301 HydrophobicContact CG1-CZ 4.34Å; V270-F301 WeakPolarHBondContact O-CZ 3.35Å; V270-I310 HydrophobicContact CG2-CD1 4.29Å; V270-I310 HydrophobicContact CG2-CG2 4.36Å; V270-V312 HydrophobicContact CG1-CG2 4.04Å; V270-W335 HydrophobicContact CG1-CH2 4.23Å; V270-W335 HydrophobicContact CG1-CZ2 4.43Å
271	G	94.9	Very high	94.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.			trans	63.4	-143.6	172.5	0	0	0	0	0	114.4	R255 F258 L275 T277	R255-G271 PolarHBondContact NH1-O 2.99Å; F258-G271 VanDerWaalsContact CB-O 3.25Å; F258-G271 WeakPolarHBondContact CB-O 3.43Å; G271-L275 VanDerWaalsContact CA-O 3.24Å; G271-L275 WeakPolarHBondContact CA-O 3.3Å; G271-T277 PolarHBondContact N-O 2.95Å; G271-T277 VanDerWaalsContact N-O 3.1Å
272	G	88.3	Confident	94.4	Very high	2 Å²	2	28.2 Å²	28.2	2%	0.021	16%	0.162	C	C	.	.			trans	137.3	-174.8	-173.9	0	0	0	0	0	110.5	S256 C274 L275	S256-G272 CarbonylContact O-C 3.58Å; S256-G272 VanDerWaalsContact O-CA 3.22Å; S256-G272 WeakPolarHBondContact O-CA 3.34Å; G272-C274 PolarHBondContact O-N 2.8Å; G272-L275 PolarHBondContact O-N 2.91Å; G272-L275 VanDerWaalsContact O-N 3.15Å
273	Q	80.5	Confident	94.3	Very high	112 Å²	112	27 Å²	27	52%	0.523	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	105.7	179.4	-168.8	157.6	-16.2	0	0	110.9	S256 N257 L275	S256-Q273 PolarHBondContact O-N 2.89Å; N257-Q273 PolarHBondContact ND2-OE1 2.89Å; Q273-L275 VanDerWaalsContact C-N 3.31Å; Q273-L275 PolarHBondContact O-N 3.15Å
274	C	72.9	Confident	94.2	Very high	104 Å²	104	31.6 Å²	31.6	70%	0.703	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	23.1	-177.5	-55.8	0	0	0	0	115.9	G272	G272-C274 PolarHBondContact O-N 2.8Å
275	L	88.6	Confident	94.2	Very high	28 Å²	28	31.6 Å²	31.6	15%	0.147	17%	0.172	C	C	.	.			trans	-111.5	131	178.4	-61.2	-179.9	0	0	0	111.8	Q253 R255 G271 G272 Q273	Q253-L275 HydrophobicContact CG-CD1 4.06Å; R255-L275 HydrophobicContact CG-CD1 3.98Å; G271-L275 VanDerWaalsContact CA-O 3.24Å; G271-L275 WeakPolarHBondContact CA-O 3.3Å; G272-L275 PolarHBondContact O-N 2.91Å; G272-L275 VanDerWaalsContact O-N 3.15Å; Q273-L275 VanDerWaalsContact C-N 3.31Å; Q273-L275 PolarHBondContact O-N 3.15Å
276	G	92.7	Very high	94.3	Very high	10 Å²	10	32.2 Å²	32.2	10%	0.103	17%	0.17	C	C	.	.			trans	-93.9	-12	166.9	0	0	0	0	0	113.2	S293 M294	G276-S293 CarbonylContact O-C 3.53Å; G276-S293 WeakPolarHBondContact O-CA 3.35Å; G276-S293 WeakPolarHBondContact O-CB 3.31Å; G276-M294 PolarHBondContact O-N 3.49Å
277	T	97	Very high	94.3	Very high	44 Å²	44	35.4 Å²	35.4	27%	0.27	18%	0.18	S	C	.	.			trans	-69	151.3	-174.3	59.3	0	0	0	0	111.7	Q253 R255 G271	Q253-T277 PolarHBondContact OE1-OG1 2.77Å; R255-T277 PolarHBondContact NH1-O 2.79Å; R255-T277 PolarHBondContact NH2-OG1 2.99Å; G271-T277 PolarHBondContact N-O 2.95Å; G271-T277 VanDerWaalsContact N-O 3.1Å
278	V	98.1	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134.3	179.1	-174	0	0	0	0	108.4	Y268 A269 V270 V291 M294 W335	Y268-V278 HydrophobicContact CD1-CG1 4.36Å; A269-V278 WeakPolarHBondContact O-CA 3.5Å; V270-V278 HydrophobicContact CG1-CG2 4.26Å; V270-V278 HydrophobicContact CG2-CG1 4.02Å; V278-V291 HydrophobicContact CB-CG2 3.72Å; V278-V291 HydrophobicContact CG1-CG2 3.53Å; V278-V291 PolarHBondContact O-N 3.23Å; V278-M294 HydrophobicContact CG2-CG 4.31Å; V278-W335 HydrophobicContact CG2-CZ2 3.91Å
279	E	98.1	Very high	94.2	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.8	176.3	-69.9	172.9	-109.3	0	0	110.3	N252 Q253 R255 Y268 A269 W288 T289	N252-E279 WeakPolarHBondContact CA-OE2 3.32Å; N252-E279 WeakPolarHBondContact CB-OE2 3.39Å; N252-E279 PolarHBondContact N-OE2 2.84Å; N252-E279 PolarHBondContact ND2-OE2 2.84Å; Q253-E279 WeakPolarHBondContact CB-OE1 3.32Å; Q253-E279 PolarHBondContact N-OE1 2.76Å; R255-E279 IonicContact CZ-OE1 2.84Å; R255-E279 IonicContact NE-OE1 3.82Å; R255-E279 PolarHBondContact NE-OE1 3.1Å; R255-E279 IonicContact NH2-OE1 3.88Å; R255-E279 PolarHBondContact NH2-OE1 2.93Å; Y268-E279 CarbonylContact C-O 3.51Å; Y268-E279 VanDerWaalsContact CA-O 3.31Å; Y268-E279 WeakPolarHBondContact CA-O 3.28Å; A269-E279 HydrophobicContact CB-CB 4.46Å; A269-E279 PolarHBondContact N-O 3.06Å; A269-E279 PolarHBondContact O-N 3.25Å; E279-W288 HydrophobicContact CB-CE3 3.69Å; E279-W288 HydrophobicContact CB-CZ3 4.35Å; E279-T289 CarbonylContact C-O 3.59Å; E279-T289 WeakPolarHBondContact CA-O 3.37Å
280	C	98.4	Very high	94.2	Very high	10 Å²	10	43.4 Å²	43.4	7%	0.068	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	121.7	178.7	176.3	0	0	0	0	110	K266 L267 Y268 W288 T289 V291	K266-C280 VanDerWaalsContact CD-SG 3.52Å; L267-C280 CarbonylContact O-C 3.53Å; L267-C280 VanDerWaalsContact O-CA 3.27Å; L267-C280 WeakPolarHBondContact O-CA 3.05Å; Y268-C280 HydrophobicContact CD1-CB 3.96Å; Y268-C280 HydrophobicContact CE1-CB 3.68Å; Y268-C280 VanDerWaalsContact CZ-SG 3.58Å; C280-W288 CarbonylContact O-C 3.56Å; C280-W288 WeakPolarHBondContact O-CA 3.35Å; C280-T289 PolarHBondContact N-O 3.35Å; C280-T289 PolarHBondContact O-N 2.83Å; C280-V291 HydrophobicContact CB-CG1 3.7Å
281	Y	98.6	Very high	94.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.9	174.1	173.2	-102.7	0	0	0	111.4	R135 F220 A249 K266 L267 P283 D286 W287 W288	R135-Y281 PolarHBondContact NH2-OH 2.9Å; F220-Y281 AromaticContact CE1-CE1 3.98Å; F220-Y281 HydrophobicContact CE1-CE1 3.98Å; F220-Y281 HydrophobicContact CZ-CE1 4.28Å; A249-Y281 HydrophobicContact CB-CE2 4.42Å; K266-Y281 WeakPolarHBondContact CB-O 3.22Å; L267-Y281 HydrophobicContact CB-CD1 4.41Å; L267-Y281 HydrophobicContact CD1-CD1 3.94Å; L267-Y281 HydrophobicContact CG-CD1 4.34Å; L267-Y281 PolarHBondContact N-O 3.01Å; L267-Y281 VanDerWaalsContact N-O 3.13Å; L267-Y281 PolarHBondContact O-N 2.8Å; Y281-P283 HydrophobicContact CD1-CG 4.34Å; Y281-P283 HydrophobicContact CE1-CB 4.27Å; Y281-P283 HydrophobicContact CE1-CG 3.99Å; Y281-D286 WeakPolarHBondContact CE2-OD1 3.31Å; Y281-D286 PolarHBondContact OH-OD1 2.82Å; Y281-D286 VanDerWaalsContact OH-OD1 3.07Å; Y281-W287 WeakPolarHBondContact CA-O 3.45Å; Y281-W288 AromaticContact CD2-CD1 3.97Å; Y281-W288 HydrophobicContact CD2-CD2 4.24Å; Y281-W288 AromaticContact CD2-CE2 3.86Å; Y281-W288 HydrophobicContact CD2-CG 4.31Å; Y281-W288 HydrophobicContact CD2-CZ2 4.33Å; Y281-W288 AromaticContact CD2-NE1 3.68Å; Y281-W288 HydrophobicContact CG-CD2 4.33Å; Y281-W288 AromaticContact CG-CE2 3.99Å; Y281-W288 HydrophobicContact CG-CH2 4.47Å; Y281-W288 HydrophobicContact CG-CZ2 4.08Å
282	G	97.4	Very high	94.4	Very high	5 Å²	5	46.6 Å²	46.6	5%	0.052	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	116.8	171	0	0	0	0	0	111.2	E284 Q285 D286 W287	G282-E284 PolarHBondContact O-N 2.85Å; G282-Q285 PolarHBondContact O-N 2.78Å; G282-D286 PolarHBondContact O-N 2.67Å; G282-W287 PolarHBondContact N-O 3.43Å
283	P	96.5	Very high	94.8	Very high	4 Å²	4	49.4 Å²	49.4	3%	0.026	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.4	176.4	-23.8	32.8	0	0	0	114.2	L134 R135 L215 Y281	L134-P283 HydrophobicContact CD1-CB 3.88Å; R135-P283 WeakPolarHBondContact CG-O 3.46Å; R135-P283 PolarHBondContact NE-O 3.12Å; L215-P283 HydrophobicContact CD2-CG 3.72Å; Y281-P283 HydrophobicContact CD1-CG 4.34Å; Y281-P283 HydrophobicContact CE1-CB 4.27Å; Y281-P283 HydrophobicContact CE1-CG 3.99Å
284	E	94.9	Very high	95.5	Very high	98 Å²	98	44.5 Å²	44.5	46%	0.458	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-35.2	178	-67.8	175.2	179.1	0	0	113.3	L134 R135 G282	L134-E284 HydrophobicContact CB-CG 4.08Å; L134-E284 HydrophobicContact CD2-CG 4.47Å; R135-E284 WeakPolarHBondContact CA-O 3.44Å; R135-E284 WeakPolarHBondContact CG-O 3.3Å; G282-E284 PolarHBondContact O-N 2.85Å
285	Q	94.9	Very high	96.5	Very high	120 Å²	120	43.5 Å²	43.5	56%	0.561	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-12.1	-179.1	-61.3	79.9	37.8	0	0	112.7	G282 W287	G282-Q285 PolarHBondContact O-N 2.78Å; Q285-W287 VanDerWaalsContact C-N 3.3Å; Q285-W287 HydrophobicContact CB-CB 4.37Å; Q285-W287 PolarHBondContact O-N 3.44Å
286	D	97.1	Very high	96.6	Very high	37 Å²	37	46.6 Å²	46.6	20%	0.198	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	51.7	-169.8	-162.2	11.9	0	0	0	111.4	R135 A249 Y281 G282	R135-D286 VanDerWaalsContact CZ-CB 3.42Å; R135-D286 IonicContact CZ-OD2 3.47Å; R135-D286 IonicContact NH1-OD2 2.74Å; R135-D286 PolarHBondContact NH1-OD2 3.3Å; R135-D286 IonicContact NH2-OD1 3.21Å; R135-D286 PolarHBondContact NH2-OD1 3.01Å; R135-D286 IonicContact NH2-OD2 3.68Å; R135-D286 PolarHBondContact NH2-OD2 3.23Å; A249-D286 WeakPolarHBondContact CB-O 3.48Å; A249-D286 WeakPolarHBondContact CB-OD1 3.48Å; A249-D286 PolarHBondContact N-OD1 2.76Å; Y281-D286 WeakPolarHBondContact CE2-OD1 3.31Å; Y281-D286 PolarHBondContact OH-OD1 2.82Å; Y281-D286 VanDerWaalsContact OH-OD1 3.07Å; G282-D286 PolarHBondContact O-N 2.67Å
287	W	97.6	Very high	96.7	Very high	158 Å²	158	48.9 Å²	48.9	60%	0.598	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.6	148.4	-176.5	-169.1	-91.2	0	0	0	112.1	Y281 G282 Q285	Y281-W287 WeakPolarHBondContact CA-O 3.45Å; G282-W287 PolarHBondContact N-O 3.43Å; Q285-W287 VanDerWaalsContact C-N 3.3Å; Q285-W287 HydrophobicContact CB-CB 4.37Å; Q285-W287 PolarHBondContact O-N 3.44Å
288	W	98.4	Very high	96.5	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.7	176.2	-69.4	89.6	0	0	0	110.8	V235 A249 L251 N252 L260 L267 A269 E279 C280 Y281	V235-W288 HydrophobicContact CG1-CZ2 4.34Å; V235-W288 HydrophobicContact CG2-CZ2 4.09Å; A249-W288 PolarHBondContact O-NE1 3.38Å; L251-W288 HydrophobicContact CD2-CD2 3.83Å; L251-W288 HydrophobicContact CD2-CE3 3.89Å; L251-W288 HydrophobicContact CD2-CH2 3.76Å; L251-W288 HydrophobicContact CD2-CZ2 3.68Å; L251-W288 HydrophobicContact CD2-CZ3 3.87Å; L251-W288 HydrophobicContact CG-CZ2 4.48Å; N252-W288 VanDerWaalsContact ND2-CB 3.28Å; N252-W288 WeakPolarHBondContact ND2-CB 3.45Å; N252-W288 PolarHBondContact ND2-O 2.86Å; L260-W288 HydrophobicContact CD1-CH2 3.87Å; L267-W288 HydrophobicContact CB-CH2 4.27Å; A269-W288 HydrophobicContact CB-CH2 4.18Å; A269-W288 HydrophobicContact CB-CZ3 3.73Å; E279-W288 HydrophobicContact CB-CE3 3.69Å; E279-W288 HydrophobicContact CB-CZ3 4.35Å; C280-W288 CarbonylContact O-C 3.56Å; C280-W288 WeakPolarHBondContact O-CA 3.35Å; Y281-W288 AromaticContact CD2-CD1 3.97Å; Y281-W288 HydrophobicContact CD2-CD2 4.24Å; Y281-W288 AromaticContact CD2-CE2 3.86Å; Y281-W288 HydrophobicContact CD2-CG 4.31Å; Y281-W288 HydrophobicContact CD2-CZ2 4.33Å; Y281-W288 AromaticContact CD2-NE1 3.68Å; Y281-W288 HydrophobicContact CG-CD2 4.33Å; Y281-W288 AromaticContact CG-CE2 3.99Å; Y281-W288 HydrophobicContact CG-CH2 4.47Å; Y281-W288 HydrophobicContact CG-CZ2 4.08Å
289	T	97.9	Very high	96.3	Very high	83 Å²	83	48.7 Å²	48.7	51%	0.509	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133	175.9	-52.2	0	0	0	0	109.8	E279 C280 V291	E279-T289 CarbonylContact C-O 3.59Å; E279-T289 WeakPolarHBondContact CA-O 3.37Å; C280-T289 PolarHBondContact N-O 3.35Å; C280-T289 PolarHBondContact O-N 2.83Å; T289-V291 PolarHBondContact O-N 2.78Å
290	C	97.7	Very high	96	Very high	93 Å²	93	52.2 Å²	52.2	63%	0.628	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	128.4	171.6	-63	0	0	0	0	109.8
291	V	98.1	Very high	95.8	Very high	24 Å²	24	51.9 Å²	51.9	15%	0.145	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	179.5	175.5	-59.9	0	0	0	0	109.7	Y268 V278 C280 T289 S293 Y328	Y268-V291 HydrophobicContact CD1-CG2 4.46Å; Y268-V291 HydrophobicContact CE1-CG2 4.47Å; V278-V291 HydrophobicContact CB-CG2 3.72Å; V278-V291 HydrophobicContact CG1-CG2 3.53Å; V278-V291 PolarHBondContact O-N 3.23Å; C280-V291 HydrophobicContact CB-CG1 3.7Å; T289-V291 PolarHBondContact O-N 2.78Å; V291-S293 PolarHBondContact O-N 3.34Å; V291-Y328 WeakPolarHBondContact CB-OH 3.38Å
292	S	97.9	Very high	95.6	Very high	43 Å²	43	51.9 Å²	51.9	30%	0.301	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-51.4	127.3	-179.5	-78.2	0	0	0	0	111.8	D333 W335	S292-D333 VanDerWaalsContact CB-O 3.32Å; S292-D333 WeakPolarHBondContact CB-O 3.43Å; S292-D333 WeakPolarHBondContact CB-OD1 3.1Å; S292-D333 PolarHBondContact N-OD1 3.06Å; S292-D333 PolarHBondContact OG-O 2.97Å; S292-D333 PolarHBondContact OG-OD1 2.91Å; S292-W335 PolarHBondContact O-NE1 2.59Å
293	S	97.4	Very high	95.6	Very high	61 Å²	61	52 Å²	52	43%	0.427	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-76.6	152.8	179.2	-60.8	0	0	0	0	111.1	G276 V291 W335	G276-S293 CarbonylContact O-C 3.53Å; G276-S293 WeakPolarHBondContact O-CA 3.35Å; G276-S293 WeakPolarHBondContact O-CB 3.31Å; V291-S293 PolarHBondContact O-N 3.34Å; S293-W335 PolarHBondContact O-NE1 3Å
294	M	95.8	Very high	95.6	Very high	9 Å²	9	52 Å²	52	4%	0.044	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-57.6	147.1	170.6	-64.4	-175.5	-62.3	0	0	110.1	V270 G276 V278 D296 L298 F301 V312 W335	V270-M294 HydrophobicContact CG1-CE 4.45Å; V270-M294 HydrophobicContact CG1-CG 4.43Å; V270-M294 HydrophobicContact CG1-SD 3.8Å; G276-M294 PolarHBondContact O-N 3.49Å; V278-M294 HydrophobicContact CG2-CG 4.31Å; M294-D296 VanDerWaalsContact C-N 3.25Å; M294-D296 PolarHBondContact O-N 2.96Å; M294-L298 HydrophobicContact CE-CB 4.41Å; M294-L298 HydrophobicContact SD-CD1 4.31Å; M294-F301 HydrophobicContact CE-CZ 4.48Å; M294-V312 HydrophobicContact SD-CG1 4.27Å; M294-V312 HydrophobicContact SD-CG2 4.39Å; M294-W335 HydrophobicContact CG-CD2 4.39Å; M294-W335 HydrophobicContact CG-CH2 3.91Å; M294-W335 HydrophobicContact CG-CZ2 3.65Å; M294-W335 HydrophobicContact CG-CZ3 4.38Å; M294-W335 HydrophobicContact SD-CH2 4.47Å
295	P	93.4	Very high	95.7	Very high	83 Å²	83	50 Å²	50	54%	0.539	28%	0.28	S	S	.	.	S	Bend	trans	-55	-40.5	178.2	-26.6	34.8	0	0	0	113.4	W335	P295-W335 HydrophobicContact CG-CB 4.3Å
296	D	91.4	Very high	95.8	Very high	94 Å²	94	44.3 Å²	44.3	50%	0.503	25%	0.253	S	S	.	.	S	Bend	trans	-130.6	140.6	175.5	-70.1	-76.1	0	0	0	110.1	M294 T317	M294-D296 VanDerWaalsContact C-N 3.25Å; M294-D296 PolarHBondContact O-N 2.96Å; D296-T317 HydrophobicContact CB-CG2 3.81Å
297	P	93.8	Very high	95.7	Very high	58 Å²	58	47.8 Å²	47.8	38%	0.377	27%	0.268	S	S	.	.			trans	-60	135.3	168.7	-23.3	34.2	0	0	0	111.5	T317	P297-T317 WeakPolarHBondContact O-CA 3.49Å
298	L	93.9	Very high	95.6	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	24%	0.244	C	C	.	.			trans	-121.6	139.1	-178.2	-67	174.4	0	0	0	111.9	M294 F301 V312 Y316 T317 N322 L326	M294-L298 HydrophobicContact CE-CB 4.41Å; M294-L298 HydrophobicContact SD-CD1 4.31Å; L298-F301 HydrophobicContact CB-CB 4.04Å; L298-F301 HydrophobicContact CB-CD1 3.48Å; L298-F301 VanDerWaalsContact CB-CD1 3.48Å; L298-F301 HydrophobicContact CB-CE1 4.14Å; L298-F301 HydrophobicContact CB-CG 3.93Å; L298-F301 HydrophobicContact CD1-CB 4.33Å; L298-F301 VanDerWaalsContact O-CD1 3.24Å; L298-F301 WeakPolarHBondContact O-CD1 3.29Å; L298-F301 VanDerWaalsContact O-CE1 3.26Å; L298-F301 WeakPolarHBondContact O-CE1 3.3Å; L298-V312 HydrophobicContact CD1-CG1 3.59Å; L298-Y316 CarbonylContact C-O 3.57Å; L298-Y316 WeakPolarHBondContact CA-O 3.21Å; L298-T317 HydrophobicContact CD2-CG2 3.65Å; L298-N322 HydrophobicContact CD2-CB 3.49Å; L298-N322 VanDerWaalsContact CD2-CB 3.49Å; L298-L326 HydrophobicContact CD1-CD1 4.11Å
299	A	92.7	Very high	95.6	Very high	37 Å²	37	43 Å²	43	31%	0.306	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-114.5	148.6	169.8	0	0	0	0	0	111	F301 G315 Y316	A299-F301 PolarHBondContact O-N 3.41Å; A299-F301 VanDerWaalsContact O-N 3.08Å; A299-G315 CarbonylContact O-C 3.49Å; A299-G315 WeakPolarHBondContact O-CA 3.43Å; A299-Y316 PolarHBondContact N-O 3.07Å; A299-Y316 PolarHBondContact O-N 2.59Å
300	E	92.1	Very high	95.6	Very high	75 Å²	75	39 Å²	39	35%	0.35	23%	0.231	S	C	.	.	S	Bend	trans	57	18.9	-179.9	-50.8	-166.4	155.5	0	0	115.2	R346 K347	E300-R346 HydrophobicContact CB-CB 4.26Å; E300-R346 IonicContact OE1-NH1 3.93Å; E300-R346 WeakPolarHBondContact OE2-CD 2.94Å; E300-R346 IonicContact OE2-CZ 3.96Å; E300-R346 IonicContact OE2-NH1 3.09Å; E300-R346 PolarHBondContact OE2-NH1 2.84Å; E300-K347 HydrophobicContact CB-CG 4.06Å; E300-K347 HydrophobicContact CG-CG 4.43Å; E300-K347 PolarHBondContact O-N 2.84Å; E300-K347 WeakPolarHBondContact OE1-CE 3.32Å; E300-K347 IonicContact OE1-NZ 2.88Å; E300-K347 PolarHBondContact OE1-NZ 2.76Å; E300-K347 VanDerWaalsContact OE1-NZ 3.09Å; E300-K347 WeakPolarHBondContact OE2-CE 3.46Å
301	F	94.3	Very high	95.6	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.018	20%	0.202	C	C	.	.			trans	-75.5	167.5	177.9	69.8	-85.9	0	0	0	112	K259 V270 M294 L298 A299 A303 V312	K259-F301 HydrophobicContact CB-CE2 4.16Å; K259-F301 WeakPolarHBondContact CE-O 3.27Å; K259-F301 HydrophobicContact CG-CD2 4.08Å; K259-F301 HydrophobicContact CG-CE2 3.47Å; K259-F301 VanDerWaalsContact CG-CE2 3.47Å; K259-F301 HydrophobicContact CG-CZ 3.98Å; V270-F301 HydrophobicContact CG1-CE2 4.23Å; V270-F301 HydrophobicContact CG1-CZ 4.34Å; V270-F301 WeakPolarHBondContact O-CZ 3.35Å; M294-F301 HydrophobicContact CE-CZ 4.48Å; L298-F301 HydrophobicContact CB-CB 4.04Å; L298-F301 HydrophobicContact CB-CD1 3.48Å; L298-F301 VanDerWaalsContact CB-CD1 3.48Å; L298-F301 HydrophobicContact CB-CE1 4.14Å; L298-F301 HydrophobicContact CB-CG 3.93Å; L298-F301 HydrophobicContact CD1-CB 4.33Å; L298-F301 VanDerWaalsContact O-CD1 3.24Å; L298-F301 WeakPolarHBondContact O-CD1 3.29Å; L298-F301 VanDerWaalsContact O-CE1 3.26Å; L298-F301 WeakPolarHBondContact O-CE1 3.3Å; A299-F301 PolarHBondContact O-N 3.41Å; A299-F301 VanDerWaalsContact O-N 3.08Å; F301-A303 HydrophobicContact CD2-CB 4.35Å; F301-A303 HydrophobicContact CE2-CB 4.18Å; F301-V312 HydrophobicContact CB-CG1 4.36Å; F301-V312 HydrophobicContact CD2-CG1 3.6Å; F301-V312 HydrophobicContact CD2-CG2 4.48Å; F301-V312 HydrophobicContact CE2-CG1 4.17Å; F301-V312 HydrophobicContact CE2-CG2 4.36Å; F301-V312 HydrophobicContact CG-CG1 4.18Å
302	S	94.4	Very high	95.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	146.4	177	-58	0	0	0	0	109	V312 M313 Q348 M350	S302-V312 CarbonylContact O-C 3.57Å; S302-V312 WeakPolarHBondContact O-CA 3.44Å; S302-M313 PolarHBondContact N-O 2.94Å; S302-M313 PolarHBondContact O-N 2.79Å; S302-Q348 WeakPolarHBondContact CB-O 3.36Å; S302-Q348 VanDerWaalsContact OG-C 3.3Å; S302-Q348 WeakPolarHBondContact OG-CA 3.13Å; S302-Q348 PolarHBondContact OG-N 3.39Å; S302-Q348 PolarHBondContact OG-O 3.06Å; S302-M350 WeakPolarHBondContact CB-SD 3.41Å
303	A	96.6	Very high	95.3	Very high	6 Å²	6	31.9 Å²	31.9	5%	0.05	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	149.7	177.6	0	0	0	0	0	111.3	K259 L261 F301 Y311 V312	K259-A303 HydrophobicContact CB-CB 3.88Å; K259-A303 HydrophobicContact CG-CB 3.76Å; L261-A303 HydrophobicContact CD1-CB 3.97Å; F301-A303 HydrophobicContact CD2-CB 4.35Å; F301-A303 HydrophobicContact CE2-CB 4.18Å; A303-Y311 CarbonylContact C-O 3.58Å; A303-Y311 WeakPolarHBondContact CA-O 3.47Å; A303-Y311 WeakPolarHBondContact CB-O 3.35Å; A303-V312 HydrophobicContact CB-CG2 3.84Å
304	C	97.2	Very high	95	Very high	5 Å²	5	29.2 Å²	29.2	3%	0.034	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	164.6	170.2	69.9	0	0	0	0	110.9	Y311 M350	C304-Y311 PolarHBondContact N-O 3.21Å; C304-Y311 VanDerWaalsContact N-O 3.08Å; C304-Y311 PolarHBondContact O-N 3.21Å; C304-M350 HydrophobicContact CB-CB 3.73Å; C304-M350 HydrophobicContact CB-CE 4.22Å; C304-M350 WeakPolarHBondContact SG-CE 3.47Å
305	E	97.3	Very high	94.9	Very high	57 Å²	57	28.8 Å²	28.8	27%	0.266	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	143.5	163.4	-176.1	-82.9	150.9	0	0	109.1	V263 Q307 G308 M309 S352	V263-E305 HydrophobicContact CB-CG 4.07Å; V263-E305 HydrophobicContact CG1-CG 3.81Å; V263-E305 HydrophobicContact CG2-CB 3.86Å; V263-E305 HydrophobicContact CG2-CG 3.64Å; E305-Q307 PolarHBondContact OE1-N 2.92Å; E305-G308 VanDerWaalsContact OE1-CA 3.29Å; E305-G308 WeakPolarHBondContact OE1-CA 3.3Å; E305-G308 PolarHBondContact OE1-N 2.77Å; E305-M309 CarbonylContact C-O 3.53Å; E305-M309 VanDerWaalsContact CA-O 3.31Å; E305-M309 WeakPolarHBondContact CA-O 3.35Å; E305-S352 WeakPolarHBondContact O-CB 3.39Å; E305-S352 PolarHBondContact O-OG 3.41Å
306	C	96.9	Very high	94.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	128.8	168.2	-175.6	0	0	0	0	108.6	G308 M309 Y311 I357	C306-G308 PolarHBondContact O-N 3.45Å; C306-M309 PolarHBondContact N-O 3.08Å; C306-M309 PolarHBondContact O-N 2.97Å; C306-Y311 HydrophobicContact CB-CD2 3.86Å; C306-Y311 HydrophobicContact CB-CE2 3.85Å; C306-I357 HydrophobicContact CB-CD1 4.05Å; C306-I357 HydrophobicContact CB-CG1 3.89Å
307	Q	95	Very high	94.8	Very high	109 Å²	109	25.4 Å²	25.4	51%	0.509	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	39.2	-177.9	-61.2	-174.3	-18.3	0	0	114.4	E305 M309 S391	E305-Q307 PolarHBondContact OE1-N 2.92Å; Q307-M309 PolarHBondContact O-N 3.13Å; Q307-S391 PolarHBondContact NE2-OG 3.47Å
308	G	95.9	Very high	94.5	Very high	9 Å²	9	27.7 Å²	27.7	9%	0.093	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	6.8	-179.5	0	0	0	0	0	114.9	V263 E305 C306 P330	V263-G308 VanDerWaalsContact CG1-O 3.31Å; V263-G308 WeakPolarHBondContact CG1-O 3.49Å; E305-G308 VanDerWaalsContact OE1-CA 3.29Å; E305-G308 WeakPolarHBondContact OE1-CA 3.3Å; E305-G308 PolarHBondContact OE1-N 2.77Å; C306-G308 PolarHBondContact O-N 3.45Å; G308-P330 WeakPolarHBondContact O-CD 3.19Å; G308-P330 WeakPolarHBondContact O-CG 3.34Å
309	M	97.6	Very high	94.2	Very high	50 Å²	50	39.2 Å²	39.2	25%	0.246	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	156.9	177.9	-56.1	-61.1	-171.3	0	0	110.5	E305 C306 Q307 Y311 R327 C329	E305-M309 CarbonylContact C-O 3.53Å; E305-M309 VanDerWaalsContact CA-O 3.31Å; E305-M309 WeakPolarHBondContact CA-O 3.35Å; C306-M309 PolarHBondContact N-O 3.08Å; C306-M309 PolarHBondContact O-N 2.97Å; Q307-M309 PolarHBondContact O-N 3.13Å; M309-Y311 HydrophobicContact CB-CD2 4.46Å; M309-Y311 HydrophobicContact CB-CE2 3.77Å; M309-R327 HydrophobicContact CB-CG 4.21Å; M309-C329 HydrophobicContact CE-CB 4.23Å; M309-C329 VanDerWaalsContact SD-CA 3.57Å; M309-C329 HydrophobicContact SD-CB 3.82Å
310	I	98.3	Very high	94	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127.5	174.1	-65.5	172	0	0	0	109.1	L261 V263 Y268 V270 V312 R327 Y328 W335	L261-I310 HydrophobicContact CD1-CB 4.39Å; L261-I310 HydrophobicContact CD1-CD1 4.31Å; L261-I310 HydrophobicContact CD1-CG1 4.08Å; L261-I310 HydrophobicContact CD1-CG2 3.6Å; V263-I310 HydrophobicContact CG2-CD1 3.88Å; V263-I310 HydrophobicContact CG2-CG1 3.63Å; Y268-I310 HydrophobicContact CD1-CD1 3.94Å; Y268-I310 HydrophobicContact CD2-CD1 3.99Å; Y268-I310 HydrophobicContact CG-CD1 3.55Å; V270-I310 HydrophobicContact CG2-CD1 4.29Å; V270-I310 HydrophobicContact CG2-CG2 4.36Å; I310-V312 HydrophobicContact CG2-CG2 4.24Å; I310-R327 CarbonylContact O-C 3.58Å; I310-R327 VanDerWaalsContact O-CA 3.3Å; I310-R327 WeakPolarHBondContact O-CA 3.27Å; I310-Y328 HydrophobicContact CB-CD1 4.36Å; I310-Y328 HydrophobicContact CD1-CD1 3.97Å; I310-Y328 HydrophobicContact CG1-CD1 4.41Å; I310-Y328 PolarHBondContact N-O 3.37Å; I310-Y328 PolarHBondContact O-N 3.14Å; I310-W335 HydrophobicContact CG2-CH2 4.26Å
311	Y	97.3	Very high	94	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.02	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	131.8	173.7	-67.5	-93.4	0	0	0	109.8	A303 C304 C306 M309 V325 L326 R327 F338 I357 V390	A303-Y311 CarbonylContact C-O 3.58Å; A303-Y311 WeakPolarHBondContact CA-O 3.47Å; A303-Y311 WeakPolarHBondContact CB-O 3.35Å; C304-Y311 PolarHBondContact N-O 3.21Å; C304-Y311 VanDerWaalsContact N-O 3.08Å; C304-Y311 PolarHBondContact O-N 3.21Å; C306-Y311 HydrophobicContact CB-CD2 3.86Å; C306-Y311 HydrophobicContact CB-CE2 3.85Å; M309-Y311 HydrophobicContact CB-CD2 4.46Å; M309-Y311 HydrophobicContact CB-CE2 3.77Å; Y311-V325 HydrophobicContact CD1-CG1 4.03Å; Y311-L326 CarbonylContact C-O 3.58Å; Y311-L326 WeakPolarHBondContact CA-O 3.35Å; Y311-R327 HydrophobicContact CD1-CB 4.11Å; Y311-R327 HydrophobicContact CD1-CG 4.26Å; Y311-R327 HydrophobicContact CE1-CB 3.89Å; Y311-R327 HydrophobicContact CE1-CG 3.73Å; Y311-R327 HydrophobicContact CE2-CG 4.48Å; Y311-R327 WeakPolarHBondContact OH-CD 3.47Å; Y311-F338 HydrophobicContact CD1-CD1 4.33Å; Y311-F338 HydrophobicContact CD1-CG 4.49Å; Y311-F338 HydrophobicContact CE1-CB 4.46Å; Y311-F338 AromaticContact CE1-CD1 3.88Å; Y311-F338 HydrophobicContact CE1-CD1 3.88Å; Y311-F338 HydrophobicContact CE1-CD2 4.09Å; Y311-F338 HydrophobicContact CE1-CE1 4.08Å; Y311-F338 HydrophobicContact CE1-CE2 4.3Å; Y311-F338 AromaticContact CE1-CG 3.87Å; Y311-F338 HydrophobicContact CE1-CG 3.87Å; Y311-F338 HydrophobicContact CE1-CZ 4.31Å; Y311-I357 HydrophobicContact CD1-CD1 4.35Å; Y311-I357 HydrophobicContact CD2-CD1 3.91Å; Y311-I357 HydrophobicContact CG-CD1 3.81Å; Y311-V390 HydrophobicContact CE1-CG1 4.13Å; Y311-V390 HydrophobicContact CE2-CG1 4.36Å; Y311-V390 WeakPolarHBondContact OH-CG1 3.38Å
312	V	96.2	Very high	93.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.6	176.6	169.5	0	0	0	0	108.7	V270 M294 L298 F301 S302 A303 I310 V325 L326 W335	V270-V312 HydrophobicContact CG1-CG2 4.04Å; M294-V312 HydrophobicContact SD-CG1 4.27Å; M294-V312 HydrophobicContact SD-CG2 4.39Å; L298-V312 HydrophobicContact CD1-CG1 3.59Å; F301-V312 HydrophobicContact CB-CG1 4.36Å; F301-V312 HydrophobicContact CD2-CG1 3.6Å; F301-V312 HydrophobicContact CD2-CG2 4.48Å; F301-V312 HydrophobicContact CE2-CG1 4.17Å; F301-V312 HydrophobicContact CE2-CG2 4.36Å; F301-V312 HydrophobicContact CG-CG1 4.18Å; S302-V312 CarbonylContact O-C 3.57Å; S302-V312 WeakPolarHBondContact O-CA 3.44Å; A303-V312 HydrophobicContact CB-CG2 3.84Å; I310-V312 HydrophobicContact CG2-CG2 4.24Å; V312-V325 WeakPolarHBondContact O-CA 3.32Å; V312-L326 HydrophobicContact CB-CB 4.23Å; V312-L326 PolarHBondContact N-O 3.22Å; V312-L326 PolarHBondContact O-N 3.13Å; V312-W335 HydrophobicContact CB-CZ3 4.29Å; V312-W335 HydrophobicContact CG2-CH2 3.75Å; V312-W335 HydrophobicContact CG2-CZ3 3.9Å
313	M	93.4	Very high	93.7	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.03	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	147.7	-177.8	-51.5	-163.2	-140.9	0	0	112.5	S302 V325 I345 M350 I357	S302-M313 PolarHBondContact N-O 2.94Å; S302-M313 PolarHBondContact O-N 2.79Å; M313-V325 HydrophobicContact CE-CG1 4.27Å; M313-V325 HydrophobicContact CG-CB 4.25Å; M313-V325 HydrophobicContact CG-CG1 3.85Å; M313-V325 HydrophobicContact CG-CG2 3.89Å; M313-V325 HydrophobicContact SD-CB 4.46Å; M313-V325 HydrophobicContact SD-CG1 4.07Å; M313-V325 HydrophobicContact SD-CG2 3.67Å; M313-I345 HydrophobicContact CB-CD1 3.83Å; M313-M350 HydrophobicContact CB-SD 4.07Å; M313-M350 HydrophobicContact CE-CE 3.44Å; M313-M350 VanDerWaalsContact CE-CE 3.44Å; M313-M350 HydrophobicContact CE-SD 4.22Å; M313-M350 HydrophobicContact CG-CE 4.03Å; M313-M350 HydrophobicContact CG-SD 4.03Å; M313-M350 HydrophobicContact SD-CE 4.38Å; M313-I357 HydrophobicContact CE-CD1 3.93Å; M313-I357 HydrophobicContact CE-CG2 3.93Å
314	G	92.3	Very high	93.5	Very high	4 Å²	4	47.3 Å²	47.3	4%	0.041	24%	0.237	C	C	.	.			trans	69.5	-158.5	171	0	0	0	0	0	114.5	N322 I345	G314-N322 WeakPolarHBondContact O-CB 3.43Å; G314-N322 PolarHBondContact O-ND2 2.9Å; G314-I345 CarbonylContact C-O 3.57Å; G314-I345 WeakPolarHBondContact CA-O 3.08Å
315	G	92.6	Very high	93.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.236	C	C	.	.			trans	78.2	-167.2	-177	0	0	0	0	0	113.2	A299 N322 H344 I345	A299-G315 CarbonylContact O-C 3.49Å; A299-G315 WeakPolarHBondContact O-CA 3.43Å; G315-N322 PolarHBondContact O-N 3.14Å; G315-H344 PolarHBondContact O-NE2 3.18Å; G315-I345 PolarHBondContact N-O 2.77Å
316	Y	91.6	Very high	93.3	Very high	76 Å²	76	45 Å²	45	30%	0.298	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-123.7	135.9	-177.7	-60.1	-83.4	0	0	0	110.5	L298 A299 R321 H344 R346	L298-Y316 CarbonylContact C-O 3.57Å; L298-Y316 WeakPolarHBondContact CA-O 3.21Å; A299-Y316 PolarHBondContact N-O 3.07Å; A299-Y316 PolarHBondContact O-N 2.59Å; Y316-R321 HydrophobicContact CD1-CG 3.95Å; Y316-R321 HydrophobicContact CE1-CG 3.69Å; Y316-H344 AromaticContact CE1-CE1 3.49Å; Y316-H344 VanDerWaalsContact CE1-CE1 3.49Å; Y316-H344 WeakPolarHBondContact CE1-CE1 3.19Å; Y316-H344 AromaticContact CZ-CE1 3.47Å; Y316-H344 VanDerWaalsContact CZ-CE1 3.47Å; Y316-R346 VanDerWaalsContact OH-CD 3.29Å; Y316-R346 WeakPolarHBondContact OH-CD 3.47Å
317	T	91.6	Very high	93.3	Very high	31 Å²	31	48.9 Å²	48.9	19%	0.19	24%	0.241	C	C	.	.			trans	-79	177.1	160.3	69.9	0	0	0	0	109.4	D296 P297 L298 R319 D320 N322	D296-T317 HydrophobicContact CB-CG2 3.81Å; P297-T317 WeakPolarHBondContact O-CA 3.49Å; L298-T317 HydrophobicContact CD2-CG2 3.65Å; T317-R319 PolarHBondContact O-N 2.72Å; T317-R319 PolarHBondContact OG1-N 3.44Å; T317-D320 PolarHBondContact N-O 3.31Å; T317-D320 PolarHBondContact OG1-N 2.97Å; T317-D320 PolarHBondContact OG1-O 2.92Å; T317-N322 HydrophobicContact CG2-CB 4.41Å
318	A	87.7	Confident	93.4	Very high	105 Å²	105	43.8 Å²	43.8	87%	0.868	22%	0.217	S	C	*	.	S	Bend	trans	-62.3	-19.8	173.6	0	0	0	0	0	113.9
319	R	86.7	Confident	93.5	Very high	244 Å²	244	44.4 Å²	44.4	92%	0.921	22%	0.219	S	C	*	.	S	Bend	trans	-116.8	-34.3	-171.8	-61.9	-176.2	-177.8	-167.9	1.6	113.6	T317	T317-R319 PolarHBondContact O-N 2.72Å; T317-R319 PolarHBondContact OG1-N 3.44Å
320	D	89.9	Confident	93.5	Very high	111 Å²	111	43 Å²	43	59%	0.594	21%	0.214	S	C	*	.	S	Bend	trans	-155	172.5	-174.2	-151.3	-10.9	0	0	0	113	T317	T317-D320 PolarHBondContact N-O 3.31Å; T317-D320 PolarHBondContact OG1-N 2.97Å; T317-D320 PolarHBondContact OG1-O 2.92Å
321	R	91.2	Very high	93.4	Very high	84 Å²	84	48.7 Å²	48.7	32%	0.317	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-60.7	133.4	169	-68.2	175	-172.7	-164.5	-1.5	110.4	Y316 H365	Y316-R321 HydrophobicContact CD1-CG 3.95Å; Y316-R321 HydrophobicContact CE1-CG 3.69Å; R321-H365 PolarHBondContact NH1-CE1 2.95Å; R321-H365 VanDerWaalsContact NH1-CE1 3.34Å; R321-H365 PolarHBondContact NH1-ND1 2.87Å
322	N	91.8	Very high	93.4	Very high	12 Å²	12	51.8 Å²	51.8	6%	0.064	27%	0.272	C	S	.	.			trans	-83.9	117.1	168.6	175.3	45.8	0	0	0	110	L298 G314 G315 T317 N324 H344	L298-N322 HydrophobicContact CD2-CB 3.49Å; L298-N322 VanDerWaalsContact CD2-CB 3.49Å; G314-N322 WeakPolarHBondContact O-CB 3.43Å; G314-N322 PolarHBondContact O-ND2 2.9Å; G315-N322 PolarHBondContact O-N 3.14Å; T317-N322 HydrophobicContact CG2-CB 4.41Å; N322-N324 PolarHBondContact ND2-O 2.71Å; N322-N324 PolarHBondContact OD1-N 3.05Å; N322-N324 PolarHBondContact OD1-O 2.87Å; N322-H344 PolarHBondContact O-CD2 2.69Å
323	T	90.6	Very high	93.5	Very high	37 Å²	37	55 Å²	55	23%	0.227	29%	0.288	C	S	.	.			trans	-102.9	-6.5	173.4	54	0	0	0	0	112.4	C341 L367	T323-C341 PolarHBondContact O-N 2.83Å; T323-L367 HydrophobicContact CG2-CD1 3.48Å; T323-L367 VanDerWaalsContact CG2-CD1 3.48Å
324	N	92.3	Very high	93.7	Very high	49 Å²	49	57 Å²	57	26%	0.262	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134.7	-179.6	-66.8	-38.5	0	0	0	110.9	N322 L326 V337 T340	N322-N324 PolarHBondContact ND2-O 2.71Å; N322-N324 PolarHBondContact OD1-N 3.05Å; N322-N324 PolarHBondContact OD1-O 2.87Å; N324-L326 HydrophobicContact CB-CD2 4.12Å; N324-V337 HydrophobicContact CB-CG1 4.09Å; N324-T340 PolarHBondContact OD1-OG1 3.3Å
325	V	93.7	Very high	94	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	109.2	161	-179.1	0	0	0	0	106.6	Y311 V312 M313 F338 Q339 C341	Y311-V325 HydrophobicContact CD1-CG1 4.03Å; V312-V325 WeakPolarHBondContact O-CA 3.32Å; M313-V325 HydrophobicContact CE-CG1 4.27Å; M313-V325 HydrophobicContact CG-CB 4.25Å; M313-V325 HydrophobicContact CG-CG1 3.85Å; M313-V325 HydrophobicContact CG-CG2 3.89Å; M313-V325 HydrophobicContact SD-CB 4.46Å; M313-V325 HydrophobicContact SD-CG1 4.07Å; M313-V325 HydrophobicContact SD-CG2 3.67Å; V325-F338 HydrophobicContact CB-CB 4.46Å; V325-F338 HydrophobicContact CG1-CB 4.18Å; V325-F338 HydrophobicContact CG1-CD1 4.03Å; V325-F338 WeakPolarHBondContact O-CB 3.4Å; V325-F338 PolarHBondContact O-N 3.34Å; V325-Q339 WeakPolarHBondContact CB-O 3.45Å; V325-Q339 PolarHBondContact N-O 2.87Å; V325-C341 WeakPolarHBondContact CG2-SG 3.48Å
326	L	95.8	Very high	94.2	Very high	10 Å²	10	60.4 Å²	60.4	5%	0.052	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	137.9	176.1	-55.1	176.1	0	0	0	108.8	L298 Y311 V312 N324 W335 V337	L298-L326 HydrophobicContact CD1-CD1 4.11Å; Y311-L326 CarbonylContact C-O 3.58Å; Y311-L326 WeakPolarHBondContact CA-O 3.35Å; V312-L326 HydrophobicContact CB-CB 4.23Å; V312-L326 PolarHBondContact N-O 3.22Å; V312-L326 PolarHBondContact O-N 3.13Å; N324-L326 HydrophobicContact CB-CD2 4.12Å; L326-W335 HydrophobicContact CB-CE3 3.79Å; L326-W335 HydrophobicContact CB-CZ3 3.87Å; L326-V337 HydrophobicContact CD2-CG2 4.09Å
327	R	97.5	Very high	94.4	Very high	82 Å²	82	60.8 Å²	60.8	31%	0.309	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.7	175.1	179.1	-172.5	65.9	-177.3	-0.1	109.8	M309 I310 Y311 W335 S336 F338	M309-R327 HydrophobicContact CB-CG 4.21Å; I310-R327 CarbonylContact O-C 3.58Å; I310-R327 VanDerWaalsContact O-CA 3.3Å; I310-R327 WeakPolarHBondContact O-CA 3.27Å; Y311-R327 HydrophobicContact CD1-CB 4.11Å; Y311-R327 HydrophobicContact CD1-CG 4.26Å; Y311-R327 HydrophobicContact CE1-CB 3.89Å; Y311-R327 HydrophobicContact CE1-CG 3.73Å; Y311-R327 HydrophobicContact CE2-CG 4.48Å; Y311-R327 WeakPolarHBondContact OH-CD 3.47Å; R327-W335 CarbonylContact O-C 3.59Å; R327-W335 WeakPolarHBondContact O-CA 3.38Å; R327-S336 PolarHBondContact N-O 3.09Å; R327-S336 PolarHBondContact NE-OG 2.73Å; R327-S336 PolarHBondContact NH2-OG 2.85Å; R327-S336 PolarHBondContact O-N 3.33Å; R327-S336 PolarHBondContact O-OG 2.86Å; R327-F338 HydrophobicContact CB-CB 3.85Å; R327-F338 HydrophobicContact CB-CG 4.44Å
328	Y	98.4	Very high	94.5	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.008	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.7	172.6	173.5	-99.1	0	0	0	110.8	Y268 V291 I310 P330 D333 W335	Y268-Y328 HydrophobicContact CD1-CE1 4.16Å; Y268-Y328 AromaticContact CE1-CE1 3.74Å; Y268-Y328 HydrophobicContact CE1-CE1 3.74Å; V291-Y328 WeakPolarHBondContact CB-OH 3.38Å; I310-Y328 HydrophobicContact CB-CD1 4.36Å; I310-Y328 HydrophobicContact CD1-CD1 3.97Å; I310-Y328 HydrophobicContact CG1-CD1 4.41Å; I310-Y328 PolarHBondContact N-O 3.37Å; I310-Y328 PolarHBondContact O-N 3.14Å; Y328-P330 HydrophobicContact CD1-CG 4.19Å; Y328-P330 HydrophobicContact CE1-CB 4.29Å; Y328-P330 HydrophobicContact CE1-CG 4Å; Y328-P330 WeakPolarHBondContact O-CD 3.35Å; Y328-D333 WeakPolarHBondContact CE2-OD1 3Å; Y328-D333 PolarHBondContact OH-OD1 3.43Å; Y328-W335 AromaticContact CD2-CD1 3.76Å; Y328-W335 AromaticContact CD2-CD2 3.98Å; Y328-W335 HydrophobicContact CD2-CD2 3.98Å; Y328-W335 AromaticContact CD2-CE2 3.56Å; Y328-W335 HydrophobicContact CD2-CG 4.09Å; Y328-W335 HydrophobicContact CD2-CZ2 4.01Å; Y328-W335 AromaticContact CD2-NE1 3.4Å; Y328-W335 HydrophobicContact CG-CD2 4.27Å; Y328-W335 AromaticContact CG-CE2 3.88Å; Y328-W335 HydrophobicContact CG-CH2 4.34Å; Y328-W335 AromaticContact CG-CZ2 3.9Å; Y328-W335 HydrophobicContact CG-CZ2 3.9Å
329	C	97.7	Very high	94.6	Very high	21 Å²	21	60.9 Å²	60.9	14%	0.142	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	110.6	175.3	177	0	0	0	0	109.8	M309 T331 S332 D333 S334	M309-C329 HydrophobicContact CE-CB 4.23Å; M309-C329 VanDerWaalsContact SD-CA 3.57Å; M309-C329 HydrophobicContact SD-CB 3.82Å; C329-T331 PolarHBondContact O-N 3.41Å; C329-S332 VanDerWaalsContact CB-OG 3.31Å; C329-S332 WeakPolarHBondContact CB-OG 3.44Å; C329-S332 PolarHBondContact O-N 2.95Å; C329-S332 PolarHBondContact SG-OG 2.92Å; C329-D333 WeakPolarHBondContact O-CA 3.43Å; C329-D333 PolarHBondContact O-N 3.39Å; C329-S334 PolarHBondContact N-O 2.91Å; C329-S334 VanDerWaalsContact N-O 3.11Å; C329-S334 PolarHBondContact O-N 2.8Å
330	P	97.3	Very high	94.7	Very high	20 Å²	20	53 Å²	53	13%	0.13	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-33	176.7	-30.6	38.7	0	0	0	114.7	V263 Y268 G308 Y328	V263-P330 HydrophobicContact CG1-CG 3.95Å; Y268-P330 WeakPolarHBondContact OH-CB 3.23Å; G308-P330 WeakPolarHBondContact O-CD 3.19Å; G308-P330 WeakPolarHBondContact O-CG 3.34Å; Y328-P330 HydrophobicContact CD1-CG 4.19Å; Y328-P330 HydrophobicContact CE1-CB 4.29Å; Y328-P330 HydrophobicContact CE1-CG 4Å; Y328-P330 WeakPolarHBondContact O-CD 3.35Å
331	T	96.6	Very high	94.3	Very high	120 Å²	120	48.8 Å²	48.8	74%	0.736	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-37.6	-176.3	-49	0	0	0	0	112.7	C329	C329-T331 PolarHBondContact O-N 3.41Å
332	S	97.2	Very high	93.7	Very high	71 Å²	71	49.1 Å²	49.1	50%	0.497	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-1.3	179.8	61.5	0	0	0	0	113.5	C329 S334	C329-S332 VanDerWaalsContact CB-OG 3.31Å; C329-S332 WeakPolarHBondContact CB-OG 3.44Å; C329-S332 PolarHBondContact O-N 2.95Å; C329-S332 PolarHBondContact SG-OG 2.92Å; S332-S334 VanDerWaalsContact C-N 3.32Å; S332-S334 PolarHBondContact O-N 2.85Å; S332-S334 PolarHBondContact OG-OG 3.07Å
333	D	97.9	Very high	93.3	Very high	66 Å²	66	49.5 Å²	49.5	35%	0.353	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	46	53.8	-175.6	-173.6	17.9	0	0	0	112.3	S292 Y328 C329	S292-D333 VanDerWaalsContact CB-O 3.32Å; S292-D333 WeakPolarHBondContact CB-O 3.43Å; S292-D333 WeakPolarHBondContact CB-OD1 3.1Å; S292-D333 PolarHBondContact N-OD1 3.06Å; S292-D333 PolarHBondContact OG-O 2.97Å; S292-D333 PolarHBondContact OG-OD1 2.91Å; Y328-D333 WeakPolarHBondContact CE2-OD1 3Å; Y328-D333 PolarHBondContact OH-OD1 3.43Å; C329-D333 WeakPolarHBondContact O-CA 3.43Å; C329-D333 PolarHBondContact O-N 3.39Å
334	S	97.8	Very high	93.2	Very high	49 Å²	49	48 Å²	48	34%	0.343	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	139.5	-172.7	67.5	0	0	0	0	112.9	C329 S332	C329-S334 PolarHBondContact N-O 2.91Å; C329-S334 VanDerWaalsContact N-O 3.11Å; C329-S334 PolarHBondContact O-N 2.8Å; S332-S334 VanDerWaalsContact C-N 3.32Å; S332-S334 PolarHBondContact O-N 2.85Å; S332-S334 PolarHBondContact OG-OG 3.07Å
335	W	98	Very high	93	Very high	36 Å²	36	45.9 Å²	45.9	14%	0.136	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	142.8	171.1	-70.5	90.8	0	0	0	111.5	V270 V278 S292 S293 M294 P295 I310 V312 L326 R327 Y328	V270-W335 HydrophobicContact CG1-CH2 4.23Å; V270-W335 HydrophobicContact CG1-CZ2 4.43Å; V278-W335 HydrophobicContact CG2-CZ2 3.91Å; S292-W335 PolarHBondContact O-NE1 2.59Å; S293-W335 PolarHBondContact O-NE1 3Å; M294-W335 HydrophobicContact CG-CD2 4.39Å; M294-W335 HydrophobicContact CG-CH2 3.91Å; M294-W335 HydrophobicContact CG-CZ2 3.65Å; M294-W335 HydrophobicContact CG-CZ3 4.38Å; M294-W335 HydrophobicContact SD-CH2 4.47Å; P295-W335 HydrophobicContact CG-CB 4.3Å; I310-W335 HydrophobicContact CG2-CH2 4.26Å; V312-W335 HydrophobicContact CB-CZ3 4.29Å; V312-W335 HydrophobicContact CG2-CH2 3.75Å; V312-W335 HydrophobicContact CG2-CZ3 3.9Å; L326-W335 HydrophobicContact CB-CE3 3.79Å; L326-W335 HydrophobicContact CB-CZ3 3.87Å; R327-W335 CarbonylContact O-C 3.59Å; R327-W335 WeakPolarHBondContact O-CA 3.38Å; Y328-W335 AromaticContact CD2-CD1 3.76Å; Y328-W335 AromaticContact CD2-CD2 3.98Å; Y328-W335 HydrophobicContact CD2-CD2 3.98Å; Y328-W335 AromaticContact CD2-CE2 3.56Å; Y328-W335 HydrophobicContact CD2-CG 4.09Å; Y328-W335 HydrophobicContact CD2-CZ2 4.01Å; Y328-W335 AromaticContact CD2-NE1 3.4Å; Y328-W335 HydrophobicContact CG-CD2 4.27Å; Y328-W335 AromaticContact CG-CE2 3.88Å; Y328-W335 HydrophobicContact CG-CH2 4.34Å; Y328-W335 AromaticContact CG-CZ2 3.9Å; Y328-W335 HydrophobicContact CG-CZ2 3.9Å
336	S	97	Very high	92.9	Very high	39 Å²	39	47.9 Å²	47.9	27%	0.273	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	148.3	173.5	54.9	0	0	0	0	109.8	R327 F338	R327-S336 PolarHBondContact N-O 3.09Å; R327-S336 PolarHBondContact NE-OG 2.73Å; R327-S336 PolarHBondContact NH2-OG 2.85Å; R327-S336 PolarHBondContact O-N 3.33Å; R327-S336 PolarHBondContact O-OG 2.86Å; S336-F338 PolarHBondContact O-N 3.07Å
337	V	95.8	Very high	92.6	Very high	85 Å²	85	51.5 Å²	51.5	52%	0.515	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	116.2	166.7	179	0	0	0	0	107.1	N324 L326	N324-V337 HydrophobicContact CB-CG1 4.09Å; L326-V337 HydrophobicContact CD2-CG2 4.09Å
338	F	92.9	Very high	92.2	Very high	58 Å²	58	47.6 Å²	47.6	25%	0.254	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-49.5	-178.9	-179	-108.3	0	0	0	111.3	Y311 V325 R327 S336 Y388 V390	Y311-F338 HydrophobicContact CD1-CD1 4.33Å; Y311-F338 HydrophobicContact CD1-CG 4.49Å; Y311-F338 HydrophobicContact CE1-CB 4.46Å; Y311-F338 AromaticContact CE1-CD1 3.88Å; Y311-F338 HydrophobicContact CE1-CD1 3.88Å; Y311-F338 HydrophobicContact CE1-CD2 4.09Å; Y311-F338 HydrophobicContact CE1-CE1 4.08Å; Y311-F338 HydrophobicContact CE1-CE2 4.3Å; Y311-F338 AromaticContact CE1-CG 3.87Å; Y311-F338 HydrophobicContact CE1-CG 3.87Å; Y311-F338 HydrophobicContact CE1-CZ 4.31Å; V325-F338 HydrophobicContact CB-CB 4.46Å; V325-F338 HydrophobicContact CG1-CB 4.18Å; V325-F338 HydrophobicContact CG1-CD1 4.03Å; V325-F338 WeakPolarHBondContact O-CB 3.4Å; V325-F338 PolarHBondContact O-N 3.34Å; R327-F338 HydrophobicContact CB-CB 3.85Å; R327-F338 HydrophobicContact CB-CG 4.44Å; S336-F338 PolarHBondContact O-N 3.07Å; F338-Y388 AromaticContact CE1-CE1 3.9Å; F338-Y388 HydrophobicContact CE1-CE1 3.9Å; F338-Y388 VanDerWaalsContact CE1-OH 3.28Å; F338-Y388 WeakPolarHBondContact CE1-OH 3.43Å; F338-V390 HydrophobicContact CE1-CG1 4.23Å; F338-V390 HydrophobicContact CE2-CG1 4.35Å; F338-V390 HydrophobicContact CZ-CG1 3.69Å
339	Q	89.8	Confident	92	Very high	80 Å²	80	48.9 Å²	48.9	37%	0.374	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	161.9	176.7	-173	167.5	1.9	0	0	110	V325 Y388	V325-Q339 WeakPolarHBondContact CB-O 3.45Å; V325-Q339 PolarHBondContact N-O 2.87Å; Q339-Y388 PolarHBondContact OE1-OH 3.25Å
340	T	89.3	Confident	91.9	Very high	78 Å²	78	48.9 Å²	48.9	48%	0.479	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.7	167.7	-54	0	0	0	0	109.7	N324	N324-T340 PolarHBondContact OD1-OG1 3.3Å
341	C	81.3	Confident	91.8	Very high	22 Å²	22	48.8 Å²	48.8	15%	0.149	27%	0.274	C	S	.	.			trans	-85.9	134.6	177	-67.9	0	0	0	0	110.8	T323 V325 V343	T323-C341 PolarHBondContact O-N 2.83Å; V325-C341 WeakPolarHBondContact CG2-SG 3.48Å; C341-V343 PolarHBondContact O-N 3.11Å
342	P	79.5	Confident	91.8	Very high	92 Å²	92	44.2 Å²	44.2	60%	0.597	25%	0.247	S	C	*	.	S	Bend	trans	-73.4	-5.8	174.5	29.7	-33.2	0	0	0	112.9	W395	P342-W395 HydrophobicContact CG-CZ3 4.48Å
343	V	83.1	Confident	91.6	Very high	20 Å²	20	42.9 Å²	42.9	12%	0.121	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.3	-176.3	-176.3	0	0	0	0	108.5	C341 I345 T364 H365 Q366 W395	C341-V343 PolarHBondContact O-N 3.11Å; V343-I345 HydrophobicContact CG1-CG2 4.46Å; V343-T364 HydrophobicContact CG1-CG2 3.29Å; V343-H365 WeakPolarHBondContact CG1-O 3.4Å; V343-Q366 HydrophobicContact CG2-CG 4.35Å; V343-W395 HydrophobicContact CB-CH2 4.19Å; V343-W395 HydrophobicContact CG2-CH2 4.34Å; V343-W395 HydrophobicContact CG2-CZ3 4.43Å
344	H	88	Confident	91.2	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.019	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.5	173.9	178.7	-113.6	0	0	0	110	G315 Y316 N322 H365 L367	G315-H344 PolarHBondContact O-NE2 3.18Å; Y316-H344 AromaticContact CE1-CE1 3.49Å; Y316-H344 VanDerWaalsContact CE1-CE1 3.49Å; Y316-H344 WeakPolarHBondContact CE1-CE1 3.19Å; Y316-H344 AromaticContact CZ-CE1 3.47Å; Y316-H344 VanDerWaalsContact CZ-CE1 3.47Å; N322-H344 PolarHBondContact O-CD2 2.69Å; H344-H365 HydrophobicContact CB-CB 4.49Å; H344-H365 PolarHBondContact N-O 2.81Å; H344-H365 PolarHBondContact O-N 3.46Å; H344-L367 HydrophobicContact CB-CD1 4.38Å; H344-L367 HydrophobicContact CB-CD2 4.16Å; H344-L367 HydrophobicContact CB-CG 4.36Å
345	I	89	Confident	91	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	151.9	179.2	58.2	167.2	0	0	0	111.1	M313 G314 G315 V343 Q348 L359 Y363 T364	M313-I345 HydrophobicContact CB-CD1 3.83Å; G314-I345 CarbonylContact C-O 3.57Å; G314-I345 WeakPolarHBondContact CA-O 3.08Å; G315-I345 PolarHBondContact N-O 2.77Å; V343-I345 HydrophobicContact CG1-CG2 4.46Å; I345-Q348 HydrophobicContact CB-CG 4.27Å; I345-L359 HydrophobicContact CD1-CD2 4.04Å; I345-Y363 VanDerWaalsContact CA-O 3.3Å; I345-Y363 WeakPolarHBondContact CA-O 2.95Å; I345-T364 HydrophobicContact CG2-CG2 4.33Å
346	R	90.5	Very high	90.8	Very high	45 Å²	45	46.5 Å²	46.5	17%	0.17	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	155	173.7	61.9	179.8	-172.1	105.6	3	112.1	E300 Y316 Q348 G362 Y363	E300-R346 HydrophobicContact CB-CB 4.26Å; E300-R346 IonicContact OE1-NH1 3.93Å; E300-R346 WeakPolarHBondContact OE2-CD 2.94Å; E300-R346 IonicContact OE2-CZ 3.96Å; E300-R346 IonicContact OE2-NH1 3.09Å; E300-R346 PolarHBondContact OE2-NH1 2.84Å; Y316-R346 VanDerWaalsContact OH-CD 3.29Å; Y316-R346 WeakPolarHBondContact OH-CD 3.47Å; R346-Q348 PolarHBondContact O-N 2.82Å; R346-Q348 VanDerWaalsContact O-N 3.09Å; R346-G362 WeakPolarHBondContact O-CA 3.36Å; R346-Y363 HydrophobicContact CG-CD2 3.97Å; R346-Y363 HydrophobicContact CG-CG 4.26Å; R346-Y363 VanDerWaalsContact CZ-CE2 3.44Å; R346-Y363 PolarHBondContact N-O 3.07Å; R346-Y363 VanDerWaalsContact N-O 3.11Å; R346-Y363 VanDerWaalsContact NH2-CZ 3.34Å; R346-Y363 PolarHBondContact O-N 2.97Å
347	K	89.4	Confident	90.7	Very high	86 Å²	86	44.6 Å²	44.6	37%	0.374	24%	0.236	S	C	.	.	S	Bend	trans	58.5	12.5	-180	-56.6	-169	-178	-177.6	0	115.5	E300 Y363	E300-K347 HydrophobicContact CB-CG 4.06Å; E300-K347 HydrophobicContact CG-CG 4.43Å; E300-K347 PolarHBondContact O-N 2.84Å; E300-K347 WeakPolarHBondContact OE1-CE 3.32Å; E300-K347 IonicContact OE1-NZ 2.88Å; E300-K347 PolarHBondContact OE1-NZ 2.76Å; E300-K347 VanDerWaalsContact OE1-NZ 3.09Å; E300-K347 WeakPolarHBondContact OE2-CE 3.46Å; K347-Y363 HydrophobicContact CD-CD2 4.44Å; K347-Y363 HydrophobicContact CD-CE2 4.16Å
348	Q	90.4	Very high	90.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.216	C	C	.	.			trans	-69	152	175.8	-50.7	-162.5	-64.9	0	0	109.8	S302 I345 R346 G361	S302-Q348 WeakPolarHBondContact CB-O 3.36Å; S302-Q348 VanDerWaalsContact OG-C 3.3Å; S302-Q348 WeakPolarHBondContact OG-CA 3.13Å; S302-Q348 PolarHBondContact OG-N 3.39Å; S302-Q348 PolarHBondContact OG-O 3.06Å; I345-Q348 HydrophobicContact CB-CG 4.27Å; R346-Q348 PolarHBondContact O-N 2.82Å; R346-Q348 VanDerWaalsContact O-N 3.09Å; Q348-G361 VanDerWaalsContact CG-O 3.26Å; Q348-G361 WeakPolarHBondContact CG-O 3.4Å; Q348-G361 PolarHBondContact NE2-O 2.83Å
349	Q	94.4	Very high	90.7	Very high	29 Å²	29	39.2 Å²	39.2	14%	0.136	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	140.9	163	-55.6	-50.6	-58.4	0	0	108.8	L359 V360 L409 C411	Q349-L359 WeakPolarHBondContact O-CA 3.48Å; Q349-V360 HydrophobicContact CB-CB 4.42Å; Q349-V360 PolarHBondContact N-O 2.82Å; Q349-V360 PolarHBondContact O-N 2.84Å; Q349-L409 VanDerWaalsContact CD-O 3.27Å; Q349-L409 HydrophobicContact CG-CB 4.41Å; Q349-L409 WeakPolarHBondContact CG-O 3.49Å; Q349-L409 PolarHBondContact NE2-O 3.34Å; Q349-C411 WeakPolarHBondContact CB-SG 3.47Å
350	M	95.4	Very high	91	Very high	21 Å²	21	35.5 Å²	35.5	10%	0.103	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136	179.5	-81.3	174.6	57.3	0	0	109.4	S302 C304 M313 I357 Y358 L359	S302-M350 WeakPolarHBondContact CB-SD 3.41Å; C304-M350 HydrophobicContact CB-CB 3.73Å; C304-M350 HydrophobicContact CB-CE 4.22Å; C304-M350 WeakPolarHBondContact SG-CE 3.47Å; M313-M350 HydrophobicContact CB-SD 4.07Å; M313-M350 HydrophobicContact CE-CE 3.44Å; M313-M350 VanDerWaalsContact CE-CE 3.44Å; M313-M350 HydrophobicContact CE-SD 4.22Å; M313-M350 HydrophobicContact CG-CE 4.03Å; M313-M350 HydrophobicContact CG-SD 4.03Å; M313-M350 HydrophobicContact SD-CE 4.38Å; M350-I357 HydrophobicContact CE-CG2 3.92Å; M350-Y358 WeakPolarHBondContact CA-O 3.26Å; M350-L359 HydrophobicContact CG-CD2 3.3Å; M350-L359 HydrophobicContact CG-CG 4.41Å; M350-L359 HydrophobicContact SD-CD2 3.75Å
351	L	95.2	Very high	91.1	Very high	17 Å²	17	31.8 Å²	31.8	9%	0.089	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	159.3	177	56.1	99.8	0	0	0	108.5	I357 Y358 V360 C411 L413 V418	L351-I357 CarbonylContact O-C 3.52Å; L351-I357 WeakPolarHBondContact O-CA 3.3Å; L351-Y358 HydrophobicContact CD1-CD2 3.84Å; L351-Y358 HydrophobicContact CD1-CG 3.99Å; L351-Y358 PolarHBondContact N-O 2.94Å; L351-Y358 VanDerWaalsContact N-O 3.15Å; L351-Y358 PolarHBondContact O-N 3.35Å; L351-V360 HydrophobicContact CD2-CG2 4.11Å; L351-C411 HydrophobicContact CD2-CB 4.45Å; L351-C411 WeakPolarHBondContact CD2-SG 3.44Å; L351-L413 HydrophobicContact CB-CD1 4.27Å; L351-L413 HydrophobicContact CD1-CD1 3.73Å; L351-L413 HydrophobicContact CD1-CD2 3.75Å; L351-L413 HydrophobicContact CD1-CG 3.68Å; L351-V418 HydrophobicContact CD1-CG2 3.7Å; L351-V418 HydrophobicContact CD2-CB 4.44Å; L351-V418 HydrophobicContact CD2-CG1 3.51Å; L351-V418 HydrophobicContact CD2-CG2 4.04Å
352	S	94.9	Very high	91.5	Very high	25 Å²	25	30.9 Å²	30.9	18%	0.175	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.6	-179	60	0	0	0	0	111.2	E305 T356 L413	E305-S352 WeakPolarHBondContact O-CB 3.39Å; E305-S352 PolarHBondContact O-OG 3.41Å; S352-T356 CarbonylContact C-O 3.58Å; S352-T356 VanDerWaalsContact CA-O 3.28Å; S352-T356 WeakPolarHBondContact CA-O 3.43Å; S352-L413 WeakPolarHBondContact O-CD1 3.38Å
353	V	93.1	Very high	91.7	Very high	42 Å²	42	28.8 Å²	28.8	26%	0.255	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	119.5	166.3	-177.2	0	0	0	0	105.9	D355 T356 Y358 L413 I441	V353-D355 PolarHBondContact O-N 3.45Å; V353-T356 PolarHBondContact N-O 2.85Å; V353-T356 PolarHBondContact O-N 2.78Å; V353-Y358 HydrophobicContact CB-CE2 4Å; V353-Y358 HydrophobicContact CG2-CD2 4.34Å; V353-Y358 HydrophobicContact CG2-CE2 3.92Å; V353-L413 HydrophobicContact CG2-CD1 3.52Å; V353-L413 HydrophobicContact CG2-CD2 3.64Å; V353-L413 HydrophobicContact CG2-CG 4.23Å; V353-I441 HydrophobicContact CG1-CD1 4.42Å; V353-I441 HydrophobicContact CG2-CD1 4.01Å
354	E	90.5	Very high	91.8	Very high	170 Å²	170	30.1 Å²	30.1	79%	0.794	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	55	-107.4	-176.8	-59	-179.9	167.6	0	0	112.4
355	D	93.3	Very high	91.5	Very high	36 Å²	36	33.6 Å²	33.6	19%	0.193	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	3.4	-179.2	71.6	-15.7	0	0	0	113.5	V353 N389 V390 S391	V353-D355 PolarHBondContact O-N 3.45Å; D355-N389 PolarHBondContact OD1-ND2 2.99Å; D355-N389 PolarHBondContact OD2-ND2 2.8Å; D355-N389 PolarHBondContact OD2-OD1 3.23Å; D355-V390 WeakPolarHBondContact O-CB 3.43Å; D355-V390 WeakPolarHBondContact O-CG2 3.28Å; D355-V390 PolarHBondContact O-N 3.21Å; D355-S391 WeakPolarHBondContact CB-OG 3.44Å; D355-S391 PolarHBondContact OD2-OG 3.22Å
356	T	94.5	Very high	90.9	Very high	21 Å²	21	40.4 Å²	40.4	13%	0.129	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.8	-170.9	-61.3	0	0	0	0	110.7	S352 V353 Y358 Y388 N389	S352-T356 CarbonylContact C-O 3.58Å; S352-T356 VanDerWaalsContact CA-O 3.28Å; S352-T356 WeakPolarHBondContact CA-O 3.43Å; V353-T356 PolarHBondContact N-O 2.85Å; V353-T356 PolarHBondContact O-N 2.78Å; T356-Y358 HydrophobicContact CG2-CD2 4.36Å; T356-Y358 HydrophobicContact CG2-CE2 3.8Å; T356-Y388 WeakPolarHBondContact CA-O 3.05Å; T356-N389 PolarHBondContact OG1-ND2 2.78Å
357	I	95.2	Very high	90.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.6	175.9	-64.5	174.9	0	0	0	108.9	C306 Y311 M313 M350 L351 S387 Y388 V390	C306-I357 HydrophobicContact CB-CD1 4.05Å; C306-I357 HydrophobicContact CB-CG1 3.89Å; Y311-I357 HydrophobicContact CD1-CD1 4.35Å; Y311-I357 HydrophobicContact CD2-CD1 3.91Å; Y311-I357 HydrophobicContact CG-CD1 3.81Å; M313-I357 HydrophobicContact CE-CD1 3.93Å; M313-I357 HydrophobicContact CE-CG2 3.93Å; M350-I357 HydrophobicContact CE-CG2 3.92Å; L351-I357 CarbonylContact O-C 3.52Å; L351-I357 WeakPolarHBondContact O-CA 3.3Å; I357-S387 CarbonylContact O-C 3.6Å; I357-S387 WeakPolarHBondContact O-CA 3.46Å; I357-Y388 PolarHBondContact N-O 3.2Å; I357-Y388 PolarHBondContact O-N 2.86Å; I357-V390 HydrophobicContact CD1-CG2 3.54Å; I357-V390 HydrophobicContact CG1-CG2 3.77Å
358	Y	95	Very high	88.9	Confident	27 Å²	27	44.3 Å²	44.3	11%	0.106	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.2	172.9	-62.9	-97.3	0	0	0	110.6	M350 L351 V353 T356 V385 Q386 L398 I441	M350-Y358 WeakPolarHBondContact CA-O 3.26Å; L351-Y358 HydrophobicContact CD1-CD2 3.84Å; L351-Y358 HydrophobicContact CD1-CG 3.99Å; L351-Y358 PolarHBondContact N-O 2.94Å; L351-Y358 VanDerWaalsContact N-O 3.15Å; L351-Y358 PolarHBondContact O-N 3.35Å; V353-Y358 HydrophobicContact CB-CE2 4Å; V353-Y358 HydrophobicContact CG2-CD2 4.34Å; V353-Y358 HydrophobicContact CG2-CE2 3.92Å; T356-Y358 HydrophobicContact CG2-CD2 4.36Å; T356-Y358 HydrophobicContact CG2-CE2 3.8Å; Y358-V385 HydrophobicContact CD1-CG1 4.14Å; Y358-Q386 CarbonylContact C-O 3.6Å; Y358-Q386 VanDerWaalsContact CA-O 3.25Å; Y358-Q386 WeakPolarHBondContact CA-O 3.37Å; Y358-L398 HydrophobicContact CD1-CD1 4.12Å; Y358-L398 HydrophobicContact CE1-CD1 4.01Å; Y358-I441 HydrophobicContact CD1-CG2 4.44Å; Y358-I441 HydrophobicContact CE1-CB 4.35Å; Y358-I441 HydrophobicContact CE1-CG2 3.94Å
359	L	93.8	Very high	87	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.1	176.1	-64.7	157.4	0	0	0	108	I345 Q349 M350 V385 Q386 W395	I345-L359 HydrophobicContact CD1-CD2 4.04Å; Q349-L359 WeakPolarHBondContact O-CA 3.48Å; M350-L359 HydrophobicContact CG-CD2 3.3Å; M350-L359 HydrophobicContact CG-CG 4.41Å; M350-L359 HydrophobicContact SD-CD2 3.75Å; L359-V385 CarbonylContact O-C 3.59Å; L359-V385 VanDerWaalsContact O-CA 3.3Å; L359-V385 WeakPolarHBondContact O-CA 3.39Å; L359-Q386 HydrophobicContact CB-CB 4.29Å; L359-Q386 PolarHBondContact N-O 2.93Å; L359-Q386 PolarHBondContact O-N 2.87Å; L359-W395 HydrophobicContact CD1-CZ2 4.48Å
360	V	94.3	Very high	84.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.8	-175.6	-177	0	0	0	0	110.5	Q349 L351 L383 V385 V418 I420	Q349-V360 HydrophobicContact CB-CB 4.42Å; Q349-V360 PolarHBondContact N-O 2.82Å; Q349-V360 PolarHBondContact O-N 2.84Å; L351-V360 HydrophobicContact CD2-CG2 4.11Å; V360-L383 HydrophobicContact CG1-CD1 4.25Å; V360-V385 HydrophobicContact CG1-CG2 4.42Å; V360-V385 HydrophobicContact CG2-CG1 4.26Å; V360-V385 HydrophobicContact CG2-CG2 4.34Å; V360-V418 HydrophobicContact CG2-CG1 4.13Å; V360-I420 HydrophobicContact CG1-CD1 3.49Å; V360-I420 VanDerWaalsContact CG1-CD1 3.49Å; V360-I420 HydrophobicContact CG1-CG1 3.92Å; V360-I420 HydrophobicContact CG1-CG2 4.33Å
361	G	92.1	Very high	82.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	63.4	-141.2	175.2	0	0	0	0	0	113.8	Q348 S384 G406	Q348-G361 VanDerWaalsContact CG-O 3.26Å; Q348-G361 WeakPolarHBondContact CG-O 3.4Å; Q348-G361 PolarHBondContact NE2-O 2.83Å; G361-S384 PolarHBondContact N-O 2.92Å; G361-G406 CarbonylContact C-O 3.58Å; G361-G406 WeakPolarHBondContact CA-O 3.37Å
362	G	89	Confident	79.9	Confident	4 Å²	4	72.1 Å²	72.1	4%	0.041	36%	0.363	C	S	.	.	S	Bend	trans	66.2	-162	-174.1	0	0	0	0	0	113.6	R346 G406	R346-G362 WeakPolarHBondContact O-CA 3.36Å; G362-G406 PolarHBondContact N-O 2.81Å
363	Y	84.8	Confident	77.3	Confident	47 Å²	47	77.4 Å²	77.4	18%	0.184	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140.6	178.3	-64.3	-88.9	0	0	0	110.5	I345 R346 K347 E380 D381 L407	I345-Y363 VanDerWaalsContact CA-O 3.3Å; I345-Y363 WeakPolarHBondContact CA-O 2.95Å; R346-Y363 HydrophobicContact CG-CD2 3.97Å; R346-Y363 HydrophobicContact CG-CG 4.26Å; R346-Y363 VanDerWaalsContact CZ-CE2 3.44Å; R346-Y363 PolarHBondContact N-O 3.07Å; R346-Y363 VanDerWaalsContact N-O 3.11Å; R346-Y363 VanDerWaalsContact NH2-CZ 3.34Å; R346-Y363 PolarHBondContact O-N 2.97Å; K347-Y363 HydrophobicContact CD-CD2 4.44Å; K347-Y363 HydrophobicContact CD-CE2 4.16Å; Y363-E380 HydrophobicContact CD1-CB 4.1Å; Y363-E380 WeakPolarHBondContact CD1-O 3.2Å; Y363-E380 HydrophobicContact CE1-CB 4.35Å; Y363-D381 WeakPolarHBondContact CE1-OD1 3.17Å; Y363-L407 HydrophobicContact CD1-CD2 4.26Å; Y363-L407 HydrophobicContact CD2-CD2 3.67Å; Y363-L407 HydrophobicContact CE1-CD1 4.09Å; Y363-L407 HydrophobicContact CE1-CD2 3.91Å; Y363-L407 HydrophobicContact CE2-CD1 4.17Å; Y363-L407 HydrophobicContact CE2-CD2 3.27Å; Y363-L407 HydrophobicContact CE2-CG 4.34Å; Y363-L407 HydrophobicContact CG-CD2 4.17Å; Y363-L407 VanDerWaalsContact CZ-CD2 3.4Å; Y363-L407 WeakPolarHBondContact OH-CD1 3.45Å
364	T	84.5	Confident	74.9	Confident	48 Å²	48	87.9 Å²	87.9	29%	0.294	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.9	177.2	-58.7	0	0	0	0	109.2	V343 I345	V343-T364 HydrophobicContact CG1-CG2 3.29Å; I345-T364 HydrophobicContact CG2-CG2 4.33Å
365	H	81.6	Confident	72.5	Confident	77 Å²	77	89.4 Å²	89.4	36%	0.356	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	113.2	-179.6	-175.1	-65.6	0	0	0	110.5	R321 V343 H344 L367	R321-H365 PolarHBondContact NH1-CE1 2.95Å; R321-H365 VanDerWaalsContact NH1-CE1 3.34Å; R321-H365 PolarHBondContact NH1-ND1 2.87Å; V343-H365 WeakPolarHBondContact CG1-O 3.4Å; H344-H365 HydrophobicContact CB-CB 4.49Å; H344-H365 PolarHBondContact N-O 2.81Å; H344-H365 PolarHBondContact O-N 3.46Å; H365-L367 PolarHBondContact O-N 2.82Å
366	Q	77.8	Confident	69.9	Low	150 Å²	150	93 Å²	93	70%	0.701	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	129.9	173.2	-69.5	-173.7	-7.7	0	0	110.3	V343 E368	V343-Q366 HydrophobicContact CG2-CG 4.35Å; Q366-E368 PolarHBondContact O-N 2.93Å
367	L	72.9	Confident	67.5	Low	72 Å²	72	95.5 Å²	95.5	38%	0.377	46%	0.462	S	S	.	.			trans	-87.2	94.7	178.3	-61.1	168.7	0	0	0	107.5	T323 H344 H365 A369	T323-L367 HydrophobicContact CG2-CD1 3.48Å; T323-L367 VanDerWaalsContact CG2-CD1 3.48Å; H344-L367 HydrophobicContact CB-CD1 4.38Å; H344-L367 HydrophobicContact CB-CD2 4.16Å; H344-L367 HydrophobicContact CB-CG 4.36Å; H365-L367 PolarHBondContact O-N 2.82Å; L367-A369 PolarHBondContact O-N 2.86Å
368	E	65.1	Low	65.1	Low	141 Å²	141	104.1 Å²	104.1	66%	0.659	50%	0.503	S	S	*	.			trans	-59.6	124.6	-178.9	-72.7	-174.2	169.4	0	0	111.9	Q366 G370	Q366-E368 PolarHBondContact O-N 2.93Å; E368-G370 PolarHBondContact O-N 2.82Å; E368-G370 VanDerWaalsContact O-N 3.17Å
369	A	48.9	Very low	63.1	Low	112 Å²	112	107.4 Å²	107.4	93%	0.926	53%	0.525	S	S	*	.			trans	-82.8	78.2	165.9	0	0	0	0	0	110.3	L367	L367-A369 PolarHBondContact O-N 2.86Å
370	G	44.3	Very low	61.5	Low	59 Å²	59	110.7 Å²	110.7	61%	0.608	54%	0.541	S	S	*	.	S	Bend	trans	107.2	125.1	159.7	0	0	0	0	0	118.2	E368	E368-G370 PolarHBondContact O-N 2.82Å; E368-G370 VanDerWaalsContact O-N 3.17Å
371	R	44.7	Very low	60.4	Low	242 Å²	242	114.1 Å²	114.1	91%	0.913	56%	0.559	S	S	*	*	S	Bend	trans	42.7	110.4	159.3	-71.9	-175.9	177.6	178.3	1	119.6
372	R	48	Very low	60.1	Low	237 Å²	237	115.5 Å²	115.5	89%	0.894	57%	0.568	S	S	*	*			trans	56.4	83.3	142.6	-70.7	-176	173.8	177.4	-1.9	116.1
373	Q	39.6	Very low	60.1	Low	137 Å²	137	115.3 Å²	115.3	64%	0.64	57%	0.566	S	S	*	*			trans	-149.7	101.6	134.9	-107.3	175	26.7	0	0	110.1	R375	Q373-R375 PolarHBondContact O-N 3.09Å
374	R	44.1	Very low	60.4	Low	262 Å²	262	113.6 Å²	113.6	99%	0.989	56%	0.56	S	S	*	*			trans	-73.2	81.8	169.1	-128.2	-178.4	176	179.2	-2.4	107.8
375	R	38.6	Very low	60.7	Low	202 Å²	202	111.3 Å²	111.3	76%	0.762	55%	0.546	S	S	*	.			trans	-86.1	135.6	155	-74.7	-172.9	179.1	-169.8	0.2	107.1	Q373 S377	Q373-R375 PolarHBondContact O-N 3.09Å; R375-S377 PolarHBondContact O-N 2.85Å
376	P	39.2	Very low	61.2	Low	111 Å²	111	108.2 Å²	108.2	72%	0.721	53%	0.532	S	S	*	.			trans	-60.3	126.5	170.8	-10.4	24.7	0	0	0	107.8	Q378	P376-Q378 PolarHBondContact O-N 2.88Å
377	S	45.2	Very low	61.9	Low	73 Å²	73	101.6 Å²	101.6	51%	0.51	50%	0.502	S	S	.	.			trans	-60.9	94.6	176.5	38.9	0	0	0	0	110.1	R375 T379 E380	R375-S377 PolarHBondContact O-N 2.85Å; S377-T379 PolarHBondContact O-N 3.09Å; S377-E380 VanDerWaalsContact CB-OE1 3.26Å; S377-E380 WeakPolarHBondContact CB-OE1 3.34Å; S377-E380 VanDerWaalsContact OG-CD 3.25Å; S377-E380 PolarHBondContact OG-OE1 3.11Å
378	Q	44.2	Very low	62.7	Low	182 Å²	182	99 Å²	99	85%	0.85	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	15.5	-173.4	-90.2	-174.6	-12.1	0	0	115.3	P376	P376-Q378 PolarHBondContact O-N 2.88Å
379	T	53	Low	64	Low	95 Å²	95	93.6 Å²	93.6	58%	0.583	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.3	15.6	-175.2	36.3	0	0	0	0	114.6	S377 D381	S377-T379 PolarHBondContact O-N 3.09Å; T379-D381 VanDerWaalsContact C-N 3.26Å; T379-D381 PolarHBondContact O-N 3.2Å
380	E	60.5	Low	66	Low	73 Å²	73	88.9 Å²	88.9	34%	0.341	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-22.8	-169.7	-70.5	-167.5	178	0	0	114.8	Y363 S377	Y363-E380 HydrophobicContact CD1-CB 4.1Å; Y363-E380 WeakPolarHBondContact CD1-O 3.2Å; Y363-E380 HydrophobicContact CE1-CB 4.35Å; S377-E380 VanDerWaalsContact CB-OE1 3.26Å; S377-E380 WeakPolarHBondContact CB-OE1 3.34Å; S377-E380 VanDerWaalsContact OG-CD 3.25Å; S377-E380 PolarHBondContact OG-OE1 3.11Å
381	D	70.8	Confident	68.2	Low	72 Å²	72	89.8 Å²	89.8	39%	0.385	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	8.9	-172.5	-61.6	-15	0	0	0	113.4	Y363 T379 S405 G406 L407	Y363-D381 WeakPolarHBondContact CE1-OD1 3.17Å; T379-D381 VanDerWaalsContact C-N 3.26Å; T379-D381 PolarHBondContact O-N 3.2Å; D381-S405 CarbonylContact O-C 3.5Å; D381-S405 WeakPolarHBondContact O-CA 3.31Å; D381-G406 PolarHBondContact O-N 3.18Å; D381-L407 HydrophobicContact CB-CD1 4.28Å; D381-L407 HydrophobicContact CB-CG 4.46Å; D381-L407 WeakPolarHBondContact OD1-CD1 3.35Å
382	V	85.1	Confident	70.4	Confident	30 Å²	30	82.9 Å²	82.9	18%	0.182	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	136.1	-177.9	175.9	0	0	0	0	111	S384 E400 N401 T402	V382-S384 PolarHBondContact O-N 2.6Å; V382-S384 VanDerWaalsContact O-N 3.13Å; V382-E400 HydrophobicContact CG1-CB 4.34Å; V382-N401 WeakPolarHBondContact CG1-O 3.23Å; V382-T402 HydrophobicContact CG1-CG2 4.41Å
383	L	89.4	Confident	72.1	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	110.4	172.3	176.8	62.1	0	0	0	110.2	V360 N401 K404 L409 I420 V435 L437 W446	V360-L383 HydrophobicContact CG1-CD1 4.25Å; L383-N401 HydrophobicContact CB-CB 4.22Å; L383-N401 HydrophobicContact CD2-CB 4.24Å; L383-N401 HydrophobicContact CG-CB 4.35Å; L383-N401 PolarHBondContact O-N 3.14Å; L383-K404 HydrophobicContact CB-CB 4.14Å; L383-K404 WeakPolarHBondContact CB-O 3.34Å; L383-K404 HydrophobicContact CD2-CB 4.07Å; L383-K404 PolarHBondContact N-O 2.91Å; L383-L409 HydrophobicContact CD1-CD1 3.55Å; L383-I420 HydrophobicContact CD1-CG2 4.45Å; L383-V435 HydrophobicContact CD2-CG1 3.91Å; L383-L437 HydrophobicContact CD2-CD1 3.68Å; L383-W446 HydrophobicContact CD1-CH2 4.07Å; L383-W446 HydrophobicContact CD2-CE3 4.46Å; L383-W446 HydrophobicContact CD2-CH2 3.55Å; L383-W446 HydrophobicContact CD2-CZ2 4.33Å; L383-W446 HydrophobicContact CD2-CZ3 3.61Å; L383-W446 HydrophobicContact CG-CH2 3.54Å; L383-W446 HydrophobicContact CG-CZ2 4.08Å; L383-W446 HydrophobicContact CG-CZ3 4.16Å
384	S	90.4	Very high	74.3	Confident	10 Å²	10	72 Å²	72	7%	0.07	37%	0.373	C	S	.	.			trans	-124.2	156.8	177.6	56.2	0	0	0	0	111.1	G361 V382	G361-S384 PolarHBondContact N-O 2.92Å; V382-S384 PolarHBondContact O-N 2.6Å; V382-S384 VanDerWaalsContact O-N 3.13Å
385	V	90.8	Very high	76.5	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.2	169.1	-173.1	0	0	0	0	107.8	Y358 L359 V360 L398 Y439 W446	Y358-V385 HydrophobicContact CD1-CG1 4.14Å; L359-V385 CarbonylContact O-C 3.59Å; L359-V385 VanDerWaalsContact O-CA 3.3Å; L359-V385 WeakPolarHBondContact O-CA 3.39Å; V360-V385 HydrophobicContact CG1-CG2 4.42Å; V360-V385 HydrophobicContact CG2-CG1 4.26Å; V360-V385 HydrophobicContact CG2-CG2 4.34Å; V385-L398 HydrophobicContact CB-CB 4.4Å; V385-L398 HydrophobicContact CB-CD1 4.35Å; V385-L398 HydrophobicContact CG1-CD1 3.87Å; V385-L398 VanDerWaalsContact O-CB 3.31Å; V385-L398 WeakPolarHBondContact O-CB 3.43Å; V385-L398 PolarHBondContact O-N 3.16Å; V385-Y439 HydrophobicContact CB-CD1 4.41Å; V385-Y439 HydrophobicContact CB-CE1 4.3Å; V385-Y439 HydrophobicContact CG1-CD1 4.14Å; V385-Y439 HydrophobicContact CG1-CE1 4.01Å; V385-Y439 HydrophobicContact CG2-CD1 4.13Å; V385-Y439 HydrophobicContact CG2-CD2 4.14Å; V385-Y439 HydrophobicContact CG2-CE1 4.48Å; V385-Y439 HydrophobicContact CG2-CE2 4.48Å; V385-Y439 HydrophobicContact CG2-CG 3.96Å; V385-W446 HydrophobicContact CG2-CH2 3.68Å; V385-W446 HydrophobicContact CG2-CZ2 3.73Å
386	Q	91.8	Very high	78.9	Confident	13 Å²	13	57.9 Å²	57.9	6%	0.061	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145	174.4	-54.5	170.7	18.4	0	0	108.2	Y358 L359 W395 I396	Y358-Q386 CarbonylContact C-O 3.6Å; Y358-Q386 VanDerWaalsContact CA-O 3.25Å; Y358-Q386 WeakPolarHBondContact CA-O 3.37Å; L359-Q386 HydrophobicContact CB-CB 4.29Å; L359-Q386 PolarHBondContact N-O 2.93Å; L359-Q386 PolarHBondContact O-N 2.87Å; Q386-W395 VanDerWaalsContact OE1-CE2 3.31Å; Q386-I396 CarbonylContact C-O 3.55Å; Q386-I396 WeakPolarHBondContact CA-O 3.43Å
387	S	92.3	Very high	81.2	Confident	11 Å²	11	58.6 Å²	58.6	8%	0.077	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.6	175.3	58	0	0	0	0	110.5	I357 I396	I357-S387 CarbonylContact O-C 3.6Å; I357-S387 WeakPolarHBondContact O-CA 3.46Å; S387-I396 PolarHBondContact N-O 2.76Å; S387-I396 PolarHBondContact O-N 3.29Å
388	Y	91.8	Very high	83.3	Confident	17 Å²	17	56.3 Å²	56.3	7%	0.067	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	115.7	177.6	175.5	-96.7	0	0	0	109.1	F338 Q339 T356 I357 V390 E394 W395	F338-Y388 AromaticContact CE1-CE1 3.9Å; F338-Y388 HydrophobicContact CE1-CE1 3.9Å; F338-Y388 VanDerWaalsContact CE1-OH 3.28Å; F338-Y388 WeakPolarHBondContact CE1-OH 3.43Å; Q339-Y388 PolarHBondContact OE1-OH 3.25Å; T356-Y388 WeakPolarHBondContact CA-O 3.05Å; I357-Y388 PolarHBondContact N-O 3.2Å; I357-Y388 PolarHBondContact O-N 2.86Å; Y388-V390 HydrophobicContact CD1-CG2 4.18Å; Y388-V390 HydrophobicContact CE1-CG2 4.14Å; Y388-E394 WeakPolarHBondContact CA-O 3.26Å; Y388-W395 HydrophobicContact CD2-CB 4.15Å; Y388-W395 HydrophobicContact CD2-CG 4.29Å
389	N	92.1	Very high	85.4	Confident	27 Å²	27	53.2 Å²	53.2	14%	0.144	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	119.2	178.2	-177.8	-67.4	0	0	0	109.6	D355 T356 S391 T392 G393 E394	D355-N389 PolarHBondContact OD1-ND2 2.99Å; D355-N389 PolarHBondContact OD2-ND2 2.8Å; D355-N389 PolarHBondContact OD2-OD1 3.23Å; T356-N389 PolarHBondContact OG1-ND2 2.78Å; N389-S391 VanDerWaalsContact C-N 3.31Å; N389-S391 PolarHBondContact O-N 2.9Å; N389-S391 WeakPolarHBondContact OD1-CA 3.29Å; N389-S391 WeakPolarHBondContact OD1-CB 3.24Å; N389-S391 PolarHBondContact OD1-N 2.76Å; N389-T392 VanDerWaalsContact CB-OG1 3.32Å; N389-T392 WeakPolarHBondContact CB-OG1 3.12Å; N389-T392 VanDerWaalsContact CG-OG1 3.28Å; N389-T392 PolarHBondContact OD1-N 2.75Å; N389-T392 PolarHBondContact OD1-OG1 3.18Å; N389-G393 VanDerWaalsContact O-CA 3.25Å; N389-G393 WeakPolarHBondContact O-CA 3.28Å; N389-G393 PolarHBondContact O-N 3.2Å; N389-E394 PolarHBondContact N-O 3.44Å
390	V	90.8	Very high	87	Confident	14 Å²	14	52 Å²	52	9%	0.085	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-26.9	-174	179.6	0	0	0	0	112	Y311 F338 D355 I357 Y388	Y311-V390 HydrophobicContact CE1-CG1 4.13Å; Y311-V390 HydrophobicContact CE2-CG1 4.36Å; Y311-V390 WeakPolarHBondContact OH-CG1 3.38Å; F338-V390 HydrophobicContact CE1-CG1 4.23Å; F338-V390 HydrophobicContact CE2-CG1 4.35Å; F338-V390 HydrophobicContact CZ-CG1 3.69Å; D355-V390 WeakPolarHBondContact O-CB 3.43Å; D355-V390 WeakPolarHBondContact O-CG2 3.28Å; D355-V390 PolarHBondContact O-N 3.21Å; I357-V390 HydrophobicContact CD1-CG2 3.54Å; I357-V390 HydrophobicContact CG1-CG2 3.77Å; Y388-V390 HydrophobicContact CD1-CG2 4.18Å; Y388-V390 HydrophobicContact CE1-CG2 4.14Å
391	S	90.6	Very high	88.2	Confident	77 Å²	77	49.6 Å²	49.6	54%	0.538	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-39.2	-178.1	-52.4	0	0	0	0	112.4	Q307 D355 N389	Q307-S391 PolarHBondContact NE2-OG 3.47Å; D355-S391 WeakPolarHBondContact CB-OG 3.44Å; D355-S391 PolarHBondContact OD2-OG 3.22Å; N389-S391 VanDerWaalsContact C-N 3.31Å; N389-S391 PolarHBondContact O-N 2.9Å; N389-S391 WeakPolarHBondContact OD1-CA 3.29Å; N389-S391 WeakPolarHBondContact OD1-CB 3.24Å; N389-S391 PolarHBondContact OD1-N 2.76Å
392	T	89.6	Confident	88.9	Confident	97 Å²	97	51.8 Å²	51.8	60%	0.595	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-22.9	-177.6	62.3	0	0	0	0	113.1	N389 E394	N389-T392 VanDerWaalsContact CB-OG1 3.32Å; N389-T392 WeakPolarHBondContact CB-OG1 3.12Å; N389-T392 VanDerWaalsContact CG-OG1 3.28Å; N389-T392 PolarHBondContact OD1-N 2.75Å; N389-T392 PolarHBondContact OD1-OG1 3.18Å; T392-E394 WeakPolarHBondContact OG1-CB 3.31Å; T392-E394 PolarHBondContact OG1-N 3.34Å
393	G	83.6	Confident	88.8	Confident	32 Å²	32	54 Å²	54	33%	0.33	29%	0.293	S	S	.	.			trans	74.8	10.8	-171.8	0	0	0	0	0	113.8	N389	N389-G393 VanDerWaalsContact O-CA 3.25Å; N389-G393 WeakPolarHBondContact O-CA 3.28Å; N389-G393 PolarHBondContact O-N 3.2Å
394	E	87.5	Confident	88.8	Confident	114 Å²	114	56.4 Å²	56.4	53%	0.533	30%	0.304	S	S	.	.			trans	-75	134.4	180	-169.9	176.8	-178.5	0	0	111.3	Y388 N389 T392 I396	Y388-E394 WeakPolarHBondContact CA-O 3.26Å; N389-E394 PolarHBondContact N-O 3.44Å; T392-E394 WeakPolarHBondContact OG1-CB 3.31Å; T392-E394 PolarHBondContact OG1-N 3.34Å; E394-I396 HydrophobicContact CG-CD1 4.38Å; E394-I396 HydrophobicContact CG-CG1 4.06Å
395	W	88.6	Confident	88.7	Confident	94 Å²	94	56 Å²	56	36%	0.356	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123	177.6	-161.6	11.3	0	0	0	110.1	P342 V343 L359 Q386 Y388	P342-W395 HydrophobicContact CG-CZ3 4.48Å; V343-W395 HydrophobicContact CB-CH2 4.19Å; V343-W395 HydrophobicContact CG2-CH2 4.34Å; V343-W395 HydrophobicContact CG2-CZ3 4.43Å; L359-W395 HydrophobicContact CD1-CZ2 4.48Å; Q386-W395 VanDerWaalsContact OE1-CE2 3.31Å; Y388-W395 HydrophobicContact CD2-CB 4.15Å; Y388-W395 HydrophobicContact CD2-CG 4.29Å
396	I	90.2	Very high	88.5	Confident	73 Å²	73	56.1 Å²	56.1	37%	0.374	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.8	-176.8	-52.8	175	0	0	0	108.7	Q386 S387 E394 L398	Q386-I396 CarbonylContact C-O 3.55Å; Q386-I396 WeakPolarHBondContact CA-O 3.43Å; S387-I396 PolarHBondContact N-O 2.76Å; S387-I396 PolarHBondContact O-N 3.29Å; E394-I396 HydrophobicContact CG-CD1 4.38Å; E394-I396 HydrophobicContact CG-CG1 4.06Å; I396-L398 HydrophobicContact CG2-CD2 3.86Å
397	Q	87.8	Confident	88.3	Confident	126 Å²	126	56.3 Å²	56.3	59%	0.589	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	121.5	168.9	-174.8	172.8	-8.8	0	0	108.4	E400	Q397-E400 PolarHBondContact NE2-OE1 3.36Å
398	L	88.9	Confident	88.1	Confident	26 Å²	26	58.4 Å²	58.4	14%	0.136	31%	0.314	C	S	.	.			trans	-94.4	176.5	-177.8	-54.6	174.8	0	0	0	110.8	Y358 V385 I396 E400 Y439	Y358-L398 HydrophobicContact CD1-CD1 4.12Å; Y358-L398 HydrophobicContact CE1-CD1 4.01Å; V385-L398 HydrophobicContact CB-CB 4.4Å; V385-L398 HydrophobicContact CB-CD1 4.35Å; V385-L398 HydrophobicContact CG1-CD1 3.87Å; V385-L398 VanDerWaalsContact O-CB 3.31Å; V385-L398 WeakPolarHBondContact O-CB 3.43Å; V385-L398 PolarHBondContact O-N 3.16Å; I396-L398 HydrophobicContact CG2-CD2 3.86Å; L398-E400 PolarHBondContact O-N 2.8Å; L398-Y439 VanDerWaalsContact CB-OH 3.23Å; L398-Y439 WeakPolarHBondContact CB-OH 3.42Å; L398-Y439 HydrophobicContact CD1-CE1 3.82Å; L398-Y439 VanDerWaalsContact CD1-OH 3.24Å; L398-Y439 WeakPolarHBondContact CD1-OH 3.41Å
399	K	87.1	Confident	88.1	Confident	116 Å²	116	57.7 Å²	57.7	50%	0.504	31%	0.311	S	S	.	.			trans	-56.8	125.7	-175.7	-172.9	174.1	-174.7	173	0	112.2	D444 W446	K399-D444 WeakPolarHBondContact CB-OD1 3.49Å; K399-D444 WeakPolarHBondContact CD-O 3.16Å; K399-D444 PolarHBondContact N-OD1 3.24Å; K399-W446 PolarHBondContact O-NE1 2.84Å
400	E	87.7	Confident	88.2	Confident	69 Å²	69	56.8 Å²	56.8	32%	0.322	31%	0.306	S	S	.	.			trans	-82.8	154.7	177.7	-61.5	-175.1	163.3	0	0	112.8	V382 Q397 L398	V382-E400 HydrophobicContact CG1-CB 4.34Å; Q397-E400 PolarHBondContact NE2-OE1 3.36Å; L398-E400 PolarHBondContact O-N 2.8Å
401	N	86.6	Confident	88.4	Confident	23 Å²	23	57.1 Å²	57.1	12%	0.123	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	93.1	168.5	-169.1	-37.3	0	0	0	110.6	V382 L383 S403 K404 L437 W446	V382-N401 WeakPolarHBondContact CG1-O 3.23Å; L383-N401 HydrophobicContact CB-CB 4.22Å; L383-N401 HydrophobicContact CD2-CB 4.24Å; L383-N401 HydrophobicContact CG-CB 4.35Å; L383-N401 PolarHBondContact O-N 3.14Å; N401-S403 PolarHBondContact O-N 3.2Å; N401-S403 VanDerWaalsContact O-N 3.14Å; N401-S403 PolarHBondContact OD1-N 2.85Å; N401-S403 VanDerWaalsContact OD1-N 3.12Å; N401-S403 PolarHBondContact OD1-OG 3.09Å; N401-K404 PolarHBondContact O-N 3.47Å; N401-L437 VanDerWaalsContact ND2-CD1 3.32Å; N401-L437 WeakPolarHBondContact ND2-CD1 3.35Å; N401-W446 HydrophobicContact CB-CD2 4.09Å; N401-W446 HydrophobicContact CB-CG 4.41Å; N401-W446 HydrophobicContact CB-CZ2 4.12Å
402	T	85	Confident	88.6	Confident	118 Å²	118	54.7 Å²	54.7	72%	0.724	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	-8.3	-177.9	57.7	0	0	0	0	114.6	V382	V382-T402 HydrophobicContact CG1-CG2 4.41Å
403	S	83.2	Confident	88.8	Confident	76 Å²	76	52.5 Å²	52.5	53%	0.531	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-8	-178.6	74.2	0	0	0	0	114	N401	N401-S403 PolarHBondContact O-N 3.2Å; N401-S403 VanDerWaalsContact O-N 3.14Å; N401-S403 PolarHBondContact OD1-N 2.85Å; N401-S403 VanDerWaalsContact OD1-N 3.12Å; N401-S403 PolarHBondContact OD1-OG 3.09Å
404	K	88.3	Confident	89.2	Confident	51 Å²	51	51.2 Å²	51.2	22%	0.222	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.5	-172	-67.6	-61.5	-179.8	169	0	112.2	L383 N401 L431 D432 R434 V435 L437	L383-K404 HydrophobicContact CB-CB 4.14Å; L383-K404 WeakPolarHBondContact CB-O 3.34Å; L383-K404 HydrophobicContact CD2-CB 4.07Å; L383-K404 PolarHBondContact N-O 2.91Å; N401-K404 PolarHBondContact O-N 3.47Å; K404-L431 PolarHBondContact NZ-O 2.84Å; K404-D432 WeakPolarHBondContact CA-O 3.17Å; K404-D432 WeakPolarHBondContact CD-O 3.36Å; K404-R434 PolarHBondContact NZ-O 2.8Å; K404-V435 HydrophobicContact CB-CG2 4.16Å; K404-V435 HydrophobicContact CD-CG2 4.41Å; K404-L437 HydrophobicContact CG-CD1 4.03Å
405	S	88.4	Confident	89.2	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	135.3	176.6	-174.1	0	0	0	0	111.4	D381 L407 D432 H433 V435	D381-S405 CarbonylContact O-C 3.5Å; D381-S405 WeakPolarHBondContact O-CA 3.31Å; S405-L407 PolarHBondContact O-N 3.32Å; S405-L407 WeakPolarHBondContact OG-CB 3.11Å; S405-L407 PolarHBondContact OG-N 3.25Å; S405-D432 PolarHBondContact N-O 3.29Å; S405-H433 WeakPolarHBondContact CB-ND1 3.45Å; S405-H433 PolarHBondContact OG-CE1 2.84Å; S405-H433 PolarHBondContact OG-ND1 3.26Å; S405-V435 WeakPolarHBondContact O-CG2 3.14Å
406	G	86.3	Confident	88.9	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.01	26%	0.259	C	S	.	.			trans	-76.5	0.5	169.6	0	0	0	0	0	113.6	G361 G362 D381 L409	G361-G406 CarbonylContact C-O 3.58Å; G361-G406 WeakPolarHBondContact CA-O 3.37Å; G362-G406 PolarHBondContact N-O 2.81Å; D381-G406 PolarHBondContact O-N 3.18Å; G406-L409 VanDerWaalsContact C-CD1 3.49Å; G406-L409 WeakPolarHBondContact O-CD1 3.43Å
407	L	87.8	Confident	89	Confident	18 Å²	18	45.3 Å²	45.3	9%	0.094	24%	0.241	C	C	.	.	S	Bend	trans	-100.6	155.8	-169.7	-56.5	-177.9	0	0	0	113.5	Y363 D381 S405 L409	Y363-L407 HydrophobicContact CD1-CD2 4.26Å; Y363-L407 HydrophobicContact CD2-CD2 3.67Å; Y363-L407 HydrophobicContact CE1-CD1 4.09Å; Y363-L407 HydrophobicContact CE1-CD2 3.91Å; Y363-L407 HydrophobicContact CE2-CD1 4.17Å; Y363-L407 HydrophobicContact CE2-CD2 3.27Å; Y363-L407 HydrophobicContact CE2-CG 4.34Å; Y363-L407 HydrophobicContact CG-CD2 4.17Å; Y363-L407 VanDerWaalsContact CZ-CD2 3.4Å; Y363-L407 WeakPolarHBondContact OH-CD1 3.45Å; D381-L407 HydrophobicContact CB-CD1 4.28Å; D381-L407 HydrophobicContact CB-CG 4.46Å; D381-L407 WeakPolarHBondContact OD1-CD1 3.35Å; S405-L407 PolarHBondContact O-N 3.32Å; S405-L407 WeakPolarHBondContact OG-CB 3.11Å; S405-L407 PolarHBondContact OG-N 3.25Å; L407-L409 WeakPolarHBondContact O-CD2 3.44Å; L407-L409 WeakPolarHBondContact O-CG 3.42Å; L407-L409 PolarHBondContact O-N 2.85Å
408	N	87.6	Confident	89.3	Confident	54 Å²	54	39.3 Å²	39.3	29%	0.289	21%	0.213	S	C	.	.	S	Bend	trans	53.6	49.7	177.1	-163.1	27	0	0	0	113.4	S422 R423 D424	N408-S422 CarbonylContact O-C 3.49Å; N408-S422 VanDerWaalsContact O-CA 3.31Å; N408-S422 WeakPolarHBondContact O-CA 3.38Å; N408-R423 PolarHBondContact O-N 3.27Å; N408-R423 PolarHBondContact OD1-NE 2.82Å; N408-D424 VanDerWaalsContact ND2-CB 3.28Å; N408-D424 WeakPolarHBondContact ND2-CB 3.42Å; N408-D424 PolarHBondContact ND2-N 3.06Å; N408-D424 VanDerWaalsContact ND2-N 3.16Å; N408-D424 PolarHBondContact ND2-OD2 3.21Å; N408-D424 PolarHBondContact OD1-OD2 3.3Å
409	L	92.5	Very high	89.6	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	152.4	-175.1	-55.2	176.5	0	0	0	112.1	Q349 L383 G406 L407 I420 M421 R423 V435	Q349-L409 VanDerWaalsContact CD-O 3.27Å; Q349-L409 HydrophobicContact CG-CB 4.41Å; Q349-L409 WeakPolarHBondContact CG-O 3.49Å; Q349-L409 PolarHBondContact NE2-O 3.34Å; L383-L409 HydrophobicContact CD1-CD1 3.55Å; G406-L409 VanDerWaalsContact C-CD1 3.49Å; G406-L409 WeakPolarHBondContact O-CD1 3.43Å; L407-L409 WeakPolarHBondContact O-CD2 3.44Å; L407-L409 WeakPolarHBondContact O-CG 3.42Å; L407-L409 PolarHBondContact O-N 2.85Å; L409-I420 HydrophobicContact CB-CG2 4.33Å; L409-I420 HydrophobicContact CD1-CG2 3.89Å; L409-I420 HydrophobicContact CD2-CG2 4.13Å; L409-I420 HydrophobicContact CG-CG2 4.34Å; L409-M421 CarbonylContact C-O 3.57Å; L409-M421 WeakPolarHBondContact CA-O 3.22Å; L409-R423 VanDerWaalsContact C-CG 3.49Å; L409-R423 WeakPolarHBondContact O-CD 3.36Å; L409-V435 HydrophobicContact CD2-CB 3.86Å; L409-V435 HydrophobicContact CD2-CG1 4.17Å; L409-V435 HydrophobicContact CD2-CG2 3.87Å
410	T	93.6	Very high	89.9	Confident	7 Å²	7	33.3 Å²	33.3	4%	0.043	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149.7	158	-179.8	0	0	0	0	107.2	M421 R423 M459 L461	T410-M421 HydrophobicContact CG2-CB 3.98Å; T410-M421 HydrophobicContact CG2-CE 3.64Å; T410-M421 WeakPolarHBondContact CG2-O 3.45Å; T410-M421 PolarHBondContact N-O 2.84Å; T410-M421 PolarHBondContact O-N 3.31Å; T410-M421 VanDerWaalsContact O-O 3.13Å; T410-R423 HydrophobicContact CG2-CG 4.03Å; T410-M459 WeakPolarHBondContact CG2-O 3.39Å; T410-L461 HydrophobicContact CG2-CB 3.83Å; T410-L461 PolarHBondContact OG1-N 2.54Å
411	C	94.8	Very high	90.2	Very high	21 Å²	21	30.2 Å²	30.2	14%	0.142	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	157.6	175.2	63.2	0	0	0	0	111.2	Q349 L351 V418 Y419 I420	Q349-C411 WeakPolarHBondContact CB-SG 3.47Å; L351-C411 HydrophobicContact CD2-CB 4.45Å; L351-C411 WeakPolarHBondContact CD2-SG 3.44Å; C411-V418 HydrophobicContact CB-CG1 4Å; C411-Y419 CarbonylContact C-O 3.57Å; C411-Y419 WeakPolarHBondContact CA-O 3.17Å; C411-Y419 WeakPolarHBondContact CB-O 3.49Å; C411-I420 HydrophobicContact CB-CG1 3.95Å
412	T	95.6	Very high	90.4	Very high	26 Å²	26	29.2 Å²	29.2	16%	0.16	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	154.9	175	-157.5	0	0	0	0	109.6	L161 Y419 L461	L161-T412 HydrophobicContact CD2-CG2 3.57Å; T412-Y419 PolarHBondContact N-O 3.42Å; T412-Y419 PolarHBondContact O-N 3.31Å; T412-L461 HydrophobicContact CG2-CD2 3.89Å; T412-L461 HydrophobicContact CG2-CG 3.69Å
413	L	93.9	Very high	90.7	Very high	52 Å²	52	27.1 Å²	27.1	27%	0.272	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	133.4	167.3	-76.6	161	0	0	0	109.2	L351 S352 V353 V418 S463	L351-L413 HydrophobicContact CB-CD1 4.27Å; L351-L413 HydrophobicContact CD1-CD1 3.73Å; L351-L413 HydrophobicContact CD1-CD2 3.75Å; L351-L413 HydrophobicContact CD1-CG 3.68Å; S352-L413 WeakPolarHBondContact O-CD1 3.38Å; V353-L413 HydrophobicContact CG2-CD1 3.52Å; V353-L413 HydrophobicContact CG2-CD2 3.64Å; V353-L413 HydrophobicContact CG2-CG 4.23Å; L413-V418 HydrophobicContact CD2-CG2 3.73Å; L413-S463 VanDerWaalsContact O-CB 3.31Å; L413-S463 WeakPolarHBondContact O-CB 3.39Å
414	H	92.6	Very high	91	Very high	4 Å²	4	25.7 Å²	25.7	2%	0.019	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	128.5	174.8	-178	74.7	0	0	0	109.4	A159 L161 E188 D416 G417 Y419 S463	A159-H414 VanDerWaalsContact C-CE1 3.48Å; A159-H414 PolarHBondContact O-CE1 2.9Å; L161-H414 HydrophobicContact CD1-CB 4.45Å; L161-H414 HydrophobicContact CD2-CB 3.45Å; L161-H414 VanDerWaalsContact CD2-CB 3.45Å; L161-H414 HydrophobicContact CG-CB 3.96Å; L161-H414 VanDerWaalsContact CG-CD2 3.48Å; L161-H414 WeakPolarHBondContact CG-CD2 3.49Å; E188-H414 IonicContact OE1-CD2 2.69Å; E188-H414 IonicContact OE1-NE2 3.17Å; E188-H414 PolarHBondContact OE1-NE2 2.91Å; H414-D416 PolarHBondContact O-N 3.13Å; H414-G417 PolarHBondContact N-O 2.94Å; H414-G417 PolarHBondContact O-N 3.38Å; H414-G417 VanDerWaalsContact O-N 3.12Å; H414-G417 VanDerWaalsContact O-O 3.09Å; H414-Y419 HydrophobicContact CB-CD2 3.71Å; H414-Y419 HydrophobicContact CB-CE2 3.82Å; H414-Y419 AromaticContact CD2-CE2 3.84Å; H414-Y419 WeakPolarHBondContact O-CE2 3.12Å; H414-S463 PolarHBondContact ND1-OG 3.09Å
415	N	86.9	Confident	90.9	Very high	100 Å²	100	23.4 Å²	23.4	54%	0.535	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	-111.1	-175.5	-62.2	-23.7	0	0	0	111.8	E188	E188-N415 PolarHBondContact OE1-ND2 3.3Å
416	D	83.3	Confident	90.7	Very high	57 Å²	57	24.4 Å²	24.4	31%	0.305	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	11.6	-173.2	66.9	-40.5	0	0	0	113.9	H414 K438 N440 F442	H414-D416 PolarHBondContact O-N 3.13Å; D416-K438 WeakPolarHBondContact OD1-CE 3.16Å; D416-K438 IonicContact OD1-NZ 3.38Å; D416-K438 PolarHBondContact OD1-NZ 2.82Å; D416-K438 IonicContact OD2-NZ 3.91Å; D416-K438 PolarHBondContact OD2-NZ 2.87Å; D416-N440 PolarHBondContact OD2-ND2 2.76Å; D416-N440 VanDerWaalsContact OD2-ND2 3.16Å; D416-F442 HydrophobicContact CB-CD2 4.23Å; D416-F442 HydrophobicContact CB-CE2 4.12Å
417	G	91.4	Very high	90.6	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	170.7	-175.5	0	0	0	0	0	116.6	H414 Y439	H414-G417 PolarHBondContact N-O 2.94Å; H414-G417 PolarHBondContact O-N 3.38Å; H414-G417 VanDerWaalsContact O-N 3.12Å; H414-G417 VanDerWaalsContact O-O 3.09Å; G417-Y439 CarbonylContact C-O 3.52Å; G417-Y439 VanDerWaalsContact CA-O 3.27Å; G417-Y439 WeakPolarHBondContact CA-O 3.06Å
418	V	94.6	Very high	90.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	112.6	172.6	-178.8	0	0	0	0	108.2	L351 V360 C411 L413 I420 K438 Y439 I441	L351-V418 HydrophobicContact CD1-CG2 3.7Å; L351-V418 HydrophobicContact CD2-CB 4.44Å; L351-V418 HydrophobicContact CD2-CG1 3.51Å; L351-V418 HydrophobicContact CD2-CG2 4.04Å; V360-V418 HydrophobicContact CG2-CG1 4.13Å; C411-V418 HydrophobicContact CB-CG1 4Å; L413-V418 HydrophobicContact CD2-CG2 3.73Å; V418-I420 HydrophobicContact CG1-CD1 4.15Å; V418-I420 HydrophobicContact CG1-CG1 3.82Å; V418-K438 CarbonylContact O-C 3.57Å; V418-K438 WeakPolarHBondContact O-CA 3.26Å; V418-Y439 PolarHBondContact N-O 2.94Å; V418-Y439 PolarHBondContact O-N 2.83Å; V418-I441 HydrophobicContact CG2-CG2 3.86Å
419	Y	94.4	Very high	90.3	Very high	14 Å²	14	35.5 Å²	35.5	6%	0.055	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	132.5	174.2	-73.1	-106.6	0	0	0	109.2	L161 C411 T412 H414 K438 F449 L461	L161-Y419 HydrophobicContact CD1-CD1 3.3Å; L161-Y419 HydrophobicContact CD1-CD2 4.03Å; L161-Y419 HydrophobicContact CD1-CE1 3.32Å; L161-Y419 HydrophobicContact CD1-CE2 4.07Å; L161-Y419 HydrophobicContact CD1-CG 3.64Å; L161-Y419 HydrophobicContact CD2-CD2 4.31Å; L161-Y419 HydrophobicContact CD2-CG 4.12Å; C411-Y419 CarbonylContact C-O 3.57Å; C411-Y419 WeakPolarHBondContact CA-O 3.17Å; C411-Y419 WeakPolarHBondContact CB-O 3.49Å; T412-Y419 PolarHBondContact N-O 3.42Å; T412-Y419 PolarHBondContact O-N 3.31Å; H414-Y419 HydrophobicContact CB-CD2 3.71Å; H414-Y419 HydrophobicContact CB-CE2 3.82Å; H414-Y419 AromaticContact CD2-CE2 3.84Å; H414-Y419 WeakPolarHBondContact O-CE2 3.12Å; Y419-K438 HydrophobicContact CD1-CB 4.1Å; Y419-K438 HydrophobicContact CD1-CG 4.41Å; Y419-K438 HydrophobicContact CD2-CG 4.15Å; Y419-K438 HydrophobicContact CE1-CB 4.01Å; Y419-K438 HydrophobicContact CE1-CD 4.15Å; Y419-K438 HydrophobicContact CE1-CG 4.14Å; Y419-K438 HydrophobicContact CE2-CD 3.9Å; Y419-K438 HydrophobicContact CE2-CG 3.84Å; Y419-K438 HydrophobicContact CG-CB 4.45Å; Y419-K438 HydrophobicContact CG-CG 4.44Å; Y419-F449 HydrophobicContact CD1-CD1 4.39Å; Y419-F449 HydrophobicContact CD1-CD2 4.13Å; Y419-F449 HydrophobicContact CD1-CE1 4.36Å; Y419-F449 HydrophobicContact CD1-CE2 4.13Å; Y419-F449 HydrophobicContact CD1-CG 4.26Å; Y419-F449 HydrophobicContact CD1-CZ 4.26Å; Y419-F449 AromaticContact CE1-CD2 3.79Å; Y419-F449 HydrophobicContact CE1-CD2 3.79Å; Y419-F449 AromaticContact CE1-CE2 3.81Å; Y419-F449 HydrophobicContact CE1-CE2 3.81Å; Y419-F449 HydrophobicContact CE1-CG 4.33Å; Y419-F449 HydrophobicContact CE1-CZ 4.37Å; Y419-L461 WeakPolarHBondContact O-CD2 3.26Å
420	I	94.1	Very high	90	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.6	-169.3	-57.7	163.9	0	0	0	108.5	V360 L383 L409 C411 V418 V435 F436 L437 W446	V360-I420 HydrophobicContact CG1-CD1 3.49Å; V360-I420 VanDerWaalsContact CG1-CD1 3.49Å; V360-I420 HydrophobicContact CG1-CG1 3.92Å; V360-I420 HydrophobicContact CG1-CG2 4.33Å; L383-I420 HydrophobicContact CD1-CG2 4.45Å; L409-I420 HydrophobicContact CB-CG2 4.33Å; L409-I420 HydrophobicContact CD1-CG2 3.89Å; L409-I420 HydrophobicContact CD2-CG2 4.13Å; L409-I420 HydrophobicContact CG-CG2 4.34Å; C411-I420 HydrophobicContact CB-CG1 3.95Å; V418-I420 HydrophobicContact CG1-CD1 4.15Å; V418-I420 HydrophobicContact CG1-CG1 3.82Å; I420-V435 HydrophobicContact CB-CG1 4.5Å; I420-V435 HydrophobicContact CG2-CG1 3.88Å; I420-F436 WeakPolarHBondContact O-CA 3.24Å; I420-L437 PolarHBondContact N-O 3.47Å; I420-L437 PolarHBondContact O-N 3.01Å; I420-W446 HydrophobicContact CD1-CH2 3.76Å; I420-W446 HydrophobicContact CD1-CZ3 3.64Å
421	M	92.8	Very high	89.5	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.02	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.4	-176.6	-175.9	178	73	0	0	111.1	V163 L409 T410 V435 F436 F452 M459 L461	V163-M421 HydrophobicContact CB-CE 4.41Å; V163-M421 HydrophobicContact CG1-CE 3.65Å; V163-M421 HydrophobicContact CG1-SD 4.12Å; V163-M421 HydrophobicContact CG2-CE 3.81Å; V163-M421 HydrophobicContact CG2-SD 3.73Å; L409-M421 CarbonylContact C-O 3.57Å; L409-M421 WeakPolarHBondContact CA-O 3.22Å; T410-M421 HydrophobicContact CG2-CB 3.98Å; T410-M421 HydrophobicContact CG2-CE 3.64Å; T410-M421 WeakPolarHBondContact CG2-O 3.45Å; T410-M421 PolarHBondContact N-O 2.84Å; T410-M421 PolarHBondContact O-N 3.31Å; T410-M421 VanDerWaalsContact O-O 3.13Å; M421-V435 CarbonylContact C-O 3.39Å; M421-V435 VanDerWaalsContact CA-O 3.27Å; M421-V435 WeakPolarHBondContact CA-O 3.41Å; M421-F436 HydrophobicContact CB-CD1 4.39Å; M421-F436 HydrophobicContact CB-CE1 4.46Å; M421-F436 HydrophobicContact CG-CD1 3.66Å; M421-F436 HydrophobicContact CG-CE1 3.31Å; M421-F436 HydrophobicContact CG-CZ 4.25Å; M421-F436 HydrophobicContact SD-CD1 4.17Å; M421-F436 HydrophobicContact SD-CE1 3.6Å; M421-F436 VanDerWaalsContact SD-CE1 3.6Å; M421-F452 HydrophobicContact SD-CD2 4.4Å; M421-F452 HydrophobicContact SD-CE2 4.49Å; M421-M459 HydrophobicContact CE-CB 3.47Å; M421-M459 VanDerWaalsContact CE-CB 3.47Å; M421-M459 HydrophobicContact CE-CE 4.36Å; M421-M459 HydrophobicContact SD-CE 4.38Å; M421-L461 HydrophobicContact CB-CD2 4.47Å; M421-L461 HydrophobicContact CE-CB 4.34Å
422	S	91.8	Very high	88.9	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.1	169.6	-52.3	0	0	0	0	111.4	N408 H433 V435 M459	N408-S422 CarbonylContact O-C 3.49Å; N408-S422 VanDerWaalsContact O-CA 3.31Å; N408-S422 WeakPolarHBondContact O-CA 3.38Å; S422-H433 WeakPolarHBondContact CB-O 3.23Å; S422-H433 PolarHBondContact OG-O 3.28Å; S422-V435 PolarHBondContact N-O 2.79Å; S422-V435 WeakPolarHBondContact OG-CB 3.41Å; S422-V435 PolarHBondContact OG-N 3.08Å; S422-M459 WeakPolarHBondContact O-CE 3.25Å
423	R	90.7	Very high	88.3	Confident	75 Å²	75	47.8 Å²	47.8	28%	0.283	26%	0.263	S	S	.	.	S	Bend	trans	-76.6	-36.2	-179	-60.4	-166.6	-66.4	-159.8	0.2	113.5	N408 L409 T410 Q457 N458 M459	N408-R423 PolarHBondContact O-N 3.27Å; N408-R423 PolarHBondContact OD1-NE 2.82Å; L409-R423 VanDerWaalsContact C-CG 3.49Å; L409-R423 WeakPolarHBondContact O-CD 3.36Å; T410-R423 HydrophobicContact CG2-CG 4.03Å; R423-Q457 CarbonylContact O-C 3.57Å; R423-N458 PolarHBondContact O-N 3.1Å; R423-M459 WeakPolarHBondContact CG-O 3.13Å; R423-M459 WeakPolarHBondContact O-CB 3.24Å; R423-M459 WeakPolarHBondContact O-CG 3.46Å; R423-M459 PolarHBondContact O-N 2.89Å
424	D	88.7	Confident	87.9	Confident	45 Å²	45	48.8 Å²	48.8	24%	0.241	26%	0.264	C	S	.	.			trans	-123.1	123	177.2	-49.8	-69.6	0	0	0	110.3	N408 G456 Q457 N458	N408-D424 VanDerWaalsContact ND2-CB 3.28Å; N408-D424 WeakPolarHBondContact ND2-CB 3.42Å; N408-D424 PolarHBondContact ND2-N 3.06Å; N408-D424 VanDerWaalsContact ND2-N 3.16Å; N408-D424 PolarHBondContact ND2-OD2 3.21Å; N408-D424 PolarHBondContact OD1-OD2 3.3Å; D424-G456 WeakPolarHBondContact CA-O 3.42Å; D424-Q457 VanDerWaalsContact OD1-CA 3.23Å; D424-Q457 WeakPolarHBondContact OD1-CA 3.36Å; D424-Q457 WeakPolarHBondContact OD1-CB 3.48Å; D424-N458 PolarHBondContact OD1-N 2.89Å
425	I	87.3	Confident	87.6	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-135.5	109.7	176.1	-53.3	179.2	0	0	0	107.9	T429 R434 F436 L455 G456 M459	I425-T429 HydrophobicContact CG2-CG2 4.48Å; I425-R434 HydrophobicContact CG2-CG 3.85Å; I425-F436 HydrophobicContact CD1-CE1 4.26Å; I425-F436 HydrophobicContact CD1-CE2 3.43Å; I425-F436 VanDerWaalsContact CD1-CE2 3.43Å; I425-F436 HydrophobicContact CD1-CZ 3.17Å; I425-L455 HydrophobicContact CB-CD2 4.5Å; I425-L455 HydrophobicContact CG2-CD2 3.69Å; I425-L455 CarbonylContact O-C 3.47Å; I425-L455 WeakPolarHBondContact O-CA 3.34Å; I425-L455 WeakPolarHBondContact O-CB 3.07Å; I425-G456 PolarHBondContact N-O 3.21Å; I425-G456 PolarHBondContact O-N 3.26Å; I425-M459 HydrophobicContact CB-CE 4.37Å; I425-M459 HydrophobicContact CD1-CE 3.81Å; I425-M459 HydrophobicContact CG1-CE 3.87Å
426	G	84.9	Confident	87.7	Confident	24 Å²	24	45 Å²	45	25%	0.247	24%	0.243	C	C	.	.			trans	-110.6	178.5	171	0	0	0	0	0	111.8	P428 T429 R434	G426-P428 VanDerWaalsContact C-CD 3.43Å; G426-T429 PolarHBondContact N-OG1 3.07Å; G426-T429 WeakPolarHBondContact O-CB 3.46Å; G426-T429 PolarHBondContact O-N 3.03Å; G426-T429 VanDerWaalsContact O-N 3.13Å; G426-T429 PolarHBondContact O-OG1 3.06Å; G426-R434 PolarHBondContact O-NH2 2.81Å
427	L	83.1	Confident	88.2	Confident	146 Å²	146	43.1 Å²	43.1	76%	0.764	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51	-45.3	172.2	-69.5	170.5	0	0	0	113.8	T429 R434 L455	L427-T429 VanDerWaalsContact C-N 3.27Å; L427-T429 PolarHBondContact O-N 3.1Å; L427-R434 PolarHBondContact O-NH2 3.48Å; L427-L455 HydrophobicContact CD2-CD1 3.66Å; L427-L455 HydrophobicContact CG-CD1 3.84Å
428	P	85.8	Confident	88.3	Confident	127 Å²	127	43.9 Å²	43.9	83%	0.825	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-6.8	-178.4	32.5	-36.4	0	0	0	113.8	G426 S430	G426-P428 VanDerWaalsContact C-CD 3.43Å; P428-S430 PolarHBondContact O-N 2.82Å
429	T	83.9	Confident	88.2	Confident	33 Å²	33	44 Å²	44	20%	0.202	24%	0.236	C	C	.	.			trans	-66.4	122.1	-179	-54.6	0	0	0	0	109.9	I425 G426 L427 H433 R434	I425-T429 HydrophobicContact CG2-CG2 4.48Å; G426-T429 PolarHBondContact N-OG1 3.07Å; G426-T429 WeakPolarHBondContact O-CB 3.46Å; G426-T429 PolarHBondContact O-N 3.03Å; G426-T429 VanDerWaalsContact O-N 3.13Å; G426-T429 PolarHBondContact O-OG1 3.06Å; L427-T429 VanDerWaalsContact C-N 3.27Å; L427-T429 PolarHBondContact O-N 3.1Å; T429-H433 HydrophobicContact CG2-CB 3.71Å; T429-R434 HydrophobicContact CG2-CG 4.14Å; T429-R434 PolarHBondContact O-NE 2.93Å; T429-R434 PolarHBondContact O-NH2 2.74Å
430	S	85.2	Confident	88.1	Confident	57 Å²	57	44 Å²	44	40%	0.399	24%	0.237	S	C	.	.			trans	-67.7	162.1	179.7	53.8	0	0	0	0	112.7	P428 D432 H433 R434	P428-S430 PolarHBondContact O-N 2.82Å; S430-D432 WeakPolarHBondContact CB-OD1 3.29Å; S430-D432 PolarHBondContact O-N 2.85Å; S430-D432 PolarHBondContact OG-OD1 3.28Å; S430-H433 PolarHBondContact O-N 3.43Å; S430-H433 PolarHBondContact OG-CD2 2.92Å; S430-H433 VanDerWaalsContact OG-CD2 3.25Å; S430-R434 WeakPolarHBondContact O-CG 3.29Å; S430-R434 PolarHBondContact O-N 2.86Å
431	L	83.6	Confident	87.8	Confident	129 Å²	129	45.2 Å²	45.2	68%	0.675	24%	0.243	S	C	*	.	S	Bend	trans	-68.1	-30.8	-171.2	-69.7	176.5	0	0	0	114.1	K404 R434	K404-L431 PolarHBondContact NZ-O 2.84Å; L431-R434 PolarHBondContact O-N 3.3Å
432	D	81.7	Confident	87.6	Confident	70 Å²	70	52.7 Å²	52.7	37%	0.374	28%	0.276	S	S	.	.	S	Bend	trans	-66.2	-36	174.2	56.9	-21.7	0	0	0	112.2	K404 S405 S430 R434	K404-D432 WeakPolarHBondContact CA-O 3.17Å; K404-D432 WeakPolarHBondContact CD-O 3.36Å; S405-D432 PolarHBondContact N-O 3.29Å; S430-D432 WeakPolarHBondContact CB-OD1 3.29Å; S430-D432 PolarHBondContact O-N 2.85Å; S430-D432 PolarHBondContact OG-OD1 3.28Å; D432-R434 VanDerWaalsContact C-N 3.32Å
433	H	83.1	Confident	87.5	Confident	58 Å²	58	56 Å²	56	27%	0.269	30%	0.298	S	S	.	.	S	Bend	trans	-80.8	-5.9	174.7	-76	-86.5	0	0	0	114.1	S405 S422 T429 S430 V435	S405-H433 WeakPolarHBondContact CB-ND1 3.45Å; S405-H433 PolarHBondContact OG-CE1 2.84Å; S405-H433 PolarHBondContact OG-ND1 3.26Å; S422-H433 WeakPolarHBondContact CB-O 3.23Å; S422-H433 PolarHBondContact OG-O 3.28Å; T429-H433 HydrophobicContact CG2-CB 3.71Å; S430-H433 PolarHBondContact O-N 3.43Å; S430-H433 PolarHBondContact OG-CD2 2.92Å; S430-H433 VanDerWaalsContact OG-CD2 3.25Å; H433-V435 PolarHBondContact O-N 2.89Å
434	R	87.1	Confident	87.5	Confident	74 Å²	74	55.6 Å²	55.6	28%	0.279	30%	0.302	S	S	.	.			trans	-91.5	91	171.1	-65.2	-178	-163	-151.7	2.7	109.5	K404 I425 G426 L427 T429 S430 L431 D432	K404-R434 PolarHBondContact NZ-O 2.8Å; I425-R434 HydrophobicContact CG2-CG 3.85Å; G426-R434 PolarHBondContact O-NH2 2.81Å; L427-R434 PolarHBondContact O-NH2 3.48Å; T429-R434 HydrophobicContact CG2-CG 4.14Å; T429-R434 PolarHBondContact O-NE 2.93Å; T429-R434 PolarHBondContact O-NH2 2.74Å; S430-R434 WeakPolarHBondContact O-CG 3.29Å; S430-R434 PolarHBondContact O-N 2.86Å; L431-R434 PolarHBondContact O-N 3.3Å; D432-R434 VanDerWaalsContact C-N 3.32Å
435	V	85.9	Confident	87.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.302	C	S	.	.			trans	-101.1	124.8	-177.7	-173.9	0	0	0	0	109.2	L383 K404 S405 L409 I420 M421 S422 H433 L437	L383-V435 HydrophobicContact CD2-CG1 3.91Å; K404-V435 HydrophobicContact CB-CG2 4.16Å; K404-V435 HydrophobicContact CD-CG2 4.41Å; S405-V435 WeakPolarHBondContact O-CG2 3.14Å; L409-V435 HydrophobicContact CD2-CB 3.86Å; L409-V435 HydrophobicContact CD2-CG1 4.17Å; L409-V435 HydrophobicContact CD2-CG2 3.87Å; I420-V435 HydrophobicContact CB-CG1 4.5Å; I420-V435 HydrophobicContact CG2-CG1 3.88Å; M421-V435 CarbonylContact C-O 3.39Å; M421-V435 VanDerWaalsContact CA-O 3.27Å; M421-V435 WeakPolarHBondContact CA-O 3.41Å; S422-V435 PolarHBondContact N-O 2.79Å; S422-V435 WeakPolarHBondContact OG-CB 3.41Å; S422-V435 PolarHBondContact OG-N 3.08Å; H433-V435 PolarHBondContact O-N 2.89Å; V435-L437 HydrophobicContact CG1-CB 4.44Å; V435-L437 HydrophobicContact CG1-CD1 4.2Å; V435-L437 HydrophobicContact CG1-CG 4.23Å
436	F	89.4	Confident	87.9	Confident	25 Å²	25	56.7 Å²	56.7	11%	0.11	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	84.5	171.4	-64.6	-77.3	0	0	0	106.6	I420 M421 I425 F449 F452	I420-F436 WeakPolarHBondContact O-CA 3.24Å; M421-F436 HydrophobicContact CB-CD1 4.39Å; M421-F436 HydrophobicContact CB-CE1 4.46Å; M421-F436 HydrophobicContact CG-CD1 3.66Å; M421-F436 HydrophobicContact CG-CE1 3.31Å; M421-F436 HydrophobicContact CG-CZ 4.25Å; M421-F436 HydrophobicContact SD-CD1 4.17Å; M421-F436 HydrophobicContact SD-CE1 3.6Å; M421-F436 VanDerWaalsContact SD-CE1 3.6Å; I425-F436 HydrophobicContact CD1-CE1 4.26Å; I425-F436 HydrophobicContact CD1-CE2 3.43Å; I425-F436 VanDerWaalsContact CD1-CE2 3.43Å; I425-F436 HydrophobicContact CD1-CZ 3.17Å; F436-F449 HydrophobicContact CB-CD1 4.31Å; F436-F449 PolarHBondContact O-N 3.47Å; F436-F452 HydrophobicContact CD1-CB 3.59Å; F436-F452 HydrophobicContact CD1-CG 4.44Å; F436-F452 HydrophobicContact CD2-CB 4.46Å; F436-F452 HydrophobicContact CE1-CB 3Å; F436-F452 HydrophobicContact CE1-CD1 4Å; F436-F452 HydrophobicContact CE1-CD2 4.29Å; F436-F452 AromaticContact CE1-CG 3.57Å; F436-F452 HydrophobicContact CE1-CG 3.57Å; F436-F452 HydrophobicContact CE2-CB 3.99Å; F436-F452 HydrophobicContact CG-CB 4.27Å; F436-F452 HydrophobicContact CZ-CB 3.23Å; F436-F452 AromaticContact CZ-CD1 3.94Å; F436-F452 HydrophobicContact CZ-CD1 3.94Å; F436-F452 AromaticContact CZ-CG 3.87Å; F436-F452 HydrophobicContact CZ-CG 3.87Å
437	L	92.4	Very high	88.2	Confident	17 Å²	17	59.1 Å²	59.1	9%	0.089	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.2	-172.1	-66.5	176.8	0	0	0	109.8	L383 N401 K404 I420 V435 W446	L383-L437 HydrophobicContact CD2-CD1 3.68Å; N401-L437 VanDerWaalsContact ND2-CD1 3.32Å; N401-L437 WeakPolarHBondContact ND2-CD1 3.35Å; K404-L437 HydrophobicContact CG-CD1 4.03Å; I420-L437 PolarHBondContact N-O 3.47Å; I420-L437 PolarHBondContact O-N 3.01Å; V435-L437 HydrophobicContact CG1-CB 4.44Å; V435-L437 HydrophobicContact CG1-CD1 4.2Å; V435-L437 HydrophobicContact CG1-CG 4.23Å; L437-W446 HydrophobicContact CB-CE3 3.95Å; L437-W446 HydrophobicContact CB-CZ3 4.06Å; L437-W446 HydrophobicContact CD1-CE3 3.82Å; L437-W446 HydrophobicContact CD1-CZ3 4.02Å; L437-W446 HydrophobicContact CG-CE3 4.48Å
438	K	93.2	Very high	88.1	Confident	17 Å²	17	56.8 Å²	56.8	7%	0.074	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.9	163.9	177.2	-166.3	175.1	-165	0	107.4	D416 V418 Y419 E447	D416-K438 WeakPolarHBondContact OD1-CE 3.16Å; D416-K438 IonicContact OD1-NZ 3.38Å; D416-K438 PolarHBondContact OD1-NZ 2.82Å; D416-K438 IonicContact OD2-NZ 3.91Å; D416-K438 PolarHBondContact OD2-NZ 2.87Å; V418-K438 CarbonylContact O-C 3.57Å; V418-K438 WeakPolarHBondContact O-CA 3.26Å; Y419-K438 HydrophobicContact CD1-CB 4.1Å; Y419-K438 HydrophobicContact CD1-CG 4.41Å; Y419-K438 HydrophobicContact CD2-CG 4.15Å; Y419-K438 HydrophobicContact CE1-CB 4.01Å; Y419-K438 HydrophobicContact CE1-CD 4.15Å; Y419-K438 HydrophobicContact CE1-CG 4.14Å; Y419-K438 HydrophobicContact CE2-CD 3.9Å; Y419-K438 HydrophobicContact CE2-CG 3.84Å; Y419-K438 HydrophobicContact CG-CB 4.45Å; Y419-K438 HydrophobicContact CG-CG 4.44Å; K438-E447 HydrophobicContact CB-CB 4.22Å; K438-E447 WeakPolarHBondContact CD-OE2 3.21Å; K438-E447 PolarHBondContact N-O 3.46Å; K438-E447 IonicContact NZ-OE1 3.31Å; K438-E447 IonicContact NZ-OE2 3.02Å; K438-E447 PolarHBondContact NZ-OE2 3.11Å; K438-E447 PolarHBondContact O-N 2.89Å
439	Y	93.6	Very high	87.7	Confident	1 Å²	1	52 Å²	52	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.2	169.3	178.4	-96.5	0	0	0	108.5	V385 L398 G417 V418 I441 D444 W446	V385-Y439 HydrophobicContact CB-CD1 4.41Å; V385-Y439 HydrophobicContact CB-CE1 4.3Å; V385-Y439 HydrophobicContact CG1-CD1 4.14Å; V385-Y439 HydrophobicContact CG1-CE1 4.01Å; V385-Y439 HydrophobicContact CG2-CD1 4.13Å; V385-Y439 HydrophobicContact CG2-CD2 4.14Å; V385-Y439 HydrophobicContact CG2-CE1 4.48Å; V385-Y439 HydrophobicContact CG2-CE2 4.48Å; V385-Y439 HydrophobicContact CG2-CG 3.96Å; L398-Y439 VanDerWaalsContact CB-OH 3.23Å; L398-Y439 WeakPolarHBondContact CB-OH 3.42Å; L398-Y439 HydrophobicContact CD1-CE1 3.82Å; L398-Y439 VanDerWaalsContact CD1-OH 3.24Å; L398-Y439 WeakPolarHBondContact CD1-OH 3.41Å; G417-Y439 CarbonylContact C-O 3.52Å; G417-Y439 VanDerWaalsContact CA-O 3.27Å; G417-Y439 WeakPolarHBondContact CA-O 3.06Å; V418-Y439 PolarHBondContact N-O 2.94Å; V418-Y439 PolarHBondContact O-N 2.83Å; Y439-I441 HydrophobicContact CD1-CG2 4.1Å; Y439-I441 HydrophobicContact CE1-CG2 4.14Å; Y439-I441 PolarHBondContact O-N 3.25Å; Y439-D444 PolarHBondContact OH-OD1 3.37Å; Y439-W446 AromaticContact CD2-CD2 3.83Å; Y439-W446 HydrophobicContact CD2-CD2 3.83Å; Y439-W446 AromaticContact CD2-CE2 3.61Å; Y439-W446 HydrophobicContact CD2-CE3 4.16Å; Y439-W446 HydrophobicContact CD2-CG 4.36Å; Y439-W446 HydrophobicContact CD2-CH2 4.13Å; Y439-W446 AromaticContact CD2-CZ2 3.78Å; Y439-W446 HydrophobicContact CD2-CZ2 3.78Å; Y439-W446 HydrophobicContact CD2-CZ3 4.31Å; Y439-W446 AromaticContact CD2-NE1 3.97Å; Y439-W446 HydrophobicContact CE2-CZ2 4.44Å; Y439-W446 HydrophobicContact CG-CH2 4.41Å; Y439-W446 HydrophobicContact CG-CZ2 4.48Å; Y439-W446 HydrophobicContact CG-CZ3 4.5Å
440	N	92.6	Very high	87.1	Confident	14 Å²	14	58.8 Å²	58.8	8%	0.075	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	113.1	-179.8	-168.8	-46.9	0	0	0	109.5	D416 F442 S443 D444 A445 E447	D416-N440 PolarHBondContact OD2-ND2 2.76Å; D416-N440 VanDerWaalsContact OD2-ND2 3.16Å; N440-F442 VanDerWaalsContact C-N 3.27Å; N440-F442 PolarHBondContact O-N 3.15Å; N440-F442 PolarHBondContact OD1-N 2.87Å; N440-S443 WeakPolarHBondContact CB-OG 2.83Å; N440-S443 PolarHBondContact OD1-N 2.96Å; N440-S443 PolarHBondContact OD1-OG 2.57Å; N440-D444 PolarHBondContact O-N 2.84Å; N440-D444 VanDerWaalsContact O-N 3.11Å; N440-A445 PolarHBondContact N-O 3.48Å; N440-E447 PolarHBondContact ND2-OE1 3.3Å
441	I	88.1	Confident	86.6	Confident	28 Å²	28	66.6 Å²	66.6	14%	0.144	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-23.7	-174.8	60.1	176.7	0	0	0	112.8	V353 Y358 V418 Y439	V353-I441 HydrophobicContact CG1-CD1 4.42Å; V353-I441 HydrophobicContact CG2-CD1 4.01Å; Y358-I441 HydrophobicContact CD1-CG2 4.44Å; Y358-I441 HydrophobicContact CE1-CB 4.35Å; Y358-I441 HydrophobicContact CE1-CG2 3.94Å; V418-I441 HydrophobicContact CG2-CG2 3.86Å; Y439-I441 HydrophobicContact CD1-CG2 4.1Å; Y439-I441 HydrophobicContact CE1-CG2 4.14Å; Y439-I441 PolarHBondContact O-N 3.25Å
442	F	87.7	Confident	86.5	Confident	162 Å²	162	61.2 Å²	61.2	71%	0.711	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-32.6	-177.6	-60	-73.4	0	0	0	112.9	D416 N440	D416-F442 HydrophobicContact CB-CD2 4.23Å; D416-F442 HydrophobicContact CB-CE2 4.12Å; N440-F442 VanDerWaalsContact C-N 3.27Å; N440-F442 PolarHBondContact O-N 3.15Å; N440-F442 PolarHBondContact OD1-N 2.87Å
443	S	90.5	Very high	86.6	Confident	69 Å²	69	59.1 Å²	59.1	48%	0.483	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-0.8	-177.4	62.5	0	0	0	0	114.6	N440 A445	N440-S443 WeakPolarHBondContact CB-OG 2.83Å; N440-S443 PolarHBondContact OD1-N 2.96Å; N440-S443 PolarHBondContact OD1-OG 2.57Å; S443-A445 VanDerWaalsContact C-N 3.27Å; S443-A445 PolarHBondContact O-N 3.23Å; S443-A445 WeakPolarHBondContact OG-CB 3.14Å
444	D	90.3	Very high	86.5	Confident	67 Å²	67	56.7 Å²	56.7	36%	0.358	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	48.1	-175.9	-176.7	31	0	0	0	111.6	K399 Y439 N440	K399-D444 WeakPolarHBondContact CB-OD1 3.49Å; K399-D444 WeakPolarHBondContact CD-O 3.16Å; K399-D444 PolarHBondContact N-OD1 3.24Å; Y439-D444 PolarHBondContact OH-OD1 3.37Å; N440-D444 PolarHBondContact O-N 2.84Å; N440-D444 VanDerWaalsContact O-N 3.11Å
445	A	91.8	Very high	86.4	Confident	28 Å²	28	54.3 Å²	54.3	23%	0.231	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	143.5	-171.3	0	0	0	0	0	113.1	N440 S443	N440-A445 PolarHBondContact N-O 3.48Å; S443-A445 VanDerWaalsContact C-N 3.27Å; S443-A445 PolarHBondContact O-N 3.23Å; S443-A445 WeakPolarHBondContact OG-CB 3.14Å
446	W	91.6	Very high	86.3	Confident	44 Å²	44	54.3 Å²	54.3	17%	0.167	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.9	172.6	-69.4	96.6	0	0	0	110.3	L383 V385 K399 N401 I420 L437 Y439	L383-W446 HydrophobicContact CD1-CH2 4.07Å; L383-W446 HydrophobicContact CD2-CE3 4.46Å; L383-W446 HydrophobicContact CD2-CH2 3.55Å; L383-W446 HydrophobicContact CD2-CZ2 4.33Å; L383-W446 HydrophobicContact CD2-CZ3 3.61Å; L383-W446 HydrophobicContact CG-CH2 3.54Å; L383-W446 HydrophobicContact CG-CZ2 4.08Å; L383-W446 HydrophobicContact CG-CZ3 4.16Å; V385-W446 HydrophobicContact CG2-CH2 3.68Å; V385-W446 HydrophobicContact CG2-CZ2 3.73Å; K399-W446 PolarHBondContact O-NE1 2.84Å; N401-W446 HydrophobicContact CB-CD2 4.09Å; N401-W446 HydrophobicContact CB-CG 4.41Å; N401-W446 HydrophobicContact CB-CZ2 4.12Å; I420-W446 HydrophobicContact CD1-CH2 3.76Å; I420-W446 HydrophobicContact CD1-CZ3 3.64Å; L437-W446 HydrophobicContact CB-CE3 3.95Å; L437-W446 HydrophobicContact CB-CZ3 4.06Å; L437-W446 HydrophobicContact CD1-CE3 3.82Å; L437-W446 HydrophobicContact CD1-CZ3 4.02Å; L437-W446 HydrophobicContact CG-CE3 4.48Å; Y439-W446 AromaticContact CD2-CD2 3.83Å; Y439-W446 HydrophobicContact CD2-CD2 3.83Å; Y439-W446 AromaticContact CD2-CE2 3.61Å; Y439-W446 HydrophobicContact CD2-CE3 4.16Å; Y439-W446 HydrophobicContact CD2-CG 4.36Å; Y439-W446 HydrophobicContact CD2-CH2 4.13Å; Y439-W446 AromaticContact CD2-CZ2 3.78Å; Y439-W446 HydrophobicContact CD2-CZ2 3.78Å; Y439-W446 HydrophobicContact CD2-CZ3 4.31Å; Y439-W446 AromaticContact CD2-NE1 3.97Å; Y439-W446 HydrophobicContact CE2-CZ2 4.44Å; Y439-W446 HydrophobicContact CG-CH2 4.41Å; Y439-W446 HydrophobicContact CG-CZ2 4.48Å; Y439-W446 HydrophobicContact CG-CZ3 4.5Å
447	E	90.9	Very high	86.1	Confident	76 Å²	76	56.4 Å²	56.4	36%	0.355	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.8	175.8	-68.1	172.4	-147.3	0	0	109.5	K438 N440 F449	K438-E447 HydrophobicContact CB-CB 4.22Å; K438-E447 WeakPolarHBondContact CD-OE2 3.21Å; K438-E447 PolarHBondContact N-O 3.46Å; K438-E447 IonicContact NZ-OE1 3.31Å; K438-E447 IonicContact NZ-OE2 3.02Å; K438-E447 PolarHBondContact NZ-OE2 3.11Å; K438-E447 PolarHBondContact O-N 2.89Å; N440-E447 PolarHBondContact ND2-OE1 3.3Å; E447-F449 PolarHBondContact O-N 3.05Å
448	A	82.8	Confident	85.8	Confident	97 Å²	97	56.5 Å²	56.5	80%	0.802	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	120	173.6	0	0	0	0	0	109.2
449	F	77.3	Confident	85.7	Confident	25 Å²	25	55.7 Å²	55.7	11%	0.11	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-98.8	127.6	174.5	174.5	-118.7	0	0	0	108.1	L161 Y186 W193 Y419 F436 E447	L161-F449 HydrophobicContact CD1-CE2 4.36Å; L161-F449 HydrophobicContact CD1-CZ 4.18Å; Y186-F449 AromaticContact CD1-CE2 3.77Å; Y186-F449 HydrophobicContact CD1-CE2 3.77Å; Y186-F449 HydrophobicContact CD1-CZ 4.21Å; Y186-F449 AromaticContact CD2-CE2 3.68Å; Y186-F449 HydrophobicContact CD2-CE2 3.68Å; Y186-F449 AromaticContact CD2-CZ 3.63Å; Y186-F449 HydrophobicContact CD2-CZ 3.63Å; Y186-F449 HydrophobicContact CE1-CD2 4.4Å; Y186-F449 AromaticContact CE1-CE2 3.54Å; Y186-F449 HydrophobicContact CE1-CE2 3.54Å; Y186-F449 HydrophobicContact CE1-CZ 4.38Å; Y186-F449 HydrophobicContact CE2-CD2 4.32Å; Y186-F449 AromaticContact CE2-CE2 3.44Å; Y186-F449 HydrophobicContact CE2-CE2 3.44Å; Y186-F449 VanDerWaalsContact CE2-CE2 3.44Å; Y186-F449 AromaticContact CE2-CZ 3.82Å; Y186-F449 HydrophobicContact CE2-CZ 3.82Å; Y186-F449 AromaticContact CG-CE2 3.82Å; Y186-F449 HydrophobicContact CG-CE2 3.82Å; Y186-F449 AromaticContact CG-CZ 3.83Å; Y186-F449 HydrophobicContact CG-CZ 3.83Å; Y186-F449 AromaticContact CZ-CE2 3.35Å; W193-F449 AromaticContact CE2-CZ 3.96Å; W193-F449 HydrophobicContact CH2-CE1 4.37Å; W193-F449 HydrophobicContact CH2-CZ 4.17Å; W193-F449 AromaticContact CZ2-CE1 3.46Å; W193-F449 HydrophobicContact CZ2-CE1 3.46Å; W193-F449 VanDerWaalsContact CZ2-CE1 3.46Å; W193-F449 AromaticContact CZ2-CZ 3.45Å; W193-F449 HydrophobicContact CZ2-CZ 3.45Å; W193-F449 VanDerWaalsContact CZ2-CZ 3.45Å; Y419-F449 HydrophobicContact CD1-CD1 4.39Å; Y419-F449 HydrophobicContact CD1-CD2 4.13Å; Y419-F449 HydrophobicContact CD1-CE1 4.36Å; Y419-F449 HydrophobicContact CD1-CE2 4.13Å; Y419-F449 HydrophobicContact CD1-CG 4.26Å; Y419-F449 HydrophobicContact CD1-CZ 4.26Å; Y419-F449 AromaticContact CE1-CD2 3.79Å; Y419-F449 HydrophobicContact CE1-CD2 3.79Å; Y419-F449 AromaticContact CE1-CE2 3.81Å; Y419-F449 HydrophobicContact CE1-CE2 3.81Å; Y419-F449 HydrophobicContact CE1-CG 4.33Å; Y419-F449 HydrophobicContact CE1-CZ 4.37Å; F436-F449 HydrophobicContact CB-CD1 4.31Å; F436-F449 PolarHBondContact O-N 3.47Å; E447-F449 PolarHBondContact O-N 3.05Å
450	R	70.8	Confident	85.7	Confident	176 Å²	176	56.5 Å²	56.5	66%	0.664	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-54.6	145.8	-168.8	-77.6	-163.7	-178.4	-154.6	3.2	111.8	F452	R450-F452 PolarHBondContact O-N 3.27Å
451	R	73.6	Confident	85.8	Confident	222 Å²	222	56.2 Å²	56.2	84%	0.838	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-52.5	127.5	-172.9	-67.8	-177.4	-178	175.2	1.1	111.1
452	F	82.8	Confident	86.1	Confident	15 Å²	15	55.2 Å²	55.2	7%	0.066	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-61.2	136.9	168.6	-175.8	-108.1	0	0	0	110	V163 F167 L184 W193 M421 F436 R450 A454 M459	V163-F452 HydrophobicContact CB-CE2 3.88Å; V163-F452 HydrophobicContact CB-CZ 4.36Å; V163-F452 HydrophobicContact CG1-CE2 3.7Å; V163-F452 HydrophobicContact CG1-CZ 3.71Å; V163-F452 HydrophobicContact CG2-CE2 4.07Å; F167-F452 HydrophobicContact CD1-CE1 4.29Å; F167-F452 HydrophobicContact CD1-CZ 4.17Å; F167-F452 HydrophobicContact CE1-CE1 4.14Å; F167-F452 AromaticContact CE1-CZ 3.64Å; F167-F452 HydrophobicContact CE1-CZ 3.64Å; F167-F452 AromaticContact CZ-CZ 3.93Å; F167-F452 HydrophobicContact CZ-CZ 3.93Å; L184-F452 HydrophobicContact CB-CE2 4.47Å; L184-F452 HydrophobicContact CD1-CD2 4.41Å; L184-F452 HydrophobicContact CD1-CE2 3.6Å; L184-F452 HydrophobicContact CD1-CZ 3.71Å; W193-F452 AromaticContact CD2-CD2 3.99Å; W193-F452 HydrophobicContact CD2-CD2 3.99Å; W193-F452 HydrophobicContact CD2-CE2 4.35Å; W193-F452 AromaticContact CE2-CD2 3.67Å; W193-F452 HydrophobicContact CE3-CE2 4.48Å; W193-F452 HydrophobicContact CG-CD2 4.33Å; W193-F452 AromaticContact CZ2-CD2 3.9Å; W193-F452 HydrophobicContact CZ2-CD2 3.9Å; W193-F452 HydrophobicContact CZ2-CE2 4.44Å; W193-F452 AromaticContact NE1-CD2 3.89Å; M421-F452 HydrophobicContact SD-CD2 4.4Å; M421-F452 HydrophobicContact SD-CE2 4.49Å; F436-F452 HydrophobicContact CD1-CB 3.59Å; F436-F452 HydrophobicContact CD1-CG 4.44Å; F436-F452 HydrophobicContact CD2-CB 4.46Å; F436-F452 HydrophobicContact CE1-CB 3Å; F436-F452 HydrophobicContact CE1-CD1 4Å; F436-F452 HydrophobicContact CE1-CD2 4.29Å; F436-F452 AromaticContact CE1-CG 3.57Å; F436-F452 HydrophobicContact CE1-CG 3.57Å; F436-F452 HydrophobicContact CE2-CB 3.99Å; F436-F452 HydrophobicContact CG-CB 4.27Å; F436-F452 HydrophobicContact CZ-CB 3.23Å; F436-F452 AromaticContact CZ-CD1 3.94Å; F436-F452 HydrophobicContact CZ-CD1 3.94Å; F436-F452 AromaticContact CZ-CG 3.87Å; F436-F452 HydrophobicContact CZ-CG 3.87Å; R450-F452 PolarHBondContact O-N 3.27Å; F452-A454 HydrophobicContact CD1-CB 4.09Å; F452-A454 WeakPolarHBondContact CD1-O 3.47Å; F452-A454 HydrophobicContact CE1-CB 3.58Å; F452-A454 HydrophobicContact CZ-CB 4.23Å; F452-A454 PolarHBondContact O-N 3.37Å; F452-M459 HydrophobicContact CD1-SD 4.17Å; F452-M459 HydrophobicContact CE1-CE 4.26Å; F452-M459 HydrophobicContact CE1-SD 3.38Å; F452-M459 WeakPolarHBondContact CE1-SD 3.32Å; F452-M459 HydrophobicContact CZ-SD 3.9Å
453	P	82.4	Confident	86.5	Confident	27 Å²	27	48.7 Å²	48.7	18%	0.175	25%	0.248	C	C	.	.	S	Bend	trans	-81.7	3.3	-168.1	36.1	-40.5	0	0	0	112.9	S171 L172 L184 W193	S171-P453 PolarHBondContact N-O 3.17Å; L172-P453 HydrophobicContact CD1-CG 4.4Å; L172-P453 HydrophobicContact CD2-CB 3.82Å; L172-P453 HydrophobicContact CD2-CG 3.8Å; L172-P453 HydrophobicContact CG-CB 4.03Å; L172-P453 HydrophobicContact CG-CG 4.02Å; L184-P453 HydrophobicContact CD1-CG 3.86Å; W193-P453 HydrophobicContact CB-CG 3.79Å; W193-P453 VanDerWaalsContact CD1-CD 3.47Å; W193-P453 HydrophobicContact CG-CG 4.26Å
454	A	81.6	Confident	86.8	Confident	7 Å²	7	45.4 Å²	45.4	6%	0.058	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.4	-172.2	0	0	0	0	0	115.8	F167 C169 L170 F452	F167-A454 HydrophobicContact CB-CB 4.14Å; F167-A454 HydrophobicContact CD1-CB 4.35Å; F167-A454 HydrophobicContact CG-CB 4.14Å; C169-A454 CarbonylContact O-C 3.53Å; C169-A454 WeakPolarHBondContact O-CA 3.44Å; C169-A454 WeakPolarHBondContact O-CB 3.3Å; L170-A454 HydrophobicContact CD2-CB 3.79Å; L170-A454 HydrophobicContact CG-CB 4.08Å; F452-A454 HydrophobicContact CD1-CB 4.09Å; F452-A454 WeakPolarHBondContact CD1-O 3.47Å; F452-A454 HydrophobicContact CE1-CB 3.58Å; F452-A454 HydrophobicContact CZ-CB 4.23Å; F452-A454 PolarHBondContact O-N 3.37Å
455	L	85.1	Confident	87	Confident	23 Å²	23	46 Å²	46	12%	0.12	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	137.2	159.3	-60.4	179.3	0	0	0	108.1	F167 T168 C169 I425 L427	F167-L455 CarbonylContact C-O 3.56Å; F167-L455 WeakPolarHBondContact CA-O 3.49Å; T168-L455 PolarHBondContact N-O 2.83Å; T168-L455 PolarHBondContact OG1-O 2.94Å; C169-L455 HydrophobicContact CB-CB 4.19Å; C169-L455 HydrophobicContact CB-CD1 4.16Å; C169-L455 HydrophobicContact CB-CG 4.26Å; C169-L455 PolarHBondContact O-N 2.74Å; I425-L455 HydrophobicContact CB-CD2 4.5Å; I425-L455 HydrophobicContact CG2-CD2 3.69Å; I425-L455 CarbonylContact O-C 3.47Å; I425-L455 WeakPolarHBondContact O-CA 3.34Å; I425-L455 WeakPolarHBondContact O-CB 3.07Å; L427-L455 HydrophobicContact CD2-CD1 3.66Å; L427-L455 HydrophobicContact CG-CD1 3.84Å
456	G	84.9	Confident	87.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	166.5	-175.3	0	0	0	0	0	113.3	D166 D424 I425	D166-G456 WeakPolarHBondContact O-CA 3.32Å; D424-G456 WeakPolarHBondContact CA-O 3.42Å; I425-G456 PolarHBondContact N-O 3.21Å; I425-G456 PolarHBondContact O-N 3.26Å
457	Q	85.3	Confident	87	Confident	70 Å²	70	44.5 Å²	44.5	33%	0.327	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	152.9	176.8	-65.6	178.5	4.6	0	0	110	D166 R423 D424 M459	D166-Q457 PolarHBondContact N-O 3.34Å; D166-Q457 PolarHBondContact O-N 2.81Å; R423-Q457 CarbonylContact O-C 3.57Å; D424-Q457 VanDerWaalsContact OD1-CA 3.23Å; D424-Q457 WeakPolarHBondContact OD1-CA 3.36Å; D424-Q457 WeakPolarHBondContact OD1-CB 3.48Å; Q457-M459 PolarHBondContact O-N 2.92Å; Q457-M459 VanDerWaalsContact O-N 3.14Å
458	N	84.9	Confident	86.4	Confident	18 Å²	18	47.4 Å²	47.4	10%	0.096	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	48.9	38	-176.9	-52.2	-67.4	0	0	0	113.2	V207 R208 Y210 R423 D424 L460	V207-N458 PolarHBondContact O-ND2 3.15Å; R208-N458 WeakPolarHBondContact CA-OD1 3.45Å; R208-N458 WeakPolarHBondContact CB-OD1 3.43Å; R208-N458 WeakPolarHBondContact CD-ND2 3.31Å; R208-N458 WeakPolarHBondContact CD-OD1 3.23Å; R208-N458 VanDerWaalsContact CG-ND2 3.28Å; R208-N458 WeakPolarHBondContact CG-ND2 3.28Å; Y210-N458 HydrophobicContact CE1-CB 4.04Å; Y210-N458 PolarHBondContact OH-O 3.38Å; R423-N458 PolarHBondContact O-N 3.1Å; D424-N458 PolarHBondContact OD1-N 2.89Å; N458-L460 PolarHBondContact O-N 3.47Å
459	M	91.1	Very high	85.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.1	179.5	-55.8	-172.7	-59.5	0	0	109.1	V163 I164 F167 T410 M421 S422 R423 I425 F452 Q457	V163-M459 HydrophobicContact CG1-CB 4.25Å; I164-M459 CarbonylContact O-C 3.48Å; I164-M459 VanDerWaalsContact O-CA 3.23Å; I164-M459 WeakPolarHBondContact O-CA 3.44Å; F167-M459 HydrophobicContact CD1-CG 4.39Å; F167-M459 HydrophobicContact CD1-SD 4.1Å; F167-M459 HydrophobicContact CE1-CG 3.96Å; F167-M459 HydrophobicContact CE1-SD 3.89Å; T410-M459 WeakPolarHBondContact CG2-O 3.39Å; M421-M459 HydrophobicContact CE-CB 3.47Å; M421-M459 VanDerWaalsContact CE-CB 3.47Å; M421-M459 HydrophobicContact CE-CE 4.36Å; M421-M459 HydrophobicContact SD-CE 4.38Å; S422-M459 WeakPolarHBondContact O-CE 3.25Å; R423-M459 WeakPolarHBondContact CG-O 3.13Å; R423-M459 WeakPolarHBondContact O-CB 3.24Å; R423-M459 WeakPolarHBondContact O-CG 3.46Å; R423-M459 PolarHBondContact O-N 2.89Å; I425-M459 HydrophobicContact CB-CE 4.37Å; I425-M459 HydrophobicContact CD1-CE 3.81Å; I425-M459 HydrophobicContact CG1-CE 3.87Å; F452-M459 HydrophobicContact CD1-SD 4.17Å; F452-M459 HydrophobicContact CE1-CE 4.26Å; F452-M459 HydrophobicContact CE1-SD 3.38Å; F452-M459 WeakPolarHBondContact CE1-SD 3.32Å; F452-M459 HydrophobicContact CZ-SD 3.9Å; Q457-M459 PolarHBondContact O-N 2.92Å; Q457-M459 VanDerWaalsContact O-N 3.14Å
460	L	93	Very high	84.8	Confident	18 Å²	18	51.4 Å²	51.4	9%	0.094	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.7	177.7	-62.5	178.8	0	0	0	109.7	V163 I164 Y210 N458	V163-L460 VanDerWaalsContact CA-O 3.3Å; V163-L460 WeakPolarHBondContact CA-O 3.49Å; I164-L460 HydrophobicContact CD1-CB 4.37Å; I164-L460 HydrophobicContact CD1-CD1 4.45Å; I164-L460 HydrophobicContact CG1-CB 3.86Å; I164-L460 PolarHBondContact N-O 2.65Å; I164-L460 PolarHBondContact O-N 2.84Å; Y210-L460 HydrophobicContact CD2-CD1 3.79Å; Y210-L460 HydrophobicContact CE2-CD1 3.16Å; Y210-L460 HydrophobicContact CE2-CG 4.27Å; N458-L460 PolarHBondContact O-N 3.47Å
461	L	94.5	Very high	85.5	Confident	9 Å²	9	45.2 Å²	45.2	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.4	179.9	-173.4	69.8	0	0	0	109.5	L161 V163 W193 T410 T412 Y419 M421	L161-L461 HydrophobicContact CD2-CD1 4.19Å; L161-L461 HydrophobicContact CD2-CG 4.39Å; V163-L461 HydrophobicContact CG2-CD1 3.33Å; W193-L461 HydrophobicContact CH2-CD1 4.33Å; T410-L461 HydrophobicContact CG2-CB 3.83Å; T410-L461 PolarHBondContact OG1-N 2.54Å; T412-L461 HydrophobicContact CG2-CD2 3.89Å; T412-L461 HydrophobicContact CG2-CG 3.69Å; Y419-L461 WeakPolarHBondContact O-CD2 3.26Å; M421-L461 HydrophobicContact CB-CD2 4.47Å; M421-L461 HydrophobicContact CE-CB 4.34Å
462	C	95.9	Very high	86.1	Confident	7 Å²	7	35.9 Å²	35.9	5%	0.047	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	162.3	174.5	65.8	0	0	0	0	111.1	V162 V214 L219	V162-C462 PolarHBondContact N-O 3.27Å; V162-C462 PolarHBondContact O-N 2.94Å; V214-C462 HydrophobicContact CG2-CB 4.04Å; L219-C462 HydrophobicContact CD1-CB 4.29Å
463	S	95.6	Very high	86.3	Confident	25 Å²	25	37.1 Å²	37.1	18%	0.175	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	127.3	171.5	-178.9	0	0	0	0	109.1	L413 H414	L413-S463 VanDerWaalsContact O-CB 3.31Å; L413-S463 WeakPolarHBondContact O-CB 3.39Å; H414-S463 PolarHBondContact ND1-OG 3.09Å
464	L	96.1	Very high	86.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151.5	178.7	-66.6	176.4	0	0	0	110.3	T160 V162 V214 L219 Y238 L466	T160-L464 PolarHBondContact N-O 2.81Å; T160-L464 PolarHBondContact O-N 2.9Å; V162-L464 HydrophobicContact CB-CD1 4.36Å; V162-L464 HydrophobicContact CG2-CB 4.38Å; V162-L464 HydrophobicContact CG2-CD1 4.18Å; V214-L464 HydrophobicContact CB-CD2 4.49Å; V214-L464 HydrophobicContact CG1-CD2 3.75Å; V214-L464 HydrophobicContact CG2-CD2 3.84Å; L219-L464 HydrophobicContact CB-CD1 4.14Å; L219-L464 HydrophobicContact CB-CD2 4.23Å; L219-L464 HydrophobicContact CD2-CD1 4.49Å; Y238-L464 HydrophobicContact CD1-CD1 4.19Å; Y238-L464 HydrophobicContact CE1-CD1 4.34Å; L464-L466 HydrophobicContact CB-CD2 4.13Å
465	Y	95.2	Very high	86.8	Confident	80 Å²	80	39.6 Å²	39.6	31%	0.314	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	108.1	169.1	-66.9	-96.2	0	0	0	108.5	M155 A159 N217	M155-Y465 HydrophobicContact CE-CD2 3.53Å; M155-Y465 HydrophobicContact CE-CE2 3.22Å; M155-Y465 WeakPolarHBondContact O-CD1 3.46Å; M155-Y465 HydrophobicContact SD-CD2 4.11Å; M155-Y465 HydrophobicContact SD-CE2 4.36Å; A159-Y465 HydrophobicContact CB-CD1 4.12Å; A159-Y465 HydrophobicContact CB-CE1 3.82Å; N217-Y465 PolarHBondContact ND2-O 3.18Å; N217-Y465 PolarHBondContact OD1-N 3.04Å
466	L	93.6	Very high	86.9	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	144.9	179.4	-57.2	-176.9	0	0	0	110.5	G157 T158 T160 V162 R185 L196 P240 L464 L470	G157-L466 WeakPolarHBondContact CA-O 3.4Å; T158-L466 PolarHBondContact N-O 3.12Å; T158-L466 PolarHBondContact O-N 3.06Å; T160-L466 HydrophobicContact CG2-CD1 3.67Å; T160-L466 HydrophobicContact CG2-CG 4.42Å; V162-L466 HydrophobicContact CG2-CD1 4.25Å; R185-L466 HydrophobicContact CB-CD1 4.24Å; L196-L466 HydrophobicContact CD1-CD1 4.14Å; P240-L466 HydrophobicContact CB-CD2 3.56Å; L464-L466 HydrophobicContact CB-CD2 4.13Å; L466-L470 HydrophobicContact CB-CD1 3.98Å; L466-L470 HydrophobicContact CB-CD2 4.42Å; L466-L470 HydrophobicContact CB-CG 4.41Å; L466-L470 HydrophobicContact CD1-CD1 3.71Å; L466-L470 HydrophobicContact CG-CD1 4.4Å
467	P	89.3	Confident	87.1	Confident	38 Å²	38	43.6 Å²	43.6	25%	0.247	24%	0.24	C	C	.	.			trans	-57.3	147.1	170.4	-22.2	32.9	0	0	0	111.7	P240 S469	P240-P467 VanDerWaalsContact O-CD 3.27Å; P240-P467 WeakPolarHBondContact O-CD 3.4Å; P240-P467 WeakPolarHBondContact O-CG 3.29Å; P467-S469 PolarHBondContact O-N 3.26Å
468	N	78.6	Confident	87.2	Confident	136 Å²	136	41.5 Å²	41.5	73%	0.727	23%	0.233	S	C	*	.	S	Bend	trans	-66	-21.8	-179.7	-67	-16.1	0	0	0	113.2	T158	T158-N468 PolarHBondContact OG1-OD1 3.27Å; T158-N468 VanDerWaalsContact OG1-OD1 3.05Å
469	S	68.7	Low	87.4	Confident	105 Å²	105	43.5 Å²	43.5	73%	0.734	24%	0.244	S	C	*	.			trans	-114.7	102	169.7	58.1	0	0	0	0	108.2	P467	P467-S469 PolarHBondContact O-N 3.26Å
470	L	57.4	Low	87.1	Confident	102 Å²	102	47.5 Å²	47.5	53%	0.534	27%	0.266	S	S	.	.			trans	-94.2	0	171	-79.3	164.2	0	0	0	110.6	L196 L466	L196-L470 HydrophobicContact CD1-CD1 3.92Å; L196-L470 HydrophobicContact CD1-CD2 4.01Å; L466-L470 HydrophobicContact CB-CD1 3.98Å; L466-L470 HydrophobicContact CB-CD2 4.42Å; L466-L470 HydrophobicContact CB-CG 4.41Å; L466-L470 HydrophobicContact CD1-CD1 3.71Å; L466-L470 HydrophobicContact CG-CD1 4.4Å

Retrieved 470 of 470 residues in 996.7 ms (Link to these results)

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