A0A096NXL6_PAPAN Loading...

SLIT and NTRK like family member 1

AlphaFold DB (F6S8N3), UniProt , Accession A0A096NXL6, Species PAPAN (Papio anubis, Olive baboon), Gene SLITRK1, Length 696 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	51.7	Low	45.8	Very low	194 Å²	194	123.1 Å²	123.1	96%	0.956	63%	0.625	S	S	*	*				0	-73.6	0	-76.4	176.8	69.4	0	0	112.2	L3 W4 I5	M1-L3 VanDerWaalsContact C-N 3.31Å; M1-L3 PolarHBondContact O-N 3.43Å; M1-L3 VanDerWaalsContact O-N 3.11Å; M1-W4 WeakPolarHBondContact O-CA 3.02Å; M1-W4 WeakPolarHBondContact O-CB 3.4Å; M1-W4 PolarHBondContact O-N 2.92Å; M1-I5 PolarHBondContact O-N 3.48Å
2	L	49.9	Very low	45	Very low	145 Å²	145	122.6 Å²	122.6	76%	0.759	62%	0.624	S	S	*	*	H	α-helix	trans	-48.4	-43.7	-175.1	-81.5	152.9	0	0	0	115.2	W4 I5 L6	L2-W4 VanDerWaalsContact C-N 3.26Å; L2-W4 PolarHBondContact O-N 2.92Å; L2-I5 PolarHBondContact O-N 2.99Å; L2-I5 VanDerWaalsContact O-N 3.11Å; L2-L6 PolarHBondContact O-N 2.03Å
3	L	43.8	Very low	44.5	Very low	134 Å²	134	120.8 Å²	120.8	70%	0.702	63%	0.628	S	S	*	*	H	α-helix	trans	-64.1	-26	177.8	-154.3	75.6	0	0	0	114.2	M1 L7	M1-L3 VanDerWaalsContact C-N 3.31Å; M1-L3 PolarHBondContact O-N 3.43Å; M1-L3 VanDerWaalsContact O-N 3.11Å; L3-L7 WeakPolarHBondContact O-CG 3.36Å; L3-L7 PolarHBondContact O-N 3.42Å
4	W	47.2	Very low	44	Very low	192 Å²	192	126.1 Å²	126.1	73%	0.727	64%	0.644	S	S	*	*	H	α-helix	trans	-79.2	-27.1	174.5	-88.1	58.4	0	0	0	112.6	M1 L2 L7 L8	M1-W4 WeakPolarHBondContact O-CA 3.02Å; M1-W4 WeakPolarHBondContact O-CB 3.4Å; M1-W4 PolarHBondContact O-N 2.92Å; L2-W4 VanDerWaalsContact C-N 3.26Å; L2-W4 PolarHBondContact O-N 2.92Å; W4-L7 PolarHBondContact O-N 3.5Å; W4-L8 WeakPolarHBondContact O-CB 3.14Å; W4-L8 PolarHBondContact O-N 3.05Å
5	I	53.4	Low	43.6	Very low	93 Å²	93	123.2 Å²	123.2	48%	0.477	65%	0.647	S	S	.	*	H	α-helix	trans	-70.7	-45.4	177.1	-60.7	172.6	0	0	0	109.5	M1 L2 L7 L8 E9	M1-I5 PolarHBondContact O-N 3.48Å; L2-I5 PolarHBondContact O-N 2.99Å; L2-I5 VanDerWaalsContact O-N 3.11Å; I5-L7 VanDerWaalsContact C-N 3.33Å; I5-L7 PolarHBondContact O-N 3.42Å; I5-L8 WeakPolarHBondContact O-CB 3.02Å; I5-L8 PolarHBondContact O-N 2.84Å; I5-L8 VanDerWaalsContact O-N 3.13Å; I5-E9 PolarHBondContact O-N 3.17Å
6	L	48.1	Very low	43.1	Very low	106 Å²	106	120.9 Å²	120.9	56%	0.555	65%	0.651	S	S	*	*	H	α-helix	trans	-58.4	-41.6	172	-96.1	138.5	0	0	0	112.7	L2 L8 E9 T10	L2-L6 PolarHBondContact O-N 2.03Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L8 PolarHBondContact O-N 3.37Å; L6-E9 PolarHBondContact O-N 3.35Å; L6-T10 WeakPolarHBondContact O-CG2 3.47Å; L6-T10 PolarHBondContact O-N 3.21Å; L6-T10 PolarHBondContact O-OG1 2.92Å
7	L	46.4	Very low	42.8	Very low	102 Å²	102	117.2 Å²	117.2	53%	0.534	65%	0.648	S	S	.	*	H	α-helix	trans	-64.3	-38.7	174.9	-78.4	167.1	0	0	0	112.1	L3 W4 I5 T10 S11	L3-L7 WeakPolarHBondContact O-CG 3.36Å; L3-L7 PolarHBondContact O-N 3.42Å; W4-L7 PolarHBondContact O-N 3.5Å; I5-L7 VanDerWaalsContact C-N 3.33Å; I5-L7 PolarHBondContact O-N 3.42Å; L7-T10 WeakPolarHBondContact CA-OG1 3.04Å; L7-T10 PolarHBondContact O-N 2.94Å; L7-T10 PolarHBondContact O-OG1 2.85Å; L7-S11 PolarHBondContact O-N 2.7Å
8	L	42.7	Very low	43	Very low	95 Å²	95	118.5 Å²	118.5	50%	0.497	65%	0.654	S	S	.	*	H	α-helix	trans	-63.9	-43.6	174.9	-106.1	141	0	0	0	112.5	W4 I5 L6 T10 S11 L12	W4-L8 WeakPolarHBondContact O-CB 3.14Å; W4-L8 PolarHBondContact O-N 3.05Å; I5-L8 WeakPolarHBondContact O-CB 3.02Å; I5-L8 PolarHBondContact O-N 2.84Å; I5-L8 VanDerWaalsContact O-N 3.13Å; L6-L8 VanDerWaalsContact C-N 3.34Å; L6-L8 PolarHBondContact O-N 3.37Å; L8-T10 PolarHBondContact O-N 3.21Å; L8-S11 PolarHBondContact O-N 2.04Å; L8-S11 VanDerWaalsContact O-N 3.14Å; L8-S11 PolarHBondContact O-OG 3.35Å; L8-L12 HydrophobicContact CD2-CD1 4.4Å; L8-L12 PolarHBondContact O-N 3.42Å
9	E	38.9	Very low	43.6	Very low	129 Å²	129	119.2 Å²	119.2	60%	0.603	66%	0.661	S	S	*	*	H	α-helix	trans	-59.8	-44.7	172.8	-72.1	-173	153.8	0	0	111.3	I5 L6 S11 L12 C13	I5-E9 PolarHBondContact O-N 3.17Å; L6-E9 PolarHBondContact O-N 3.35Å; E9-S11 VanDerWaalsContact C-N 3.27Å; E9-S11 PolarHBondContact O-N 3.22Å; E9-L12 PolarHBondContact O-N 2.9Å; E9-C13 PolarHBondContact O-N 2.62Å
10	T	42.7	Very low	44.8	Very low	89 Å²	89	115.5 Å²	115.5	55%	0.546	64%	0.642	S	S	.	*	H	α-helix	trans	-65.9	-25.5	175.6	58.4	0	0	0	0	114.1	L6 L7 L8	L6-T10 WeakPolarHBondContact O-CG2 3.47Å; L6-T10 PolarHBondContact O-N 3.21Å; L6-T10 PolarHBondContact O-OG1 2.92Å; L7-T10 WeakPolarHBondContact CA-OG1 3.04Å; L7-T10 PolarHBondContact O-N 2.94Å; L7-T10 PolarHBondContact O-OG1 2.85Å; L8-T10 PolarHBondContact O-N 3.21Å
11	S	38.6	Very low	46.3	Very low	75 Å²	75	110.2 Å²	110.2	52%	0.524	61%	0.614	S	S	.	*	H	α-helix	trans	-85.3	-21	175.6	74.9	0	0	0	0	114	L7 L8 E9	L7-S11 PolarHBondContact O-N 2.7Å; L8-S11 PolarHBondContact O-N 2.04Å; L8-S11 VanDerWaalsContact O-N 3.14Å; L8-S11 PolarHBondContact O-OG 3.35Å; E9-S11 VanDerWaalsContact C-N 3.27Å; E9-S11 PolarHBondContact O-N 3.22Å
12	L	37	Very low	48.1	Very low	117 Å²	117	101.6 Å²	101.6	61%	0.613	57%	0.572	S	S	*	*	H	α-helix	trans	-79.9	-19.3	176.7	-83.3	160.3	0	0	0	113	L8 E9 F14 A15	L8-L12 HydrophobicContact CD2-CD1 4.4Å; L8-L12 PolarHBondContact O-N 3.42Å; E9-L12 PolarHBondContact O-N 2.9Å; L12-F14 PolarHBondContact O-N 2.93Å; L12-A15 PolarHBondContact O-N 2.87Å
13	C	38	Very low	50	Low	99 Å²	99	94.8 Å²	94.8	67%	0.669	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-67	-9	173.5	-79	0	0	0	0	115	E9	E9-C13 PolarHBondContact O-N 2.62Å
14	F	37.7	Very low	52.1	Low	195 Å²	195	89.7 Å²	89.7	86%	0.855	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-96.7	19.5	176.2	-83.9	-81.4	0	0	0	114.4	L12	L12-F14 PolarHBondContact O-N 2.93Å
15	A	37.8	Very low	54	Low	83 Å²	83	88 Å²	88	69%	0.686	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-125.8	22.8	170.9	0	0	0	0	0	113.3	L12 G17	L12-A15 PolarHBondContact O-N 2.87Å; A15-G17 VanDerWaalsContact C-N 3.34Å; A15-G17 PolarHBondContact O-N 2.93Å
16	A	35.2	Very low	55.5	Low	87 Å²	87	89.1 Å²	89.1	72%	0.719	51%	0.512	S	S	*	.			trans	-71	89.2	168.4	0	0	0	0	0	109.9
17	G	38.5	Very low	57.2	Low	57 Å²	57	92.4 Å²	92.4	59%	0.588	52%	0.522	S	S	*	.			trans	-55.8	146.5	164.7	0	0	0	0	0	110.2	A15 V19	A15-G17 VanDerWaalsContact C-N 3.34Å; A15-G17 PolarHBondContact O-N 2.93Å; G17-V19 WeakPolarHBondContact O-CG2 3.44Å; G17-V19 PolarHBondContact O-N 3.49Å
18	N	46.2	Very low	59.2	Low	141 Å²	141	89.7 Å²	89.7	75%	0.754	51%	0.508	S	S	*	.			trans	-60.1	97.6	-172.9	-121.8	6.8	0	0	0	110.9	T20	N18-T20 VanDerWaalsContact C-N 3.34Å; N18-T20 PolarHBondContact O-N 3.34Å
19	V	55	Low	61.5	Low	132 Å²	132	85.5 Å²	85.5	80%	0.8	49%	0.486	S	S	*	.			trans	-74.6	91.4	175.5	-175.4	0	0	0	0	107.5	G17	G17-V19 WeakPolarHBondContact O-CG2 3.44Å; G17-V19 PolarHBondContact O-N 3.49Å
20	T	68.1	Low	64	Low	44 Å²	44	81.7 Å²	81.7	27%	0.27	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-87.4	118.3	179.3	43.1	0	0	0	0	109.8	N18 R52 T54	N18-T20 VanDerWaalsContact C-N 3.34Å; N18-T20 PolarHBondContact O-N 3.34Å; T20-R52 CarbonylContact C-O 3.43Å; T20-R52 VanDerWaalsContact CA-O 3.25Å; T20-R52 WeakPolarHBondContact CA-O 3.07Å; T20-T54 WeakPolarHBondContact OG1-CG2 3.29Å
21	G	76.3	Confident	66.3	Low	6 Å²	6	79.2 Å²	79.2	6%	0.062	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	128.2	-175.7	0	0	0	0	0	112	V23 E26 R52 F53 T54	G21-V23 PolarHBondContact O-N 3.34Å; G21-E26 VanDerWaalsContact CA-OE1 3.27Å; G21-E26 WeakPolarHBondContact CA-OE1 3.35Å; G21-E26 WeakPolarHBondContact CA-OE2 3.05Å; G21-R52 PolarHBondContact N-O 2.65Å; G21-F53 CarbonylContact O-C 3.39Å; G21-F53 VanDerWaalsContact O-CA 3.24Å; G21-F53 WeakPolarHBondContact O-CA 3.26Å; G21-T54 PolarHBondContact O-N 3.25Å
22	D	87.8	Confident	68.6	Low	13 Å²	13	79.6 Å²	79.6	7%	0.07	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	116.1	177.6	177.3	-52.1	0	0	0	109.8	C24 K25 E26 T54	D22-C24 PolarHBondContact O-N 2.85Å; D22-C24 WeakPolarHBondContact OD1-CA 3.44Å; D22-C24 PolarHBondContact OD1-N 3.09Å; D22-K25 HydrophobicContact CB-CB 3.97Å; D22-K25 HydrophobicContact CB-CD 4.15Å; D22-K25 HydrophobicContact CB-CG 4.12Å; D22-K25 PolarHBondContact O-N 3.26Å; D22-K25 PolarHBondContact OD1-N 2.84Å; D22-K25 IonicContact OD2-NZ 2.74Å; D22-K25 PolarHBondContact OD2-NZ 2.89Å; D22-E26 WeakPolarHBondContact O-CB 3.04Å; D22-E26 PolarHBondContact O-N 3.32Å; D22-T54 WeakPolarHBondContact CA-O 3.34Å; D22-T54 WeakPolarHBondContact CA-OG1 3.27Å
23	V	89.9	Confident	70.8	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.006	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.4	-170.6	-61.5	0	0	0	0	113.9	G21 I28 C29 V40 F53 T54 A55	G21-V23 PolarHBondContact O-N 3.34Å; V23-I28 PolarHBondContact O-N 3.06Å; V23-C29 HydrophobicContact CB-CB 4.12Å; V23-C29 HydrophobicContact CG2-CB 4.43Å; V23-C29 PolarHBondContact O-N 3.36Å; V23-V40 HydrophobicContact CG2-CG1 3.84Å; V23-F53 HydrophobicContact CG1-CB 3.77Å; V23-F53 HydrophobicContact CG1-CD1 4.45Å; V23-F53 HydrophobicContact CG1-CG 4.14Å; V23-T54 PolarHBondContact N-O 2.95Å; V23-A55 HydrophobicContact CG2-CB 4.42Å
24	C	88.2	Confident	72.3	Confident	28 Å²	28	79 Å²	79	19%	0.189	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-47	179.8	-60.5	0	0	0	0	111.9	D22 E26 K27 C31 P56	D22-C24 PolarHBondContact O-N 2.85Å; D22-C24 WeakPolarHBondContact OD1-CA 3.44Å; D22-C24 PolarHBondContact OD1-N 3.09Å; C24-E26 VanDerWaalsContact C-N 3.33Å; C24-E26 PolarHBondContact O-N 3.01Å; C24-K27 PolarHBondContact O-N 3.01Å; C24-K27 VanDerWaalsContact O-N 3.14Å; C24-C31 WeakPolarHBondContact CA-SG 3.44Å; C24-C31 HydrophobicContact CB-CB 3.71Å; C24-C31 WeakPolarHBondContact CB-SG 3.37Å; C24-C31 WeakPolarHBondContact SG-CB 3.43Å; C24-C31 CovalentContact SG-SG 2.03Å; C24-C31 PolarHBondContact SG-SG 3.3Å; C24-P56 HydrophobicContact CB-CG 4.05Å; C24-P56 WeakPolarHBondContact SG-CG 3.43Å
25	K	86.6	Confident	73.3	Confident	156 Å²	156	75.6 Å²	75.6	68%	0.678	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-37.8	180	-62.2	-178.4	-175.9	92.5	0	111.7	D22 K27	D22-K25 HydrophobicContact CB-CB 3.97Å; D22-K25 HydrophobicContact CB-CD 4.15Å; D22-K25 HydrophobicContact CB-CG 4.12Å; D22-K25 PolarHBondContact O-N 3.26Å; D22-K25 PolarHBondContact OD1-N 2.84Å; D22-K25 IonicContact OD2-NZ 2.74Å; D22-K25 PolarHBondContact OD2-NZ 2.89Å; K25-K27 VanDerWaalsContact C-N 3.3Å
26	E	85.3	Confident	74.5	Confident	116 Å²	116	74.5 Å²	74.5	54%	0.542	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	0.6	177	-63.6	178.9	-163.6	0	0	113	G21 D22 C24 I28	G21-E26 VanDerWaalsContact CA-OE1 3.27Å; G21-E26 WeakPolarHBondContact CA-OE1 3.35Å; G21-E26 WeakPolarHBondContact CA-OE2 3.05Å; D22-E26 WeakPolarHBondContact O-CB 3.04Å; D22-E26 PolarHBondContact O-N 3.32Å; C24-E26 VanDerWaalsContact C-N 3.33Å; C24-E26 PolarHBondContact O-N 3.01Å; E26-I28 HydrophobicContact CB-CD1 4.15Å; E26-I28 HydrophobicContact CB-CG1 3.88Å; E26-I28 PolarHBondContact O-N 3.17Å
27	K	84.6	Confident	76.3	Confident	176 Å²	176	73 Å²	73	77%	0.765	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	31.4	177.9	-55.2	-176.3	178.6	-176.2	0	114.2	C24 K25	C24-K27 PolarHBondContact O-N 3.01Å; C24-K27 VanDerWaalsContact O-N 3.14Å; K25-K27 VanDerWaalsContact C-N 3.3Å
28	I	87.7	Confident	78.5	Confident	45 Å²	45	70.9 Å²	70.9	23%	0.231	38%	0.38	C	S	.	.	S	Bend	trans	-68.5	-44.5	175.4	-47.8	179.2	0	0	0	108.9	V23 E26 K45 F47 F53	V23-I28 PolarHBondContact O-N 3.06Å; E26-I28 HydrophobicContact CB-CD1 4.15Å; E26-I28 HydrophobicContact CB-CG1 3.88Å; E26-I28 PolarHBondContact O-N 3.17Å; I28-K45 WeakPolarHBondContact O-CD 3.38Å; I28-K45 VanDerWaalsContact O-CE 3.25Å; I28-K45 WeakPolarHBondContact O-CE 3.31Å; I28-K45 PolarHBondContact O-NZ 3.03Å; I28-F47 HydrophobicContact CG2-CE1 3.88Å; I28-F47 HydrophobicContact CG2-CZ 3.71Å; I28-F53 HydrophobicContact CD1-CD1 3.82Å; I28-F53 HydrophobicContact CD1-CE1 3.68Å
29	C	91.6	Very high	80.3	Confident	6 Å²	6	65.6 Å²	65.6	4%	0.041	35%	0.351	C	S	.	.	S	Bend	trans	-108.4	160.9	173.7	-60.8	0	0	0	0	110.9	V23 V40 D41 C42	V23-C29 HydrophobicContact CB-CB 4.12Å; V23-C29 HydrophobicContact CG2-CB 4.43Å; V23-C29 PolarHBondContact O-N 3.36Å; C29-V40 HydrophobicContact CB-CG1 4.19Å; C29-D41 CarbonylContact C-O 3.39Å; C29-D41 WeakPolarHBondContact CA-O 3.26Å; C29-D41 WeakPolarHBondContact CB-O 3.05Å; C29-C42 HydrophobicContact CB-CB 4.12Å; C29-C42 WeakPolarHBondContact CB-SG 3.45Å; C29-C42 WeakPolarHBondContact SG-CB 3.37Å; C29-C42 CovalentContact SG-SG 2.03Å; C29-C42 PolarHBondContact SG-SG 3.42Å
30	S	90.7	Very high	82	Confident	49 Å²	49	59.3 Å²	59.3	34%	0.343	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116.5	171.8	-169.2	0	0	0	0	108.6	N32 D41	S30-N32 PolarHBondContact OG-ND2 3.45Å; S30-N32 VanDerWaalsContact OG-ND2 3.16Å; S30-D41 PolarHBondContact N-O 2.95Å; S30-D41 PolarHBondContact O-N 3.43Å
31	C	91.2	Very high	82.9	Confident	38 Å²	38	60.3 Å²	60.3	26%	0.257	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	110.3	179.9	-54.1	0	0	0	0	109.4	C24 L38 H39	C24-C31 WeakPolarHBondContact CA-SG 3.44Å; C24-C31 HydrophobicContact CB-CB 3.71Å; C24-C31 WeakPolarHBondContact CB-SG 3.37Å; C24-C31 WeakPolarHBondContact SG-CB 3.43Å; C24-C31 CovalentContact SG-SG 2.03Å; C24-C31 PolarHBondContact SG-SG 3.3Å; C31-L38 HydrophobicContact CB-CD1 4.26Å; C31-H39 WeakPolarHBondContact CA-O 3.27Å
32	N	86.4	Confident	83.6	Confident	82 Å²	82	60 Å²	60	44%	0.439	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.3	-174.4	-57.7	-51.5	0	0	0	109.7	S30 H39	S30-N32 PolarHBondContact OG-ND2 3.45Å; S30-N32 VanDerWaalsContact OG-ND2 3.16Å; N32-H39 PolarHBondContact N-O 3.13Å; N32-H39 PolarHBondContact O-N 2.96Å
33	E	84.1	Confident	83.6	Confident	130 Å²	130	62 Å²	62	61%	0.607	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	126.1	167.9	-66.6	177.3	163.9	0	0	109.1	L38 Q59	E33-L38 HydrophobicContact CG-CD1 4.02Å; E33-Q59 PolarHBondContact OE1-NE2 2.95Å
34	I	69.3	Low	83.3	Confident	73 Å²	73	67.7 Å²	67.7	37%	0.374	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	114.9	177.7	-58.8	-179.1	0	0	0	107.3	G36 D37 H39	I34-G36 PolarHBondContact O-N 3.37Å; I34-D37 PolarHBondContact N-O 3.49Å; I34-D37 PolarHBondContact O-N 3.24Å; I34-H39 HydrophobicContact CD1-CB 4.29Å
35	E	59.1	Low	83.3	Confident	125 Å²	125	71 Å²	71	58%	0.584	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	0	177	-54.1	-163.7	127	0	0	117.3	Q460 L482	E35-Q460 VanDerWaalsContact CD-NE2 3.28Å; E35-Q460 PolarHBondContact OE1-NE2 3.46Å; E35-Q460 PolarHBondContact OE2-NE2 2.99Å; E35-L482 HydrophobicContact CB-CD1 4.07Å; E35-L482 WeakPolarHBondContact OE2-CD1 3.31Å
36	G	63.6	Low	83.5	Confident	60 Å²	60	65.6 Å²	65.6	62%	0.619	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	141.5	-25.3	179.4	0	0	0	0	0	112.2	I34	I34-G36 PolarHBondContact O-N 3.37Å
37	D	72.9	Confident	83.8	Confident	55 Å²	55	60.9 Å²	60.9	29%	0.294	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	-172.6	-63.9	-57.6	0	0	0	112.1	I34 H39	I34-D37 PolarHBondContact N-O 3.49Å; I34-D37 PolarHBondContact O-N 3.24Å; D37-H39 PolarHBondContact O-N 2.8Å; D37-H39 PolarHBondContact O-ND1 3.39Å
38	L	83.9	Confident	84	Confident	12 Å²	12	57.2 Å²	57.2	6%	0.063	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.4	-180	-179.5	65.3	0	0	0	110.3	C31 E33 V40 P56 Y61 H62	C31-L38 HydrophobicContact CB-CD1 4.26Å; E33-L38 HydrophobicContact CG-CD1 4.02Å; L38-V40 HydrophobicContact CD2-CG2 4.41Å; L38-V40 HydrophobicContact CG-CG2 4.28Å; L38-P56 HydrophobicContact CD2-CB 3.95Å; L38-P56 HydrophobicContact CD2-CG 3.86Å; L38-Y61 CarbonylContact O-C 3.58Å; L38-Y61 WeakPolarHBondContact O-CA 3.36Å; L38-Y61 WeakPolarHBondContact O-CB 3.31Å; L38-H62 PolarHBondContact O-N 3.02Å
39	H	83.8	Confident	84.1	Confident	31 Å²	31	56.8 Å²	56.8	14%	0.144	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	117.9	177.4	-71.5	58.6	0	0	0	109.3	C31 N32 I34 D37 H62 F64	C31-H39 WeakPolarHBondContact CA-O 3.27Å; N32-H39 PolarHBondContact N-O 3.13Å; N32-H39 PolarHBondContact O-N 2.96Å; I34-H39 HydrophobicContact CD1-CB 4.29Å; D37-H39 PolarHBondContact O-N 2.8Å; D37-H39 PolarHBondContact O-ND1 3.39Å; H39-H62 AromaticContact CE1-CD2 3.85Å; H39-F64 HydrophobicContact CB-CE2 4.07Å; H39-F64 AromaticContact CD2-CE2 3.57Å; H39-F64 AromaticContact CD2-CZ 3.77Å
40	V	90.4	Very high	84.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	92	-179.1	-179.4	0	0	0	0	108.9	V23 C29 L38 Y61 H62 L63 F64	V23-V40 HydrophobicContact CG2-CG1 3.84Å; C29-V40 HydrophobicContact CB-CG1 4.19Å; L38-V40 HydrophobicContact CD2-CG2 4.41Å; L38-V40 HydrophobicContact CG-CG2 4.28Å; V40-Y61 HydrophobicContact CB-CD2 4.44Å; V40-Y61 HydrophobicContact CG2-CD2 3.92Å; V40-Y61 HydrophobicContact CG2-CG 3.95Å; V40-H62 PolarHBondContact N-O 2.93Å; V40-L63 HydrophobicContact CB-CD1 4.09Å; V40-L63 HydrophobicContact CG1-CD1 3.79Å; V40-F64 PolarHBondContact O-N 3.21Å
41	D	87.6	Confident	83.9	Confident	64 Å²	64	58.5 Å²	58.5	34%	0.342	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	108.5	-178.8	173.9	16.7	0	0	0	112.3	C29 S30 E43	C29-D41 CarbonylContact C-O 3.39Å; C29-D41 WeakPolarHBondContact CA-O 3.26Å; C29-D41 WeakPolarHBondContact CB-O 3.05Å; S30-D41 PolarHBondContact N-O 2.95Å; S30-D41 PolarHBondContact O-N 3.43Å; D41-E43 WeakPolarHBondContact OD1-CB 3.47Å; D41-E43 PolarHBondContact OD1-N 3.27Å
42	C	91.4	Very high	83.7	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.007	34%	0.343	C	S	.	.			trans	-115.1	27.6	174.4	-55.7	0	0	0	0	112.3	C29 K44 K45 F47 F64 L65 N68	C29-C42 HydrophobicContact CB-CB 4.12Å; C29-C42 WeakPolarHBondContact CB-SG 3.45Å; C29-C42 WeakPolarHBondContact SG-CB 3.37Å; C29-C42 CovalentContact SG-SG 2.03Å; C29-C42 PolarHBondContact SG-SG 3.42Å; C42-K44 PolarHBondContact O-N 2.86Å; C42-K45 HydrophobicContact CB-CG 4.21Å; C42-K45 VanDerWaalsContact O-CG 3.32Å; C42-K45 WeakPolarHBondContact O-CG 3.47Å; C42-F47 HydrophobicContact CB-CD2 4.37Å; C42-F47 HydrophobicContact CB-CE2 3.74Å; C42-F64 CarbonylContact C-O 3.43Å; C42-F64 VanDerWaalsContact C-O 3.28Å; C42-F64 VanDerWaalsContact CA-O 3.22Å; C42-F64 WeakPolarHBondContact CA-O 3.05Å; C42-F64 VanDerWaalsContact CB-O 3.24Å; C42-F64 WeakPolarHBondContact CB-O 3.38Å; C42-F64 PolarHBondContact N-O 3.15Å; C42-L65 HydrophobicContact CB-CD2 3.85Å; C42-N68 PolarHBondContact O-ND2 3.32Å
43	E	86.7	Confident	83.9	Confident	53 Å²	53	64 Å²	64	25%	0.248	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	134	177.5	-179	175.3	-125.6	0	0	111	D41 K45 H66 K386	D41-E43 WeakPolarHBondContact OD1-CB 3.47Å; D41-E43 PolarHBondContact OD1-N 3.27Å; E43-K45 PolarHBondContact O-N 2.77Å; E43-H66 WeakPolarHBondContact CG-ND1 3.22Å; E43-H66 IonicContact OE1-CE1 2.64Å; E43-H66 PolarHBondContact OE1-CE1 2.84Å; E43-H66 IonicContact OE1-ND1 3.31Å; E43-H66 PolarHBondContact OE1-ND1 3.18Å; E43-K386 IonicContact OE1-NZ 3.02Å; E43-K386 PolarHBondContact OE1-NZ 3.3Å; E43-K386 IonicContact OE2-NZ 3.93Å
44	K	84.6	Confident	84.1	Confident	122 Å²	122	59.4 Å²	59.4	53%	0.53	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	26.4	169	-66.6	157.8	-168.6	146.5	0	116	C42 G46 H66	C42-K44 PolarHBondContact O-N 2.86Å; K44-G46 PolarHBondContact O-N 3.05Å; K44-H66 PolarHBondContact N-O 2.89Å
45	K	88.6	Confident	85	Confident	96 Å²	96	56 Å²	56	42%	0.417	30%	0.295	S	S	.	.	S	Bend	trans	-71	-11.7	174.8	-57	-66.5	173.7	158.3	0	113.6	I28 C42 E43 F47 N68	I28-K45 WeakPolarHBondContact O-CD 3.38Å; I28-K45 VanDerWaalsContact O-CE 3.25Å; I28-K45 WeakPolarHBondContact O-CE 3.31Å; I28-K45 PolarHBondContact O-NZ 3.03Å; C42-K45 HydrophobicContact CB-CG 4.21Å; C42-K45 VanDerWaalsContact O-CG 3.32Å; C42-K45 WeakPolarHBondContact O-CG 3.47Å; E43-K45 PolarHBondContact O-N 2.77Å; K45-F47 HydrophobicContact CB-CD1 3.83Å; K45-F47 HydrophobicContact CB-CD2 4.26Å; K45-F47 HydrophobicContact CB-CE1 3.61Å; K45-F47 HydrophobicContact CB-CE2 4.08Å; K45-F47 HydrophobicContact CB-CG 4.16Å; K45-F47 HydrophobicContact CB-CZ 3.75Å; K45-F47 HydrophobicContact CG-CE1 4.38Å; K45-F47 HydrophobicContact CG-CE2 4.31Å; K45-F47 HydrophobicContact CG-CZ 4.06Å; K45-N68 WeakPolarHBondContact CA-OD1 3.39Å; K45-N68 PolarHBondContact N-OD1 3.01Å
46	G	89.4	Confident	86.2	Confident	43 Å²	43	50.8 Å²	50.8	44%	0.443	27%	0.271	S	S	.	.			trans	80.3	20.4	-178.9	0	0	0	0	0	113.7	K44 T48 N68	K44-G46 PolarHBondContact O-N 3.05Å; G46-T48 PolarHBondContact O-N 2.95Å; G46-N68 PolarHBondContact N-OD1 2.92Å
47	F	91.4	Very high	87.2	Confident	17 Å²	17	51.9 Å²	51.9	8%	0.075	27%	0.267	C	S	.	.			trans	-62.4	133.9	-178.8	-63.3	-24	0	0	0	112.1	I28 C42 K45 L50 F53 L65 N68 S69 L70	I28-F47 HydrophobicContact CG2-CE1 3.88Å; I28-F47 HydrophobicContact CG2-CZ 3.71Å; C42-F47 HydrophobicContact CB-CD2 4.37Å; C42-F47 HydrophobicContact CB-CE2 3.74Å; K45-F47 HydrophobicContact CB-CD1 3.83Å; K45-F47 HydrophobicContact CB-CD2 4.26Å; K45-F47 HydrophobicContact CB-CE1 3.61Å; K45-F47 HydrophobicContact CB-CE2 4.08Å; K45-F47 HydrophobicContact CB-CG 4.16Å; K45-F47 HydrophobicContact CB-CZ 3.75Å; K45-F47 HydrophobicContact CG-CE1 4.38Å; K45-F47 HydrophobicContact CG-CE2 4.31Å; K45-F47 HydrophobicContact CG-CZ 4.06Å; F47-L50 HydrophobicContact CB-CD2 4.36Å; F47-L50 HydrophobicContact CD2-CD2 3.7Å; F47-L50 HydrophobicContact CE2-CD2 4.23Å; F47-L50 HydrophobicContact CG-CD2 4.27Å; F47-F53 AromaticContact CD1-CE2 3.93Å; F47-F53 HydrophobicContact CD1-CE2 3.93Å; F47-F53 HydrophobicContact CD1-CZ 4.35Å; F47-F53 AromaticContact CE1-CE2 3.81Å; F47-F53 HydrophobicContact CE1-CE2 3.81Å; F47-F53 AromaticContact CE1-CZ 3.96Å; F47-F53 HydrophobicContact CE1-CZ 3.96Å; F47-F53 HydrophobicContact CG-CE2 4.44Å; F47-F53 HydrophobicContact CZ-CE2 4.21Å; F47-L65 HydrophobicContact CD2-CD2 3.76Å; F47-L65 HydrophobicContact CE2-CD2 4.15Å; F47-N68 HydrophobicContact CB-CB 4.24Å; F47-N68 PolarHBondContact N-OD1 3.11Å; F47-S69 CarbonylContact O-C 3.46Å; F47-S69 VanDerWaalsContact O-CA 3.29Å; F47-S69 WeakPolarHBondContact O-CA 3.49Å; F47-S69 PolarHBondContact O-N 3.44Å; F47-L70 HydrophobicContact CB-CD2 4.31Å; F47-L70 PolarHBondContact O-N 2.96Å
48	T	90.6	Very high	87.6	Confident	100 Å²	100	54.1 Å²	54.1	61%	0.613	29%	0.286	S	S	*	.	S	Bend	trans	-113.8	-13.9	175.3	52.6	0	0	0	0	113.1	G46	G46-T48 PolarHBondContact O-N 2.95Å
49	S	89.8	Confident	87.6	Confident	36 Å²	36	57.1 Å²	57.1	25%	0.252	30%	0.3	S	S	.	.			trans	-160.9	152	175.7	171.4	0	0	0	0	108.8	E77	S49-E77 WeakPolarHBondContact CA-OE1 3.29Å; S49-E77 VanDerWaalsContact CB-OE1 3.25Å; S49-E77 WeakPolarHBondContact CB-OE1 3.31Å; S49-E77 PolarHBondContact OG-OE1 3.25Å
50	L	90.1	Very high	87.7	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	32%	0.319	C	S	.	.			trans	-113	-10.2	-177.5	-62.4	171.5	0	0	0	113.6	F47 R52 F53 L65 L70 E77 F78 F81	F47-L50 HydrophobicContact CB-CD2 4.36Å; F47-L50 HydrophobicContact CD2-CD2 3.7Å; F47-L50 HydrophobicContact CE2-CD2 4.23Å; F47-L50 HydrophobicContact CG-CD2 4.27Å; L50-R52 PolarHBondContact O-N 3.06Å; L50-F53 HydrophobicContact CD2-CD2 4.21Å; L50-F53 PolarHBondContact O-N 2.96Å; L50-L65 HydrophobicContact CD1-CD1 3.59Å; L50-L65 HydrophobicContact CD1-CD2 4.22Å; L50-L65 HydrophobicContact CD2-CD2 3.89Å; L50-L70 HydrophobicContact CD1-CD1 4.19Å; L50-L70 HydrophobicContact CG-CD2 4.3Å; L50-E77 HydrophobicContact CB-CG 4.48Å; L50-E77 PolarHBondContact N-OE1 2.89Å; L50-F78 HydrophobicContact CD1-CD1 3.92Å; L50-F78 HydrophobicContact CD1-CE1 3.33Å; L50-F78 HydrophobicContact CD1-CZ 3.94Å; L50-F81 HydrophobicContact CB-CE2 3.93Å; L50-F81 HydrophobicContact CB-CZ 4.32Å
51	Q	87	Confident	87.5	Confident	88 Å²	88	61.6 Å²	61.6	41%	0.411	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-20	-179.3	-63	173.1	25.5	0	0	114.7	E77	Q51-E77 PolarHBondContact NE2-OE2 3.49Å
52	R	86.4	Confident	87.5	Confident	194 Å²	194	60 Å²	60	73%	0.732	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.7	178.6	-63.4	-174.1	-179.1	-172.4	-0.2	114.2	T20 G21 L50	T20-R52 CarbonylContact C-O 3.43Å; T20-R52 VanDerWaalsContact CA-O 3.25Å; T20-R52 WeakPolarHBondContact CA-O 3.07Å; G21-R52 PolarHBondContact N-O 2.65Å; L50-R52 PolarHBondContact O-N 3.06Å
53	F	90.3	Very high	87.5	Confident	42 Å²	42	60 Å²	60	18%	0.184	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	155.6	-175.9	-58.2	-57.9	0	0	0	111.3	G21 V23 I28 F47 L50 N80 F81	G21-F53 CarbonylContact O-C 3.39Å; G21-F53 VanDerWaalsContact O-CA 3.24Å; G21-F53 WeakPolarHBondContact O-CA 3.26Å; V23-F53 HydrophobicContact CG1-CB 3.77Å; V23-F53 HydrophobicContact CG1-CD1 4.45Å; V23-F53 HydrophobicContact CG1-CG 4.14Å; I28-F53 HydrophobicContact CD1-CD1 3.82Å; I28-F53 HydrophobicContact CD1-CE1 3.68Å; F47-F53 AromaticContact CD1-CE2 3.93Å; F47-F53 HydrophobicContact CD1-CE2 3.93Å; F47-F53 HydrophobicContact CD1-CZ 4.35Å; F47-F53 AromaticContact CE1-CE2 3.81Å; F47-F53 HydrophobicContact CE1-CE2 3.81Å; F47-F53 AromaticContact CE1-CZ 3.96Å; F47-F53 HydrophobicContact CE1-CZ 3.96Å; F47-F53 HydrophobicContact CG-CE2 4.44Å; F47-F53 HydrophobicContact CZ-CE2 4.21Å; L50-F53 HydrophobicContact CD2-CD2 4.21Å; L50-F53 PolarHBondContact O-N 2.96Å; F53-N80 VanDerWaalsContact O-CB 3.23Å; F53-N80 WeakPolarHBondContact O-CB 3.26Å; F53-N80 PolarHBondContact O-ND2 2.78Å; F53-F81 HydrophobicContact CB-CZ 4.01Å
54	T	89.9	Confident	87.5	Confident	33 Å²	33	58.8 Å²	58.8	20%	0.202	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	159.1	169.2	46.3	0	0	0	0	110	T20 G21 D22 V23 N80	T20-T54 WeakPolarHBondContact OG1-CG2 3.29Å; G21-T54 PolarHBondContact O-N 3.25Å; D22-T54 WeakPolarHBondContact CA-O 3.34Å; D22-T54 WeakPolarHBondContact CA-OG1 3.27Å; V23-T54 PolarHBondContact N-O 2.95Å; T54-N80 HydrophobicContact CG2-CB 3.85Å
55	A	87.6	Confident	87.9	Confident	2 Å²	2	53 Å²	53	2%	0.017	28%	0.278	C	S	.	.			trans	-124.7	167.4	177.9	0	0	0	0	0	111.5	V23 T57 Y61 F81	V23-A55 HydrophobicContact CG2-CB 4.42Å; A55-T57 PolarHBondContact O-N 3.42Å; A55-Y61 HydrophobicContact CB-CE1 4.01Å; A55-Y61 HydrophobicContact CB-CE2 4.26Å; A55-Y61 WeakPolarHBondContact CB-OH 3.44Å; A55-F81 HydrophobicContact CB-CD1 3.47Å; A55-F81 VanDerWaalsContact CB-CD1 3.47Å; A55-F81 HydrophobicContact CB-CE1 3.68Å; A55-F81 HydrophobicContact CB-CG 4.31Å
56	P	84.3	Confident	87.7	Confident	15 Å²	15	50.3 Å²	50.3	10%	0.097	27%	0.267	C	S	.	.			trans	-57.5	121.9	-174.1	-30.2	39.7	0	0	0	113.7	C24 L38 Y61 N83	C24-P56 HydrophobicContact CB-CG 4.05Å; C24-P56 WeakPolarHBondContact SG-CG 3.43Å; L38-P56 HydrophobicContact CD2-CB 3.95Å; L38-P56 HydrophobicContact CD2-CG 3.86Å; P56-Y61 WeakPolarHBondContact O-CE1 3.46Å; P56-N83 PolarHBondContact O-ND2 2.88Å
57	T	84.5	Confident	87.2	Confident	84 Å²	84	49.4 Å²	49.4	52%	0.515	26%	0.258	S	S	.	.	S	Bend	trans	-87.6	-6	-174.2	63	0	0	0	0	113.8	A55 Y82 N83	A55-T57 PolarHBondContact O-N 3.42Å; T57-Y82 VanDerWaalsContact CB-OH 3.3Å; T57-Y82 WeakPolarHBondContact CB-OH 3.34Å; T57-Y82 VanDerWaalsContact CG2-OH 3.25Å; T57-Y82 WeakPolarHBondContact CG2-OH 3.38Å; T57-N83 PolarHBondContact O-ND2 3.47Å
58	S	81.6	Confident	87.2	Confident	101 Å²	101	49 Å²	49	71%	0.706	26%	0.257	S	S	*	.	S	Bend	trans	-106	-10.1	-168.1	50.8	0	0	0	0	115.1
59	Q	82.9	Confident	87.3	Confident	76 Å²	76	46.9 Å²	46.9	36%	0.355	25%	0.246	S	C	.	.	S	Bend	trans	-143	158.1	-177.9	-75.6	166.9	-37.7	0	0	108.9	E33 N83	E33-Q59 PolarHBondContact OE1-NE2 2.95Å; Q59-N83 WeakPolarHBondContact O-CB 3.39Å; Q59-N83 PolarHBondContact O-ND2 2.88Å
60	F	87.5	Confident	87.5	Confident	122 Å²	122	45.3 Å²	45.3	54%	0.535	24%	0.235	S	C	.	.			trans	-80.2	154.3	165.4	-57	-57.3	0	0	0	110.4	N83 V85 L107	F60-N83 WeakPolarHBondContact CA-O 3.48Å; F60-N83 HydrophobicContact CD1-CB 4.29Å; F60-V85 HydrophobicContact CB-CG2 3.81Å; F60-V85 HydrophobicContact CG-CG2 4.4Å; F60-L107 HydrophobicContact CD1-CD1 4.06Å; F60-L107 HydrophobicContact CE1-CD1 3.56Å
61	Y	86.3	Confident	87.7	Confident	3 Å²	3	48.3 Å²	48.3	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	161.1	-177.4	56	-97.3	0	0	0	115.1	L38 V40 A55 P56 L63 F81 N83 A84 V85	L38-Y61 CarbonylContact O-C 3.58Å; L38-Y61 WeakPolarHBondContact O-CA 3.36Å; L38-Y61 WeakPolarHBondContact O-CB 3.31Å; V40-Y61 HydrophobicContact CB-CD2 4.44Å; V40-Y61 HydrophobicContact CG2-CD2 3.92Å; V40-Y61 HydrophobicContact CG2-CG 3.95Å; A55-Y61 HydrophobicContact CB-CE1 4.01Å; A55-Y61 HydrophobicContact CB-CE2 4.26Å; A55-Y61 WeakPolarHBondContact CB-OH 3.44Å; P56-Y61 WeakPolarHBondContact O-CE1 3.46Å; Y61-L63 HydrophobicContact CD2-CB 4.21Å; Y61-L63 HydrophobicContact CE2-CB 4.15Å; Y61-L63 HydrophobicContact CE2-CD2 4.44Å; Y61-F81 VanDerWaalsContact OH-C 3.27Å; Y61-F81 WeakPolarHBondContact OH-CA 3.21Å; Y61-F81 PolarHBondContact OH-O 2.9Å; Y61-N83 HydrophobicContact CD1-CB 4.11Å; Y61-N83 HydrophobicContact CE1-CB 3.57Å; Y61-N83 PolarHBondContact N-O 2.84Å; Y61-A84 HydrophobicContact CD2-CB 4.25Å; Y61-A84 HydrophobicContact CE2-CB 3.65Å; Y61-A84 CarbonylContact O-C 3.58Å; Y61-A84 WeakPolarHBondContact O-CA 3.27Å; Y61-V85 PolarHBondContact O-N 3.08Å
62	H	86.1	Confident	88	Confident	30 Å²	30	49.5 Å²	49.5	14%	0.139	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	129.6	168.8	-60.1	-77.7	0	0	0	109.8	L38 H39 V40 F64 S86	L38-H62 PolarHBondContact O-N 3.02Å; H39-H62 AromaticContact CE1-CD2 3.85Å; V40-H62 PolarHBondContact N-O 2.93Å; H62-F64 HydrophobicContact CB-CE2 3.56Å; H62-F64 HydrophobicContact CB-CZ 3.69Å; H62-S86 PolarHBondContact ND1-OG 3.47Å
63	L	91.3	Very high	88.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	110.5	-172	-179.2	56.6	0	0	0	111.8	V40 Y61 L65 F81 S86 L87 H88	V40-L63 HydrophobicContact CB-CD1 4.09Å; V40-L63 HydrophobicContact CG1-CD1 3.79Å; Y61-L63 HydrophobicContact CD2-CB 4.21Å; Y61-L63 HydrophobicContact CE2-CB 4.15Å; Y61-L63 HydrophobicContact CE2-CD2 4.44Å; L63-L65 HydrophobicContact CD1-CD1 4.32Å; L63-L65 HydrophobicContact CD1-CG 4.19Å; L63-L65 HydrophobicContact CD2-CD1 3.8Å; L63-L65 HydrophobicContact CG-CD1 3.77Å; L63-L65 HydrophobicContact CG-CG 4.02Å; L63-F81 HydrophobicContact CD1-CE1 4.48Å; L63-F81 HydrophobicContact CD2-CB 4.44Å; L63-F81 HydrophobicContact CD2-CD1 3.55Å; L63-F81 HydrophobicContact CD2-CE1 4.08Å; L63-F81 HydrophobicContact CD2-CG 4.21Å; L63-S86 PolarHBondContact N-O 2.76Å; L63-L87 HydrophobicContact CD2-CD1 4.12Å; L63-L87 HydrophobicContact CG-CD1 4.32Å; L63-H88 PolarHBondContact O-N 2.86Å
64	F	88.2	Confident	88.6	Confident	28 Å²	28	43.1 Å²	43.1	12%	0.123	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	103	-176.3	-54.2	-86.6	0	0	0	111.4	H39 V40 C42 H62 H88	H39-F64 HydrophobicContact CB-CE2 4.07Å; H39-F64 AromaticContact CD2-CE2 3.57Å; H39-F64 AromaticContact CD2-CZ 3.77Å; V40-F64 PolarHBondContact O-N 3.21Å; C42-F64 CarbonylContact C-O 3.43Å; C42-F64 VanDerWaalsContact C-O 3.28Å; C42-F64 VanDerWaalsContact CA-O 3.22Å; C42-F64 WeakPolarHBondContact CA-O 3.05Å; C42-F64 VanDerWaalsContact CB-O 3.24Å; C42-F64 WeakPolarHBondContact CB-O 3.38Å; C42-F64 PolarHBondContact N-O 3.15Å; H62-F64 HydrophobicContact CB-CE2 3.56Å; H62-F64 HydrophobicContact CB-CZ 3.69Å; F64-H88 HydrophobicContact CD1-CB 3.94Å; F64-H88 AromaticContact CD1-CD2 3.7Å; F64-H88 AromaticContact CD1-CG 3.77Å; F64-H88 AromaticContact CE1-CD2 3.52Å; F64-H88 AromaticContact CE1-CG 3.94Å; F64-H88 AromaticContact CE1-NE2 3.75Å
65	L	92.4	Very high	88.7	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.24	C	C	.	.			trans	-113.2	13.7	-177.6	-71.8	160.6	0	0	0	112.5	C42 F47 L50 L63 N68 L70 F78 L87 H88 M89 N92	C42-L65 HydrophobicContact CB-CD2 3.85Å; F47-L65 HydrophobicContact CD2-CD2 3.76Å; F47-L65 HydrophobicContact CE2-CD2 4.15Å; L50-L65 HydrophobicContact CD1-CD1 3.59Å; L50-L65 HydrophobicContact CD1-CD2 4.22Å; L50-L65 HydrophobicContact CD2-CD2 3.89Å; L63-L65 HydrophobicContact CD1-CD1 4.32Å; L63-L65 HydrophobicContact CD1-CG 4.19Å; L63-L65 HydrophobicContact CD2-CD1 3.8Å; L63-L65 HydrophobicContact CG-CD1 3.77Å; L63-L65 HydrophobicContact CG-CG 4.02Å; L65-N68 PolarHBondContact O-ND2 3.07Å; L65-L70 HydrophobicContact CB-CD1 4.32Å; L65-L70 HydrophobicContact CD1-CD1 4.42Å; L65-F78 HydrophobicContact CD1-CE1 4.08Å; L65-L87 HydrophobicContact CD1-CD1 3.77Å; L65-H88 CarbonylContact C-O 3.58Å; L65-H88 VanDerWaalsContact CA-O 3.32Å; L65-H88 WeakPolarHBondContact CA-O 3.45Å; L65-H88 WeakPolarHBondContact CB-O 3.48Å; L65-H88 PolarHBondContact N-O 3.03Å; L65-M89 HydrophobicContact CB-CG 4.28Å; L65-M89 HydrophobicContact CD1-CG 4.45Å; L65-N92 PolarHBondContact O-ND2 2.02Å
66	H	84.9	Confident	88.9	Confident	39 Å²	39	48.1 Å²	48.1	18%	0.181	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	145.2	-176.1	51.4	83.6	0	0	0	113.8	E43 K44 N68 H88 E90	E43-H66 WeakPolarHBondContact CG-ND1 3.22Å; E43-H66 IonicContact OE1-CE1 2.64Å; E43-H66 PolarHBondContact OE1-CE1 2.84Å; E43-H66 IonicContact OE1-ND1 3.31Å; E43-H66 PolarHBondContact OE1-ND1 3.18Å; K44-H66 PolarHBondContact N-O 2.89Å; H66-N68 VanDerWaalsContact C-N 3.27Å; H66-N68 PolarHBondContact O-N 3.41Å; H66-H88 PolarHBondContact N-O 3.02Å; H66-E90 CarbonylContact C-O 3.53Å; H66-E90 WeakPolarHBondContact CA-O 3.4Å; H66-E90 HydrophobicContact CB-CB 4.09Å; H66-E90 WeakPolarHBondContact CB-O 3.33Å
67	G	78.2	Confident	89.2	Confident	25 Å²	25	47.5 Å²	47.5	26%	0.258	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	24	178.5	0	0	0	0	0	115.1	E90	G67-E90 PolarHBondContact N-O 3.01Å
68	N	91.9	Very high	89.7	Confident	8 Å²	8	43.5 Å²	43.5	4%	0.043	23%	0.231	C	C	.	.	S	Bend	trans	-86	-158.8	167.2	-77.2	-74.2	0	0	0	110.8	C42 K45 G46 F47 L65 H66 L70 N92	C42-N68 PolarHBondContact O-ND2 3.32Å; K45-N68 WeakPolarHBondContact CA-OD1 3.39Å; K45-N68 PolarHBondContact N-OD1 3.01Å; G46-N68 PolarHBondContact N-OD1 2.92Å; F47-N68 HydrophobicContact CB-CB 4.24Å; F47-N68 PolarHBondContact N-OD1 3.11Å; L65-N68 PolarHBondContact O-ND2 3.07Å; H66-N68 VanDerWaalsContact C-N 3.27Å; H66-N68 PolarHBondContact O-N 3.41Å; N68-L70 HydrophobicContact CB-CG 4.44Å; N68-N92 WeakPolarHBondContact CA-OD1 3.18Å; N68-N92 WeakPolarHBondContact CB-OD1 3.43Å; N68-N92 PolarHBondContact N-OD1 3.38Å
69	S	93.2	Very high	90.1	Very high	56 Å²	56	40.8 Å²	40.8	39%	0.392	22%	0.215	S	C	.	.			trans	-123.7	34.3	-177.8	-64	0	0	0	0	112	F47 T71 N92	F47-S69 CarbonylContact O-C 3.46Å; F47-S69 VanDerWaalsContact O-CA 3.29Å; F47-S69 WeakPolarHBondContact O-CA 3.49Å; F47-S69 PolarHBondContact O-N 3.44Å; S69-T71 PolarHBondContact O-N 3.34Å; S69-N92 PolarHBondContact N-OD1 3.15Å
70	L	93.4	Very high	90.4	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.212	C	C	.	.			trans	-73.3	62.7	176.3	-55.4	175	0	0	0	110.7	F47 L50 L65 N68 R72 L73 M89 N92 L94	F47-L70 HydrophobicContact CB-CD2 4.31Å; F47-L70 PolarHBondContact O-N 2.96Å; L50-L70 HydrophobicContact CD1-CD1 4.19Å; L50-L70 HydrophobicContact CG-CD2 4.3Å; L65-L70 HydrophobicContact CB-CD1 4.32Å; L65-L70 HydrophobicContact CD1-CD1 4.42Å; N68-L70 HydrophobicContact CB-CG 4.44Å; L70-R72 PolarHBondContact O-N 3.31Å; L70-L73 HydrophobicContact CB-CD2 4.28Å; L70-M89 HydrophobicContact CD1-SD 4.26Å; L70-N92 HydrophobicContact CB-CB 4.06Å; L70-N92 VanDerWaalsContact CB-OD1 3.29Å; L70-N92 WeakPolarHBondContact CB-OD1 3.3Å; L70-N92 WeakPolarHBondContact CG-OD1 3.45Å; L70-N92 PolarHBondContact N-OD1 2.77Å; L70-L94 WeakPolarHBondContact O-CB 3.24Å; L70-L94 WeakPolarHBondContact O-CD1 3.4Å
71	T	93.6	Very high	90.6	Very high	66 Å²	66	34 Å²	34	41%	0.405	19%	0.187	S	C	.	.			trans	-68.7	-19.6	-175.4	59.2	0	0	0	0	113.7	S69 L94 H95	S69-T71 PolarHBondContact O-N 3.34Å; T71-L94 WeakPolarHBondContact O-CA 3.42Å; T71-H95 PolarHBondContact O-CE1 2.79Å; T71-H95 VanDerWaalsContact O-CE1 3.24Å; T71-H95 PolarHBondContact O-N 3.28Å; T71-H95 PolarHBondContact O-ND1 2.95Å
72	R	94.5	Very high	90.8	Very high	113 Å²	113	38.7 Å²	38.7	43%	0.426	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146.8	173.3	-56.1	-175.7	-173.9	-129.6	-8.9	109.2	L70 F74 H95 E96	L70-R72 PolarHBondContact O-N 3.31Å; R72-F74 HydrophobicContact CB-CE2 4.35Å; R72-F74 HydrophobicContact CB-CZ 4.39Å; R72-H95 PolarHBondContact NE-NE2 2.76Å; R72-E96 VanDerWaalsContact CA-O 3.3Å; R72-E96 WeakPolarHBondContact CA-O 3.19Å; R72-E96 HydrophobicContact CG-CB 4.41Å; R72-E96 IonicContact CZ-OE2 2.92Å; R72-E96 VanDerWaalsContact CZ-OE2 3.32Å; R72-E96 IonicContact NE-OE2 3.63Å; R72-E96 IonicContact NH1-OE2 3.88Å; R72-E96 PolarHBondContact NH1-OE2 3Å; R72-E96 IonicContact NH2-OE2 2.95Å
73	L	95	Very high	91.1	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.5	170.4	-58.6	173.8	0	0	0	109.5	L70 E77 F78 M89 L94 E96 I97 V98 A101 F102	L70-L73 HydrophobicContact CB-CD2 4.28Å; L73-E77 HydrophobicContact CD2-CG 4.25Å; L73-F78 HydrophobicContact CD1-CE2 4.13Å; L73-F78 HydrophobicContact CD1-CZ 4.47Å; L73-F78 HydrophobicContact CD2-CE2 3.97Å; L73-F78 HydrophobicContact CD2-CZ 3.98Å; L73-M89 HydrophobicContact CD1-CE 3.71Å; L73-M89 HydrophobicContact CD1-SD 4.21Å; L73-M89 HydrophobicContact CD2-SD 4.44Å; L73-L94 HydrophobicContact CD1-CD1 4.35Å; L73-L94 HydrophobicContact CD1-CD2 3.74Å; L73-L94 HydrophobicContact CG-CD1 3.89Å; L73-L94 HydrophobicContact CG-CD2 4.15Å; L73-E96 PolarHBondContact N-O 2.97Å; L73-E96 VanDerWaalsContact N-O 3.15Å; L73-I97 HydrophobicContact CB-CG2 4.44Å; L73-I97 HydrophobicContact CD1-CG1 4.27Å; L73-I97 HydrophobicContact CD1-CG2 4.48Å; L73-V98 WeakPolarHBondContact O-CB 3.5Å; L73-V98 WeakPolarHBondContact O-CG2 3.27Å; L73-V98 PolarHBondContact O-N 3.06Å; L73-A101 HydrophobicContact CB-CB 3.78Å; L73-F102 HydrophobicContact CD1-CE1 4.31Å; L73-F102 HydrophobicContact CD1-CZ 4.24Å
74	F	92.9	Very high	91.1	Very high	101 Å²	101	38 Å²	38	44%	0.443	20%	0.203	S	C	.	.			trans	-98.5	163.6	179	-62.5	-82	0	0	0	111.2	R72 N76 E77 A101	R72-F74 HydrophobicContact CB-CE2 4.35Å; R72-F74 HydrophobicContact CB-CZ 4.39Å; F74-N76 PolarHBondContact O-N 3.38Å; F74-E77 WeakPolarHBondContact O-CB 3.26Å; F74-E77 PolarHBondContact O-N 3.41Å; F74-A101 VanDerWaalsContact O-CA 3.3Å; F74-A101 WeakPolarHBondContact O-CA 3.27Å
75	P	93.1	Very high	91.1	Very high	58 Å²	58	38.1 Å²	38.1	38%	0.377	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	134.9	179.2	-24.4	35.5	0	0	0	112.3	E77 V98 G100	P75-E77 VanDerWaalsContact C-N 3.31Å; P75-E77 PolarHBondContact O-N 2.63Å; P75-V98 HydrophobicContact CG-CB 4.34Å; P75-V98 HydrophobicContact CG-CG1 3.73Å; P75-G100 WeakPolarHBondContact CA-O 3.35Å
76	N	90.3	Very high	90.8	Very high	82 Å²	82	38.1 Å²	38.1	44%	0.439	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	23	-177	-44.3	-83.6	0	0	0	115.4	F74 F78 A79 G100 L103	F74-N76 PolarHBondContact O-N 3.38Å; N76-F78 PolarHBondContact O-N 2.77Å; N76-A79 HydrophobicContact CB-CB 4.17Å; N76-A79 PolarHBondContact O-N 3.04Å; N76-G100 PolarHBondContact N-O 3.02Å; N76-L103 WeakPolarHBondContact OD1-CB 3.06Å; N76-L103 WeakPolarHBondContact OD1-CD1 3.32Å
77	E	92.3	Very high	91.3	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.009	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-29.2	178.9	-162.8	65.2	-141.9	0	0	113	S49 L50 Q51 L73 F74 P75 A101	S49-E77 WeakPolarHBondContact CA-OE1 3.29Å; S49-E77 VanDerWaalsContact CB-OE1 3.25Å; S49-E77 WeakPolarHBondContact CB-OE1 3.31Å; S49-E77 PolarHBondContact OG-OE1 3.25Å; L50-E77 HydrophobicContact CB-CG 4.48Å; L50-E77 PolarHBondContact N-OE1 2.89Å; Q51-E77 PolarHBondContact NE2-OE2 3.49Å; L73-E77 HydrophobicContact CD2-CG 4.25Å; F74-E77 WeakPolarHBondContact O-CB 3.26Å; F74-E77 PolarHBondContact O-N 3.41Å; P75-E77 VanDerWaalsContact C-N 3.31Å; P75-E77 PolarHBondContact O-N 2.63Å; E77-A101 PolarHBondContact N-O 3.39Å
78	F	93.4	Very high	91.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	13.3	-175.7	-60.3	-87.1	0	0	0	114.7	L50 L65 L73 N76 N80 F81 L87 M89 F102 L105	L50-F78 HydrophobicContact CD1-CD1 3.92Å; L50-F78 HydrophobicContact CD1-CE1 3.33Å; L50-F78 HydrophobicContact CD1-CZ 3.94Å; L65-F78 HydrophobicContact CD1-CE1 4.08Å; L73-F78 HydrophobicContact CD1-CE2 4.13Å; L73-F78 HydrophobicContact CD1-CZ 4.47Å; L73-F78 HydrophobicContact CD2-CE2 3.97Å; L73-F78 HydrophobicContact CD2-CZ 3.98Å; N76-F78 PolarHBondContact O-N 2.77Å; F78-N80 PolarHBondContact O-N 3.39Å; F78-F81 HydrophobicContact CB-CB 4.44Å; F78-F81 WeakPolarHBondContact O-CB 3.45Å; F78-F81 PolarHBondContact O-N 3.04Å; F78-L87 HydrophobicContact CD1-CD2 4.31Å; F78-L87 HydrophobicContact CE1-CD1 4.02Å; F78-L87 HydrophobicContact CE1-CD2 3.98Å; F78-L87 HydrophobicContact CZ-CD2 4.18Å; F78-M89 HydrophobicContact CE1-SD 4.08Å; F78-M89 HydrophobicContact CE2-SD 4.39Å; F78-M89 HydrophobicContact CZ-CE 4.16Å; F78-M89 HydrophobicContact CZ-SD 3.46Å; F78-M89 WeakPolarHBondContact CZ-SD 3.22Å; F78-F102 HydrophobicContact CD2-CD1 4.35Å; F78-F102 HydrophobicContact CE2-CD1 4.31Å; F78-F102 HydrophobicContact CE2-CE1 4.48Å; F78-L105 HydrophobicContact CB-CD1 3.53Å; F78-L105 HydrophobicContact CB-CD2 3.88Å; F78-L105 HydrophobicContact CB-CG 3.58Å; F78-L105 HydrophobicContact CD1-CD1 4.06Å; F78-L105 HydrophobicContact CD2-CD1 3.9Å; F78-L105 HydrophobicContact CG-CD1 3.56Å; F78-L105 HydrophobicContact CG-CD2 4.49Å; F78-L105 HydrophobicContact CG-CG 4.19Å
79	A	89.9	Confident	91.8	Very high	45 Å²	45	35.4 Å²	35.4	37%	0.372	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.9	-174.7	0	0	0	0	0	114.7	N76	N76-A79 HydrophobicContact CB-CB 4.17Å; N76-A79 PolarHBondContact O-N 3.04Å
80	N	90.2	Very high	91.4	Very high	52 Å²	52	33.1 Å²	33.1	28%	0.278	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	5.1	177.4	-60.4	-23.6	0	0	0	114.2	F53 T54 F78	F53-N80 VanDerWaalsContact O-CB 3.23Å; F53-N80 WeakPolarHBondContact O-CB 3.26Å; F53-N80 PolarHBondContact O-ND2 2.78Å; T54-N80 HydrophobicContact CG2-CB 3.85Å; F78-N80 PolarHBondContact O-N 3.39Å
81	F	92.4	Very high	90.8	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.009	18%	0.184	C	C	.	.			trans	-119.3	26	-171.3	-66.2	-95.3	0	0	0	113.1	L50 F53 A55 Y61 L63 F78 N83 A84 L105	L50-F81 HydrophobicContact CB-CE2 3.93Å; L50-F81 HydrophobicContact CB-CZ 4.32Å; F53-F81 HydrophobicContact CB-CZ 4.01Å; A55-F81 HydrophobicContact CB-CD1 3.47Å; A55-F81 VanDerWaalsContact CB-CD1 3.47Å; A55-F81 HydrophobicContact CB-CE1 3.68Å; A55-F81 HydrophobicContact CB-CG 4.31Å; Y61-F81 VanDerWaalsContact OH-C 3.27Å; Y61-F81 WeakPolarHBondContact OH-CA 3.21Å; Y61-F81 PolarHBondContact OH-O 2.9Å; L63-F81 HydrophobicContact CD1-CE1 4.48Å; L63-F81 HydrophobicContact CD2-CB 4.44Å; L63-F81 HydrophobicContact CD2-CD1 3.55Å; L63-F81 HydrophobicContact CD2-CE1 4.08Å; L63-F81 HydrophobicContact CD2-CG 4.21Å; F78-F81 HydrophobicContact CB-CB 4.44Å; F78-F81 WeakPolarHBondContact O-CB 3.45Å; F78-F81 PolarHBondContact O-N 3.04Å; F81-N83 PolarHBondContact O-N 3.35Å; F81-A84 WeakPolarHBondContact O-CB 3.44Å; F81-A84 PolarHBondContact O-N 3.39Å; F81-L105 HydrophobicContact CB-CD2 4.17Å; F81-L105 WeakPolarHBondContact O-CD2 3.41Å
82	Y	90.4	Very high	90.5	Very high	102 Å²	102	33 Å²	33	40%	0.4	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-12	-169.2	58.4	-98.5	0	0	0	116.8	T57 G104	T57-Y82 VanDerWaalsContact CB-OH 3.3Å; T57-Y82 WeakPolarHBondContact CB-OH 3.34Å; T57-Y82 VanDerWaalsContact CG2-OH 3.25Å; T57-Y82 WeakPolarHBondContact CG2-OH 3.38Å; Y82-G104 VanDerWaalsContact CA-O 3.29Å; Y82-G104 WeakPolarHBondContact CA-O 3.44Å; Y82-G104 WeakPolarHBondContact CB-O 3.38Å
83	N	91.6	Very high	90.3	Very high	17 Å²	17	28.3 Å²	28.3	9%	0.091	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	3.9	176	-84.7	9.2	0	0	0	113.6	P56 T57 Q59 F60 Y61 F81	P56-N83 PolarHBondContact O-ND2 2.88Å; T57-N83 PolarHBondContact O-ND2 3.47Å; Q59-N83 WeakPolarHBondContact O-CB 3.39Å; Q59-N83 PolarHBondContact O-ND2 2.88Å; F60-N83 WeakPolarHBondContact CA-O 3.48Å; F60-N83 HydrophobicContact CD1-CB 4.29Å; Y61-N83 HydrophobicContact CD1-CB 4.11Å; Y61-N83 HydrophobicContact CE1-CB 3.57Å; Y61-N83 PolarHBondContact N-O 2.84Å; F81-N83 PolarHBondContact O-N 3.35Å
84	A	91.8	Very high	90.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	137.6	177.8	0	0	0	0	0	111.8	Y61 F81 L105 L107 V108	Y61-A84 HydrophobicContact CD2-CB 4.25Å; Y61-A84 HydrophobicContact CE2-CB 3.65Å; Y61-A84 CarbonylContact O-C 3.58Å; Y61-A84 WeakPolarHBondContact O-CA 3.27Å; F81-A84 WeakPolarHBondContact O-CB 3.44Å; F81-A84 PolarHBondContact O-N 3.39Å; A84-L105 HydrophobicContact CB-CD2 4.08Å; A84-L107 CarbonylContact O-C 3.44Å; A84-V108 HydrophobicContact CB-CG2 3.98Å; A84-V108 VanDerWaalsContact O-CG2 3.24Å; A84-V108 WeakPolarHBondContact O-CG2 3.47Å; A84-V108 PolarHBondContact O-N 3.42Å
85	V	88.4	Confident	90.3	Very high	29 Å²	29	26.2 Å²	26.2	18%	0.176	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-36.7	179.4	-179.7	0	0	0	0	111.9	F60 Y61 V108 K109 R110	F60-V85 HydrophobicContact CB-CG2 3.81Å; F60-V85 HydrophobicContact CG-CG2 4.4Å; Y61-V85 PolarHBondContact O-N 3.08Å; V85-V108 CarbonylContact O-C 3.3Å; V85-V108 WeakPolarHBondContact O-CA 3.37Å; V85-K109 HydrophobicContact CG1-CD 4.07Å; V85-K109 PolarHBondContact O-N 3.3Å; V85-R110 PolarHBondContact O-N 3.25Å
86	S	85.9	Confident	90.3	Very high	2 Å²	2	26 Å²	26	1%	0.014	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	146.6	162.7	72.6	0	0	0	0	111.6	H62 L63 H88 R110	H62-S86 PolarHBondContact ND1-OG 3.47Å; L63-S86 PolarHBondContact N-O 2.76Å; S86-H88 PolarHBondContact OG-CD2 3.13Å; S86-H88 PolarHBondContact OG-NE2 2.83Å; S86-R110 WeakPolarHBondContact CA-O 3.36Å
87	L	93.9	Very high	90.5	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	112.3	179.6	175.3	53.6	0	0	0	110.1	L63 L65 F78 M89 F102 L105 V108 R110 L111 H112	L63-L87 HydrophobicContact CD2-CD1 4.12Å; L63-L87 HydrophobicContact CG-CD1 4.32Å; L65-L87 HydrophobicContact CD1-CD1 3.77Å; F78-L87 HydrophobicContact CD1-CD2 4.31Å; F78-L87 HydrophobicContact CE1-CD1 4.02Å; F78-L87 HydrophobicContact CE1-CD2 3.98Å; F78-L87 HydrophobicContact CZ-CD2 4.18Å; L87-M89 HydrophobicContact CD1-CG 3.7Å; L87-M89 HydrophobicContact CD1-SD 4.06Å; L87-M89 HydrophobicContact CD2-CE 3.9Å; L87-M89 HydrophobicContact CD2-SD 4.24Å; L87-M89 HydrophobicContact CG-CE 4.12Å; L87-M89 HydrophobicContact CG-CG 3.97Å; L87-M89 HydrophobicContact CG-SD 4.22Å; L87-F102 HydrophobicContact CD2-CD1 4.22Å; L87-F102 HydrophobicContact CD2-CE1 4.16Å; L87-L105 HydrophobicContact CD2-CD1 3.59Å; L87-V108 HydrophobicContact CB-CG1 4.18Å; L87-R110 PolarHBondContact N-O 2.85Å; L87-L111 HydrophobicContact CB-CD1 4.07Å; L87-L111 HydrophobicContact CD2-CD1 3.89Å; L87-L111 HydrophobicContact CG-CD1 3.87Å; L87-H112 PolarHBondContact O-N 2.9Å
88	H	88.8	Confident	90.6	Very high	14 Å²	14	24.4 Å²	24.4	7%	0.065	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	106.7	-176.4	-69.6	-91.9	0	0	0	110.3	L63 F64 L65 H66 S86 E90 H112	L63-H88 PolarHBondContact O-N 2.86Å; F64-H88 HydrophobicContact CD1-CB 3.94Å; F64-H88 AromaticContact CD1-CD2 3.7Å; F64-H88 AromaticContact CD1-CG 3.77Å; F64-H88 AromaticContact CE1-CD2 3.52Å; F64-H88 AromaticContact CE1-CG 3.94Å; F64-H88 AromaticContact CE1-NE2 3.75Å; L65-H88 CarbonylContact C-O 3.58Å; L65-H88 VanDerWaalsContact CA-O 3.32Å; L65-H88 WeakPolarHBondContact CA-O 3.45Å; L65-H88 WeakPolarHBondContact CB-O 3.48Å; L65-H88 PolarHBondContact N-O 3.03Å; H66-H88 PolarHBondContact N-O 3.02Å; S86-H88 PolarHBondContact OG-CD2 3.13Å; S86-H88 PolarHBondContact OG-NE2 2.83Å; H88-E90 VanDerWaalsContact CA-OE2 3.3Å; H88-E90 WeakPolarHBondContact CA-OE2 3.06Å; H88-E90 VanDerWaalsContact CB-OE2 3.23Å; H88-E90 WeakPolarHBondContact CB-OE2 3.31Å; H88-E90 IonicContact CG-OE1 2.6Å; H88-E90 IonicContact ND1-OE1 2.71Å; H88-E90 PolarHBondContact ND1-OE1 3.4Å; H88-H112 AromaticContact CE1-CD2 3.17Å; H88-H112 PolarHBondContact CE1-CD2 3.33Å; H88-H112 AromaticContact CE1-CE1 3.95Å; H88-H112 AromaticContact CE1-CG 3.8Å; H88-H112 AromaticContact CE1-NE2 3.3Å; H88-H112 PolarHBondContact CE1-NE2 3.18Å; H88-H112 VanDerWaalsContact CE1-NE2 3.3Å; H88-H112 AromaticContact ND1-CD2 3.38Å; H88-H112 PolarHBondContact ND1-CD2 3.46Å; H88-H112 AromaticContact ND1-CG 3.63Å; H88-H112 AromaticContact ND1-NE2 3.94Å; H88-H112 AromaticContact NE2-CD2 3.74Å; H88-H112 AromaticContact NE2-NE2 3.92Å
89	M	93.1	Very high	90.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.146	C	C	.	.			trans	-124.5	23	-176	-64.5	-163.9	-65.3	0	0	113.8	L65 L70 L73 F78 L87 N92 F102 L111 H112 I113 N116	L65-M89 HydrophobicContact CB-CG 4.28Å; L65-M89 HydrophobicContact CD1-CG 4.45Å; L70-M89 HydrophobicContact CD1-SD 4.26Å; L73-M89 HydrophobicContact CD1-CE 3.71Å; L73-M89 HydrophobicContact CD1-SD 4.21Å; L73-M89 HydrophobicContact CD2-SD 4.44Å; F78-M89 HydrophobicContact CE1-SD 4.08Å; F78-M89 HydrophobicContact CE2-SD 4.39Å; F78-M89 HydrophobicContact CZ-CE 4.16Å; F78-M89 HydrophobicContact CZ-SD 3.46Å; F78-M89 WeakPolarHBondContact CZ-SD 3.22Å; L87-M89 HydrophobicContact CD1-CG 3.7Å; L87-M89 HydrophobicContact CD1-SD 4.06Å; L87-M89 HydrophobicContact CD2-CE 3.9Å; L87-M89 HydrophobicContact CD2-SD 4.24Å; L87-M89 HydrophobicContact CG-CE 4.12Å; L87-M89 HydrophobicContact CG-CG 3.97Å; L87-M89 HydrophobicContact CG-SD 4.22Å; M89-N92 PolarHBondContact O-ND2 2.69Å; M89-F102 HydrophobicContact CE-CE1 3.72Å; M89-F102 HydrophobicContact CE-CZ 4.26Å; M89-L111 HydrophobicContact CE-CD1 4.03Å; M89-H112 PolarHBondContact N-O 3.22Å; M89-I113 HydrophobicContact CB-CG2 4.48Å; M89-I113 HydrophobicContact CE-CG2 3.76Å; M89-N116 PolarHBondContact O-ND2 3.22Å
90	E	85.1	Confident	90.6	Very high	8 Å²	8	24.6 Å²	24.6	4%	0.037	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	150.7	174.8	-49.3	90.6	146.4	0	0	111.1	H66 G67 H88 N92 H112 N114 N408	H66-E90 CarbonylContact C-O 3.53Å; H66-E90 WeakPolarHBondContact CA-O 3.4Å; H66-E90 HydrophobicContact CB-CB 4.09Å; H66-E90 WeakPolarHBondContact CB-O 3.33Å; G67-E90 PolarHBondContact N-O 3.01Å; H88-E90 VanDerWaalsContact CA-OE2 3.3Å; H88-E90 WeakPolarHBondContact CA-OE2 3.06Å; H88-E90 VanDerWaalsContact CB-OE2 3.23Å; H88-E90 WeakPolarHBondContact CB-OE2 3.31Å; H88-E90 IonicContact CG-OE1 2.6Å; H88-E90 IonicContact ND1-OE1 2.71Å; H88-E90 PolarHBondContact ND1-OE1 3.4Å; E90-N92 PolarHBondContact O-N 2.78Å; E90-N92 PolarHBondContact O-ND2 2.71Å; E90-H112 HydrophobicContact CG-CB 4.24Å; E90-N114 WeakPolarHBondContact CA-O 3.31Å; E90-N114 WeakPolarHBondContact CG-ND2 3.27Å; E90-N114 WeakPolarHBondContact CG-OD1 3.4Å; E90-N408 PolarHBondContact OE1-ND2 2.86Å
91	N	80.8	Confident	90.8	Very high	59 Å²	59	22.1 Å²	22.1	32%	0.316	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	11.8	172.7	-72.7	-83.2	0	0	0	117.3	G93 N115 N361	N91-G93 VanDerWaalsContact C-N 3.26Å; N91-G93 PolarHBondContact O-N 3.31Å; N91-N115 WeakPolarHBondContact CA-O 3.38Å; N91-N115 PolarHBondContact N-O 3.44Å; N91-N115 VanDerWaalsContact N-O 3.13Å; N91-N115 PolarHBondContact OD1-ND2 3.01Å; N91-N361 PolarHBondContact ND2-OD1 3.32Å; N91-N361 PolarHBondContact OD1-ND2 2.96Å; N91-N361 PolarHBondContact OD1-OD1 3.49Å
92	N	87.3	Confident	90.9	Very high	5 Å²	5	22 Å²	22	3%	0.027	12%	0.116	C	C	.	.	S	Bend	trans	-75.2	-12.4	178.9	-88.9	-83.4	0	0	0	114.4	L65 N68 S69 L70 M89 E90 L94 N116	L65-N92 PolarHBondContact O-ND2 2.02Å; N68-N92 WeakPolarHBondContact CA-OD1 3.18Å; N68-N92 WeakPolarHBondContact CB-OD1 3.43Å; N68-N92 PolarHBondContact N-OD1 3.38Å; S69-N92 PolarHBondContact N-OD1 3.15Å; L70-N92 HydrophobicContact CB-CB 4.06Å; L70-N92 VanDerWaalsContact CB-OD1 3.29Å; L70-N92 WeakPolarHBondContact CB-OD1 3.3Å; L70-N92 WeakPolarHBondContact CG-OD1 3.45Å; L70-N92 PolarHBondContact N-OD1 2.77Å; M89-N92 PolarHBondContact O-ND2 2.69Å; E90-N92 PolarHBondContact O-N 2.78Å; E90-N92 PolarHBondContact O-ND2 2.71Å; N92-L94 HydrophobicContact CB-CB 4.47Å; N92-L94 PolarHBondContact O-N 3.15Å; N92-N116 WeakPolarHBondContact CA-OD1 3.1Å; N92-N116 PolarHBondContact N-OD1 3.45Å
93	G	89.5	Confident	91	Very high	15 Å²	15	19.9 Å²	19.9	16%	0.155	11%	0.111	C	C	.	.			trans	68.8	19.8	-171.9	0	0	0	0	0	113.2	N91 H95 N116	N91-G93 VanDerWaalsContact C-N 3.26Å; N91-G93 PolarHBondContact O-N 3.31Å; G93-H95 PolarHBondContact O-N 2.93Å; G93-N116 PolarHBondContact N-OD1 3.21Å
94	L	95.3	Very high	90.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.119	C	C	.	.			trans	-55.4	117.2	-179.9	175.5	54.8	0	0	0	110.8	L70 T71 L73 N92 E96 I97 N116 K117 I118	L70-L94 WeakPolarHBondContact O-CB 3.24Å; L70-L94 WeakPolarHBondContact O-CD1 3.4Å; T71-L94 WeakPolarHBondContact O-CA 3.42Å; L73-L94 HydrophobicContact CD1-CD1 4.35Å; L73-L94 HydrophobicContact CD1-CD2 3.74Å; L73-L94 HydrophobicContact CG-CD1 3.89Å; L73-L94 HydrophobicContact CG-CD2 4.15Å; N92-L94 HydrophobicContact CB-CB 4.47Å; N92-L94 PolarHBondContact O-N 3.15Å; L94-E96 WeakPolarHBondContact CD1-O 3.48Å; L94-I97 HydrophobicContact CD1-CG1 4.16Å; L94-I97 HydrophobicContact CD2-CD1 4.1Å; L94-I97 HydrophobicContact CD2-CG1 3.97Å; L94-I97 HydrophobicContact CG-CG1 4.21Å; L94-N116 HydrophobicContact CB-CB 4.08Å; L94-N116 WeakPolarHBondContact CB-OD1 3.31Å; L94-N116 PolarHBondContact N-OD1 2.96Å; L94-K117 CarbonylContact O-C 3.6Å; L94-K117 VanDerWaalsContact O-C 3.25Å; L94-K117 WeakPolarHBondContact O-CA 3.24Å; L94-K117 PolarHBondContact O-N 2.87Å; L94-I118 HydrophobicContact CD2-CD1 4.21Å; L94-I118 HydrophobicContact CG-CD1 4.31Å; L94-I118 HydrophobicContact CG-CG1 4.11Å; L94-I118 WeakPolarHBondContact O-CG1 3.38Å; L94-I118 PolarHBondContact O-N 3.06Å; L94-I118 VanDerWaalsContact O-N 3.1Å
95	H	93.4	Very high	90.7	Very high	57 Å²	57	20.3 Å²	20.3	26%	0.264	12%	0.119	S	C	.	.			trans	-114.4	-10.3	-179.1	67.3	-99.2	0	0	0	114.2	T71 R72 G93 K117	T71-H95 PolarHBondContact O-CE1 2.79Å; T71-H95 VanDerWaalsContact O-CE1 3.24Å; T71-H95 PolarHBondContact O-N 3.28Å; T71-H95 PolarHBondContact O-ND1 2.95Å; R72-H95 PolarHBondContact NE-NE2 2.76Å; G93-H95 PolarHBondContact O-N 2.93Å; H95-K117 WeakPolarHBondContact CA-O 3.43Å; H95-K117 HydrophobicContact CB-CB 3.83Å
96	E	91.6	Very high	90.8	Very high	54 Å²	54	24.3 Å²	24.3	25%	0.252	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	120.6	-176.5	177.2	164.7	-138.6	0	0	111	R72 L73 L94 R122	R72-E96 VanDerWaalsContact CA-O 3.3Å; R72-E96 WeakPolarHBondContact CA-O 3.19Å; R72-E96 HydrophobicContact CG-CB 4.41Å; R72-E96 IonicContact CZ-OE2 2.92Å; R72-E96 VanDerWaalsContact CZ-OE2 3.32Å; R72-E96 IonicContact NE-OE2 3.63Å; R72-E96 IonicContact NH1-OE2 3.88Å; R72-E96 PolarHBondContact NH1-OE2 3Å; R72-E96 IonicContact NH2-OE2 2.95Å; L73-E96 PolarHBondContact N-O 2.97Å; L73-E96 VanDerWaalsContact N-O 3.15Å; L94-E96 WeakPolarHBondContact CD1-O 3.48Å; E96-R122 IonicContact OE1-NH1 3.24Å
97	I	95.4	Very high	91.1	Very high	11 Å²	11	27.2 Å²	27.2	6%	0.056	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.8	169.5	-54.5	179	0	0	0	106.5	L73 L94 A101 F102 I113 I118 T125	L73-I97 HydrophobicContact CB-CG2 4.44Å; L73-I97 HydrophobicContact CD1-CG1 4.27Å; L73-I97 HydrophobicContact CD1-CG2 4.48Å; L94-I97 HydrophobicContact CD1-CG1 4.16Å; L94-I97 HydrophobicContact CD2-CD1 4.1Å; L94-I97 HydrophobicContact CD2-CG1 3.97Å; L94-I97 HydrophobicContact CG-CG1 4.21Å; I97-A101 HydrophobicContact CG2-CB 3.71Å; I97-F102 HydrophobicContact CD1-CE2 4.31Å; I97-F102 HydrophobicContact CD1-CZ 4.14Å; I97-F102 HydrophobicContact CG2-CE2 3.89Å; I97-F102 HydrophobicContact CG2-CZ 4.4Å; I97-I113 HydrophobicContact CD1-CD1 4.42Å; I97-I118 HydrophobicContact CD1-CD1 3.88Å; I97-I118 HydrophobicContact CG1-CD1 4.49Å; I97-T125 HydrophobicContact CB-CG2 4.01Å; I97-T125 HydrophobicContact CD1-CG2 4.27Å; I97-T125 HydrophobicContact CG2-CG2 3.84Å
98	V	93.9	Very high	91.2	Very high	40 Å²	40	27.2 Å²	27.2	24%	0.242	15%	0.151	C	C	.	.			trans	-82.3	137.7	174.1	-176	0	0	0	0	108.7	L73 P75 G100 A101	L73-V98 WeakPolarHBondContact O-CB 3.5Å; L73-V98 WeakPolarHBondContact O-CG2 3.27Å; L73-V98 PolarHBondContact O-N 3.06Å; P75-V98 HydrophobicContact CG-CB 4.34Å; P75-V98 HydrophobicContact CG-CG1 3.73Å; V98-G100 PolarHBondContact O-N 3.39Å; V98-A101 VanDerWaalsContact O-CB 3.22Å; V98-A101 WeakPolarHBondContact O-CB 3.43Å; V98-A101 PolarHBondContact O-N 2.95Å
99	P	92.4	Very high	91.2	Very high	46 Å²	46	28.7 Å²	28.7	30%	0.299	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	138.1	177	-30.9	37.4	0	0	0	113.2	A101 Q124	P99-A101 VanDerWaalsContact C-N 3.33Å; P99-Q124 WeakPolarHBondContact CA-O 3.47Å; P99-Q124 HydrophobicContact CB-CB 4.16Å
100	G	90.4	Very high	90.8	Very high	3 Å²	3	28.9 Å²	28.9	3%	0.031	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	15.5	-172.4	0	0	0	0	0	115.3	P75 N76 V98 F102 L103 Q124	P75-G100 WeakPolarHBondContact CA-O 3.35Å; N76-G100 PolarHBondContact N-O 3.02Å; V98-G100 PolarHBondContact O-N 3.39Å; G100-F102 VanDerWaalsContact C-N 3.27Å; G100-F102 PolarHBondContact O-N 2.8Å; G100-L103 WeakPolarHBondContact O-CB 3.24Å; G100-L103 WeakPolarHBondContact O-CD1 3.27Å; G100-L103 VanDerWaalsContact O-CG 3.26Å; G100-L103 WeakPolarHBondContact O-CG 3.18Å; G100-L103 PolarHBondContact O-N 3.1Å; G100-Q124 PolarHBondContact N-O 2.87Å
101	A	94.4	Very high	91.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-39.8	174.4	0	0	0	0	0	113.2	L73 F74 E77 I97 V98 P99 L103	L73-A101 HydrophobicContact CB-CB 3.78Å; F74-A101 VanDerWaalsContact O-CA 3.3Å; F74-A101 WeakPolarHBondContact O-CA 3.27Å; E77-A101 PolarHBondContact N-O 3.39Å; I97-A101 HydrophobicContact CG2-CB 3.71Å; V98-A101 VanDerWaalsContact O-CB 3.22Å; V98-A101 WeakPolarHBondContact O-CB 3.43Å; V98-A101 PolarHBondContact O-N 2.95Å; P99-A101 VanDerWaalsContact C-N 3.33Å; A101-L103 VanDerWaalsContact C-N 3.3Å; A101-L103 PolarHBondContact O-N 3.49Å
102	F	95.4	Very high	91.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	8.2	-177	-55.5	-77.6	0	0	0	114.3	L73 F78 L87 M89 I97 G100 G104 L105 L111 T125 F126 L129	L73-F102 HydrophobicContact CD1-CE1 4.31Å; L73-F102 HydrophobicContact CD1-CZ 4.24Å; F78-F102 HydrophobicContact CD2-CD1 4.35Å; F78-F102 HydrophobicContact CE2-CD1 4.31Å; F78-F102 HydrophobicContact CE2-CE1 4.48Å; L87-F102 HydrophobicContact CD2-CD1 4.22Å; L87-F102 HydrophobicContact CD2-CE1 4.16Å; M89-F102 HydrophobicContact CE-CE1 3.72Å; M89-F102 HydrophobicContact CE-CZ 4.26Å; I97-F102 HydrophobicContact CD1-CE2 4.31Å; I97-F102 HydrophobicContact CD1-CZ 4.14Å; I97-F102 HydrophobicContact CG2-CE2 3.89Å; I97-F102 HydrophobicContact CG2-CZ 4.4Å; G100-F102 VanDerWaalsContact C-N 3.27Å; G100-F102 PolarHBondContact O-N 2.8Å; F102-G104 PolarHBondContact O-N 2.74Å; F102-G104 VanDerWaalsContact O-N 3.16Å; F102-L105 HydrophobicContact CB-CD1 4.17Å; F102-L105 HydrophobicContact CD1-CD1 3.87Å; F102-L105 WeakPolarHBondContact O-CB 3.3Å; F102-L105 PolarHBondContact O-N 3.4Å; F102-L111 HydrophobicContact CE1-CD1 4.01Å; F102-L111 HydrophobicContact CE1-CD2 3.86Å; F102-L111 HydrophobicContact CE2-CD2 4.29Å; F102-L111 HydrophobicContact CZ-CD1 4.46Å; F102-L111 HydrophobicContact CZ-CD2 3.71Å; F102-T125 VanDerWaalsContact CD2-O 3.27Å; F102-T125 WeakPolarHBondContact CD2-O 3.43Å; F102-F126 HydrophobicContact CE2-CD1 4.05Å; F102-L129 HydrophobicContact CB-CD1 3.95Å; F102-L129 HydrophobicContact CB-CD2 3.88Å; F102-L129 HydrophobicContact CB-CG 3.66Å; F102-L129 HydrophobicContact CD1-CD1 4.08Å; F102-L129 HydrophobicContact CD1-CD2 4.32Å; F102-L129 HydrophobicContact CD1-CG 4.5Å; F102-L129 HydrophobicContact CD2-CD1 3.78Å; F102-L129 HydrophobicContact CD2-CG 4.42Å; F102-L129 HydrophobicContact CE2-CD1 4.24Å; F102-L129 HydrophobicContact CG-CD1 3.68Å; F102-L129 HydrophobicContact CG-CD2 4.22Å; F102-L129 HydrophobicContact CG-CG 3.98Å
103	L	92.1	Very high	92.1	Very high	57 Å²	57	25.4 Å²	25.4	30%	0.298	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	122.4	177	-74.2	171.4	0	0	0	111	N76 G100 A101 L127	N76-L103 WeakPolarHBondContact OD1-CB 3.06Å; N76-L103 WeakPolarHBondContact OD1-CD1 3.32Å; G100-L103 WeakPolarHBondContact O-CB 3.24Å; G100-L103 WeakPolarHBondContact O-CD1 3.27Å; G100-L103 VanDerWaalsContact O-CG 3.26Å; G100-L103 WeakPolarHBondContact O-CG 3.18Å; G100-L103 PolarHBondContact O-N 3.1Å; A101-L103 VanDerWaalsContact C-N 3.3Å; A101-L103 PolarHBondContact O-N 3.49Å; L103-L127 HydrophobicContact CD2-CD2 4.36Å; L103-L127 HydrophobicContact CD2-CG 4.13Å
104	G	84.8	Confident	91.8	Very high	25 Å²	25	24.7 Å²	24.7	26%	0.258	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	110	-17.5	-174	0	0	0	0	0	114.6	Y82 F102 Q106	Y82-G104 VanDerWaalsContact CA-O 3.29Å; Y82-G104 WeakPolarHBondContact CA-O 3.44Å; Y82-G104 WeakPolarHBondContact CB-O 3.38Å; F102-G104 PolarHBondContact O-N 2.74Å; F102-G104 VanDerWaalsContact O-N 3.16Å; G104-Q106 VanDerWaalsContact C-N 3.3Å; G104-Q106 PolarHBondContact O-N 3.2Å
105	L	93.8	Very high	91.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.143	C	C	.	.			trans	-90.4	40.8	-175.2	-68.4	175.2	0	0	0	114.3	F78 F81 A84 L87 F102 L107 V108 G128 L129	F78-L105 HydrophobicContact CB-CD1 3.53Å; F78-L105 HydrophobicContact CB-CD2 3.88Å; F78-L105 HydrophobicContact CB-CG 3.58Å; F78-L105 HydrophobicContact CD1-CD1 4.06Å; F78-L105 HydrophobicContact CD2-CD1 3.9Å; F78-L105 HydrophobicContact CG-CD1 3.56Å; F78-L105 HydrophobicContact CG-CD2 4.49Å; F78-L105 HydrophobicContact CG-CG 4.19Å; F81-L105 HydrophobicContact CB-CD2 4.17Å; F81-L105 WeakPolarHBondContact O-CD2 3.41Å; A84-L105 HydrophobicContact CB-CD2 4.08Å; L87-L105 HydrophobicContact CD2-CD1 3.59Å; F102-L105 HydrophobicContact CB-CD1 4.17Å; F102-L105 HydrophobicContact CD1-CD1 3.87Å; F102-L105 WeakPolarHBondContact O-CB 3.3Å; F102-L105 PolarHBondContact O-N 3.4Å; L105-L107 PolarHBondContact O-N 2.87Å; L105-V108 HydrophobicContact CB-CB 4.36Å; L105-V108 HydrophobicContact CB-CG2 3.77Å; L105-V108 HydrophobicContact CD1-CG2 4.42Å; L105-V108 HydrophobicContact CD2-CG2 3.87Å; L105-V108 HydrophobicContact CG-CG2 4.24Å; L105-V108 PolarHBondContact O-N 3.35Å; L105-V108 VanDerWaalsContact O-N 3.07Å; L105-G128 CarbonylContact C-O 3.54Å; L105-G128 VanDerWaalsContact C-O 3.23Å; L105-L129 HydrophobicContact CB-CD2 3.73Å; L105-L129 HydrophobicContact CD1-CD2 4.3Å
106	Q	90	Very high	91	Very high	113 Å²	113	24.5 Å²	24.5	53%	0.528	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-14.9	-171.2	-56.9	-169.2	-83.9	0	0	114.7	G104 G128 D130 D131	G104-Q106 VanDerWaalsContact C-N 3.3Å; G104-Q106 PolarHBondContact O-N 3.2Å; Q106-G128 WeakPolarHBondContact CA-O 3.44Å; Q106-G128 PolarHBondContact N-O 3.22Å; Q106-D130 PolarHBondContact NE2-OD2 3.48Å; Q106-D131 WeakPolarHBondContact O-CB 3.19Å
107	L	91.4	Very high	91	Very high	64 Å²	64	27.4 Å²	27.4	34%	0.335	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	1.3	-179.2	-58	-179.4	0	0	0	113.8	F60 A84 L105 K109	F60-L107 HydrophobicContact CD1-CD1 4.06Å; F60-L107 HydrophobicContact CE1-CD1 3.56Å; A84-L107 CarbonylContact O-C 3.44Å; L105-L107 PolarHBondContact O-N 2.87Å; L107-K109 PolarHBondContact O-N 3.43Å; L107-K109 VanDerWaalsContact O-N 3.15Å
108	V	95.4	Very high	91	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.			trans	-75.3	106.5	-179	173	0	0	0	0	110.1	A84 V85 L87 L105 R110 L129 L132	A84-V108 HydrophobicContact CB-CG2 3.98Å; A84-V108 VanDerWaalsContact O-CG2 3.24Å; A84-V108 WeakPolarHBondContact O-CG2 3.47Å; A84-V108 PolarHBondContact O-N 3.42Å; V85-V108 CarbonylContact O-C 3.3Å; V85-V108 WeakPolarHBondContact O-CA 3.37Å; L87-V108 HydrophobicContact CB-CG1 4.18Å; L105-V108 HydrophobicContact CB-CB 4.36Å; L105-V108 HydrophobicContact CB-CG2 3.77Å; L105-V108 HydrophobicContact CD1-CG2 4.42Å; L105-V108 HydrophobicContact CD2-CG2 3.87Å; L105-V108 HydrophobicContact CG-CG2 4.24Å; L105-V108 PolarHBondContact O-N 3.35Å; L105-V108 VanDerWaalsContact O-N 3.07Å; V108-R110 WeakPolarHBondContact CG1-O 3.5Å; V108-L129 HydrophobicContact CB-CD2 3.91Å; V108-L129 HydrophobicContact CG1-CD2 4.14Å; V108-L132 HydrophobicContact CG1-CD1 4.16Å; V108-L132 WeakPolarHBondContact O-CA 3.23Å; V108-L132 WeakPolarHBondContact O-CD1 3.15Å; V108-L132 PolarHBondContact O-N 3.08Å
109	K	89.3	Confident	91	Very high	46 Å²	46	30.7 Å²	30.7	20%	0.2	16%	0.156	C	C	.	.			trans	-78.7	-26	172.9	-69.3	169.7	174.3	-94.8	0	112.8	V85 L107 E133 Y134 N503	V85-K109 HydrophobicContact CG1-CD 4.07Å; V85-K109 PolarHBondContact O-N 3.3Å; L107-K109 PolarHBondContact O-N 3.43Å; L107-K109 VanDerWaalsContact O-N 3.15Å; K109-E133 HydrophobicContact CB-CG 4.37Å; K109-E133 WeakPolarHBondContact CD-OE1 2.98Å; K109-E133 HydrophobicContact CG-CG 4.4Å; K109-E133 IonicContact NZ-OE1 2.89Å; K109-E133 PolarHBondContact NZ-OE1 2.94Å; K109-E133 PolarHBondContact O-N 3.43Å; K109-Y134 PolarHBondContact O-N 2.87Å; K109-N503 PolarHBondContact NZ-ND2 2.97Å; K109-N503 PolarHBondContact NZ-OD1 2.6Å
110	R	85.1	Confident	91.2	Very high	3 Å²	3	30.3 Å²	30.3	1%	0.011	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.2	-171.4	-125	-177.4	165.5	54	174.4	112.5	V85 S86 L87 V108 H112 Y134 S432 E455 Y456	V85-R110 PolarHBondContact O-N 3.25Å; S86-R110 WeakPolarHBondContact CA-O 3.36Å; L87-R110 PolarHBondContact N-O 2.85Å; V108-R110 WeakPolarHBondContact CG1-O 3.5Å; R110-H112 WeakPolarHBondContact CD-NE2 3.45Å; R110-H112 WeakPolarHBondContact CG-NE2 3Å; R110-H112 PolarHBondContact NE-NE2 3.43Å; R110-H112 VanDerWaalsContact NE-NE2 3.19Å; R110-Y134 HydrophobicContact CG-CD1 3.67Å; R110-Y134 HydrophobicContact CG-CE1 4.38Å; R110-Y134 HydrophobicContact CG-CG 4Å; R110-Y134 VanDerWaalsContact NH1-CE2 3.34Å; R110-S432 PolarHBondContact NH1-OG 2.93Å; R110-E455 IonicContact CZ-OE2 3.53Å; R110-E455 VanDerWaalsContact CZ-OE2 3.31Å; R110-E455 VanDerWaalsContact NH1-CD 3.29Å; R110-E455 IonicContact NH1-OE1 3.57Å; R110-E455 IonicContact NH1-OE2 3.37Å; R110-E455 PolarHBondContact NH1-OE2 2.79Å; R110-E455 IonicContact NH2-OE2 2.71Å; R110-E455 PolarHBondContact NH2-OE2 3.01Å; R110-Y456 HydrophobicContact CG-CE1 4.34Å; R110-Y456 HydrophobicContact CG-CE2 4.46Å; R110-Y456 VanDerWaalsContact CZ-CE2 3.48Å
111	L	96.1	Very high	91.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	115.3	175.2	179.4	58.1	0	0	0	111.4	L87 M89 F102 I113 F126 L129 L132 Y134 L135 Q136	L87-L111 HydrophobicContact CB-CD1 4.07Å; L87-L111 HydrophobicContact CD2-CD1 3.89Å; L87-L111 HydrophobicContact CG-CD1 3.87Å; M89-L111 HydrophobicContact CE-CD1 4.03Å; F102-L111 HydrophobicContact CE1-CD1 4.01Å; F102-L111 HydrophobicContact CE1-CD2 3.86Å; F102-L111 HydrophobicContact CE2-CD2 4.29Å; F102-L111 HydrophobicContact CZ-CD1 4.46Å; F102-L111 HydrophobicContact CZ-CD2 3.71Å; L111-I113 HydrophobicContact CD1-CG2 3.66Å; L111-I113 HydrophobicContact CD2-CG2 4.31Å; L111-I113 HydrophobicContact CG-CG2 3.88Å; L111-F126 HydrophobicContact CD2-CD1 4.14Å; L111-F126 HydrophobicContact CD2-CE1 4.19Å; L111-L129 HydrophobicContact CD2-CD1 3.63Å; L111-L132 HydrophobicContact CB-CD1 3.72Å; L111-Y134 PolarHBondContact N-O 3.05Å; L111-L135 HydrophobicContact CB-CD1 4.03Å; L111-L135 HydrophobicContact CD2-CD1 3.86Å; L111-L135 HydrophobicContact CG-CD1 3.94Å; L111-Q136 PolarHBondContact O-N 2.89Å
112	H	88.8	Confident	91.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	104.8	176.3	-57.2	-100.4	0	0	0	109.4	L87 H88 M89 E90 R110 N114 Y134 Q136	L87-H112 PolarHBondContact O-N 2.9Å; H88-H112 AromaticContact CE1-CD2 3.17Å; H88-H112 PolarHBondContact CE1-CD2 3.33Å; H88-H112 AromaticContact CE1-CE1 3.95Å; H88-H112 AromaticContact CE1-CG 3.8Å; H88-H112 AromaticContact CE1-NE2 3.3Å; H88-H112 PolarHBondContact CE1-NE2 3.18Å; H88-H112 VanDerWaalsContact CE1-NE2 3.3Å; H88-H112 AromaticContact ND1-CD2 3.38Å; H88-H112 PolarHBondContact ND1-CD2 3.46Å; H88-H112 AromaticContact ND1-CG 3.63Å; H88-H112 AromaticContact ND1-NE2 3.94Å; H88-H112 AromaticContact NE2-CD2 3.74Å; H88-H112 AromaticContact NE2-NE2 3.92Å; M89-H112 PolarHBondContact N-O 3.22Å; E90-H112 HydrophobicContact CG-CB 4.24Å; R110-H112 WeakPolarHBondContact CD-NE2 3.45Å; R110-H112 WeakPolarHBondContact CG-NE2 3Å; R110-H112 PolarHBondContact NE-NE2 3.43Å; R110-H112 VanDerWaalsContact NE-NE2 3.19Å; H112-N114 WeakPolarHBondContact CB-OD1 3.05Å; H112-Y134 AromaticContact CE1-CE1 3.4Å; H112-Y134 WeakPolarHBondContact CE1-CE1 3.47Å; H112-Y134 AromaticContact ND1-CE1 3.86Å; H112-Q136 PolarHBondContact ND1-OE1 2.87Å
113	I	94.6	Very high	91.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.191	C	C	.	.			trans	-121.2	13	179.4	55	173.5	0	0	0	112.6	M89 I97 L111 N116 I118 F121 F126 L135 Q136 A137 N140	M89-I113 HydrophobicContact CB-CG2 4.48Å; M89-I113 HydrophobicContact CE-CG2 3.76Å; I97-I113 HydrophobicContact CD1-CD1 4.42Å; L111-I113 HydrophobicContact CD1-CG2 3.66Å; L111-I113 HydrophobicContact CD2-CG2 4.31Å; L111-I113 HydrophobicContact CG-CG2 3.88Å; I113-N116 WeakPolarHBondContact O-CB 3.29Å; I113-N116 PolarHBondContact O-ND2 3.08Å; I113-I118 HydrophobicContact CB-CD1 4.17Å; I113-I118 HydrophobicContact CD1-CD1 3.92Å; I113-I118 HydrophobicContact CG1-CD1 4.35Å; I113-F121 HydrophobicContact CD1-CE1 3.96Å; I113-F121 HydrophobicContact CD1-CZ 3.94Å; I113-F126 HydrophobicContact CD1-CE1 4.11Å; I113-F126 HydrophobicContact CD1-CZ 4.5Å; I113-L135 HydrophobicContact CD1-CD1 4.02Å; I113-L135 HydrophobicContact CG1-CD1 4.19Å; I113-Q136 VanDerWaalsContact CG1-O 3.3Å; I113-Q136 WeakPolarHBondContact CG1-O 3.49Å; I113-Q136 PolarHBondContact N-O 2.97Å; I113-A137 HydrophobicContact CD1-CB 4.03Å; I113-A137 HydrophobicContact CG1-CB 3.77Å; I113-N140 PolarHBondContact O-ND2 3.17Å
114	N	85.1	Confident	91.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.198	C	C	.	.			trans	-63.4	163.3	175.3	54.1	-70.3	0	0	0	114.2	E90 H112 N116 Q136 D138 D384	E90-N114 WeakPolarHBondContact CA-O 3.31Å; E90-N114 WeakPolarHBondContact CG-ND2 3.27Å; E90-N114 WeakPolarHBondContact CG-OD1 3.4Å; H112-N114 WeakPolarHBondContact CB-OD1 3.05Å; N114-N116 PolarHBondContact O-N 3.04Å; N114-N116 PolarHBondContact O-ND2 2.92Å; N114-N116 VanDerWaalsContact O-ND2 3.15Å; N114-Q136 HydrophobicContact CB-CG 4.04Å; N114-Q136 VanDerWaalsContact CG-CD 3.49Å; N114-Q136 PolarHBondContact N-O 3.4Å; N114-Q136 PolarHBondContact ND2-NE2 2.75Å; N114-Q136 PolarHBondContact OD1-NE2 3.07Å; N114-D138 CarbonylContact C-O 3.51Å; N114-D138 WeakPolarHBondContact CA-O 3.4Å; N114-D138 VanDerWaalsContact CB-O 3.28Å; N114-D138 WeakPolarHBondContact CB-O 3.42Å; N114-D138 WeakPolarHBondContact CB-OD1 3.25Å; N114-D384 PolarHBondContact ND2-OD1 2.92Å; N114-D384 PolarHBondContact ND2-OD2 2.76Å
115	N	80.3	Confident	91.5	Very high	42 Å²	42	40.4 Å²	40.4	23%	0.225	19%	0.186	C	C	.	.	S	Bend	trans	39.2	64.8	-168.2	-165.9	108.6	0	0	0	112.2	N91 D138 F139 N361	N91-N115 WeakPolarHBondContact CA-O 3.38Å; N91-N115 PolarHBondContact N-O 3.44Å; N91-N115 VanDerWaalsContact N-O 3.13Å; N91-N115 PolarHBondContact OD1-ND2 3.01Å; N115-D138 PolarHBondContact N-O 3.26Å; N115-F139 WeakPolarHBondContact CA-O 3.36Å; N115-F139 HydrophobicContact CB-CB 4.2Å; N115-N361 HydrophobicContact CB-CB 4.01Å; N115-N361 PolarHBondContact ND2-ND2 3.17Å; N115-N361 WeakPolarHBondContact OD1-CB 3.48Å; N115-N361 PolarHBondContact OD1-ND2 3.38Å
116	N	89.9	Confident	91.6	Very high	10 Å²	10	40.4 Å²	40.4	5%	0.053	19%	0.186	C	C	.	.	S	Bend	trans	-129.4	-149.7	173.7	-86.2	-61.9	0	0	0	108.8	M89 N92 G93 L94 I113 N114 I118 F139 N140	M89-N116 PolarHBondContact O-ND2 3.22Å; N92-N116 WeakPolarHBondContact CA-OD1 3.1Å; N92-N116 PolarHBondContact N-OD1 3.45Å; G93-N116 PolarHBondContact N-OD1 3.21Å; L94-N116 HydrophobicContact CB-CB 4.08Å; L94-N116 WeakPolarHBondContact CB-OD1 3.31Å; L94-N116 PolarHBondContact N-OD1 2.96Å; I113-N116 WeakPolarHBondContact O-CB 3.29Å; I113-N116 PolarHBondContact O-ND2 3.08Å; N114-N116 PolarHBondContact O-N 3.04Å; N114-N116 PolarHBondContact O-ND2 2.92Å; N114-N116 VanDerWaalsContact O-ND2 3.15Å; N116-I118 HydrophobicContact CB-CG1 4.38Å; N116-F139 PolarHBondContact N-O 2.81Å; N116-N140 WeakPolarHBondContact CA-OD1 3.34Å; N116-N140 WeakPolarHBondContact CB-OD1 3.47Å
117	K	92.3	Very high	91.8	Very high	116 Å²	116	37.5 Å²	37.5	50%	0.504	17%	0.174	S	C	.	.			trans	-136.2	20.3	-175.8	-66	175.1	-174.2	164	0	111.6	L94 H95 K119 N140 L141	L94-K117 CarbonylContact O-C 3.6Å; L94-K117 VanDerWaalsContact O-C 3.25Å; L94-K117 WeakPolarHBondContact O-CA 3.24Å; L94-K117 PolarHBondContact O-N 2.87Å; H95-K117 WeakPolarHBondContact CA-O 3.43Å; H95-K117 HydrophobicContact CB-CB 3.83Å; K117-K119 PolarHBondContact O-N 2.98Å; K117-N140 PolarHBondContact N-OD1 3.47Å; K117-N140 VanDerWaalsContact N-OD1 3.14Å; K117-L141 HydrophobicContact CB-CD1 4.21Å
118	I	96.2	Very high	91.7	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	16%	0.16	C	C	.	.			trans	-63.6	132.1	-176.4	-56	168.4	0	0	0	108.1	L94 I97 I113 N116 F121 N140 L141 L142	L94-I118 HydrophobicContact CD2-CD1 4.21Å; L94-I118 HydrophobicContact CG-CD1 4.31Å; L94-I118 HydrophobicContact CG-CG1 4.11Å; L94-I118 WeakPolarHBondContact O-CG1 3.38Å; L94-I118 PolarHBondContact O-N 3.06Å; L94-I118 VanDerWaalsContact O-N 3.1Å; I97-I118 HydrophobicContact CD1-CD1 3.88Å; I97-I118 HydrophobicContact CG1-CD1 4.49Å; I113-I118 HydrophobicContact CB-CD1 4.17Å; I113-I118 HydrophobicContact CD1-CD1 3.92Å; I113-I118 HydrophobicContact CG1-CD1 4.35Å; N116-I118 HydrophobicContact CB-CG1 4.38Å; I118-F121 HydrophobicContact CD1-CE1 4.4Å; I118-F121 HydrophobicContact CG2-CD1 4.1Å; I118-F121 HydrophobicContact CG2-CE1 3.86Å; I118-N140 HydrophobicContact CB-CB 4.37Å; I118-N140 WeakPolarHBondContact CB-OD1 3.37Å; I118-N140 WeakPolarHBondContact CG1-OD1 3.37Å; I118-N140 PolarHBondContact N-OD1 3.3Å; I118-L141 CarbonylContact O-C 3.55Å; I118-L141 VanDerWaalsContact O-CA 3.28Å; I118-L141 WeakPolarHBondContact O-CA 3.37Å; I118-L141 PolarHBondContact O-N 3.33Å; I118-L142 PolarHBondContact O-N 2.9Å; I118-L142 VanDerWaalsContact O-N 3.11Å
119	K	93.7	Very high	91.7	Very high	118 Å²	118	34.7 Å²	34.7	51%	0.513	16%	0.16	S	C	.	.			trans	-104.8	-29.6	-175.2	-61.9	178.3	-175	172.4	0	113.7	K117 L141 L142 R143	K117-K119 PolarHBondContact O-N 2.98Å; K119-L141 HydrophobicContact CG-CB 4.28Å; K119-L142 WeakPolarHBondContact O-CA 3.27Å; K119-R143 PolarHBondContact O-N 3.35Å
120	S	95.2	Very high	91.8	Very high	37 Å²	37	35.5 Å²	35.5	26%	0.259	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	145.6	-177.3	58	0	0	0	0	112	D144	S120-D144 CarbonylContact C-O 3.25Å; S120-D144 WeakPolarHBondContact CA-O 3.26Å; S120-D144 VanDerWaalsContact CB-O 3.28Å; S120-D144 WeakPolarHBondContact CB-O 3.27Å
121	F	96.3	Very high	92.2	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	110.5	164.6	-67	-33.2	0	0	0	108.4	I113 I118 T125 F126 A137 L142 D144 D146 A149 F150 L161	I113-F121 HydrophobicContact CD1-CE1 3.96Å; I113-F121 HydrophobicContact CD1-CZ 3.94Å; I118-F121 HydrophobicContact CD1-CE1 4.4Å; I118-F121 HydrophobicContact CG2-CD1 4.1Å; I118-F121 HydrophobicContact CG2-CE1 3.86Å; F121-T125 HydrophobicContact CD1-CG2 4.31Å; F121-F126 HydrophobicContact CB-CE2 4.29Å; F121-F126 HydrophobicContact CD1-CE2 4.14Å; F121-F126 AromaticContact CD1-CZ 3.73Å; F121-F126 HydrophobicContact CD1-CZ 3.73Å; F121-F126 HydrophobicContact CD2-CE2 4.06Å; F121-F126 HydrophobicContact CD2-CZ 4.01Å; F121-F126 HydrophobicContact CE1-CE1 4.45Å; F121-F126 HydrophobicContact CE1-CE2 4.47Å; F121-F126 AromaticContact CE1-CZ 3.65Å; F121-F126 HydrophobicContact CE1-CZ 3.65Å; F121-F126 HydrophobicContact CE2-CE2 4.39Å; F121-F126 AromaticContact CE2-CZ 3.93Å; F121-F126 HydrophobicContact CE2-CZ 3.93Å; F121-F126 AromaticContact CG-CE2 3.93Å; F121-F126 HydrophobicContact CG-CE2 3.93Å; F121-F126 AromaticContact CG-CZ 3.92Å; F121-F126 HydrophobicContact CG-CZ 3.92Å; F121-F126 AromaticContact CZ-CZ 3.76Å; F121-F126 HydrophobicContact CZ-CZ 3.76Å; F121-A137 HydrophobicContact CE2-CB 4.33Å; F121-A137 HydrophobicContact CZ-CB 3.76Å; F121-L142 HydrophobicContact CB-CD1 4.49Å; F121-L142 HydrophobicContact CD1-CD1 4.37Å; F121-L142 HydrophobicContact CD2-CD1 4.03Å; F121-L142 HydrophobicContact CD2-CD2 3.66Å; F121-L142 HydrophobicContact CE2-CD1 4.38Å; F121-L142 HydrophobicContact CE2-CD2 3.41Å; F121-L142 VanDerWaalsContact CE2-CD2 3.41Å; F121-L142 HydrophobicContact CG-CD1 4.02Å; F121-L142 HydrophobicContact CG-CD2 4.44Å; F121-L142 HydrophobicContact CZ-CD2 4.01Å; F121-D144 PolarHBondContact N-O 3.04Å; F121-D146 PolarHBondContact O-N 3.02Å; F121-A149 HydrophobicContact CB-CB 4.19Å; F121-F150 AromaticContact CD2-CE1 3.89Å; F121-F150 HydrophobicContact CD2-CE1 3.89Å; F121-F150 AromaticContact CD2-CZ 3.9Å; F121-F150 HydrophobicContact CD2-CZ 3.9Å; F121-F150 HydrophobicContact CE2-CE1 4.2Å; F121-F150 HydrophobicContact CE2-CZ 4.31Å; F121-L161 HydrophobicContact CE2-CD2 4.01Å
122	R	93.4	Very high	92.2	Very high	106 Å²	106	37.6 Å²	37.6	40%	0.4	18%	0.178	S	C	.	.			trans	-81.6	162.2	176.5	-66.1	-177.1	-175.9	141.3	5.7	111.4	E96 Q124 T125 D146	E96-R122 IonicContact OE1-NH1 3.24Å; R122-Q124 PolarHBondContact O-N 3.14Å; R122-T125 WeakPolarHBondContact CA-OG1 3.08Å; R122-T125 PolarHBondContact N-OG1 2.94Å; R122-T125 VanDerWaalsContact O-CB 3.28Å; R122-T125 WeakPolarHBondContact O-CB 3.5Å; R122-T125 PolarHBondContact O-N 3.46Å; R122-T125 VanDerWaalsContact O-N 3.1Å; R122-T125 PolarHBondContact O-OG1 3.12Å; R122-D146 WeakPolarHBondContact CA-OD2 3.3Å
123	K	90.9	Very high	92.2	Very high	95 Å²	95	38 Å²	38	41%	0.413	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	139.3	167	-173.7	155	-170.1	145.2	0	110.3	T125 D146	K123-T125 PolarHBondContact O-N 3.24Å; K123-D146 HydrophobicContact CB-CB 4.34Å; K123-D146 PolarHBondContact N-OD2 3.06Å
124	Q	90.5	Very high	91.9	Very high	92 Å²	92	38.1 Å²	38.1	43%	0.43	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	20.5	-175.4	-65.7	172	-29.4	0	0	115.4	P99 G100 R122 F126 L127	P99-Q124 WeakPolarHBondContact CA-O 3.47Å; P99-Q124 HydrophobicContact CB-CB 4.16Å; G100-Q124 PolarHBondContact N-O 2.87Å; R122-Q124 PolarHBondContact O-N 3.14Å; Q124-F126 VanDerWaalsContact C-N 3.28Å; Q124-F126 PolarHBondContact O-N 2.84Å; Q124-L127 HydrophobicContact CB-CB 4.08Å; Q124-L127 HydrophobicContact CB-CD2 4.3Å; Q124-L127 HydrophobicContact CG-CD2 4.34Å; Q124-L127 WeakPolarHBondContact O-CB 2.97Å; Q124-L127 PolarHBondContact O-N 2.69Å
125	T	93.7	Very high	92.4	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-42.4	171.5	-65.6	0	0	0	0	111.5	I97 F102 F121 R122 K123	I97-T125 HydrophobicContact CB-CG2 4.01Å; I97-T125 HydrophobicContact CD1-CG2 4.27Å; I97-T125 HydrophobicContact CG2-CG2 3.84Å; F102-T125 VanDerWaalsContact CD2-O 3.27Å; F102-T125 WeakPolarHBondContact CD2-O 3.43Å; F121-T125 HydrophobicContact CD1-CG2 4.31Å; R122-T125 WeakPolarHBondContact CA-OG1 3.08Å; R122-T125 PolarHBondContact N-OG1 2.94Å; R122-T125 VanDerWaalsContact O-CB 3.28Å; R122-T125 WeakPolarHBondContact O-CB 3.5Å; R122-T125 PolarHBondContact O-N 3.46Å; R122-T125 VanDerWaalsContact O-N 3.1Å; R122-T125 PolarHBondContact O-OG1 3.12Å; K123-T125 PolarHBondContact O-N 3.24Å
126	F	95.6	Very high	92.8	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	13.6	-174.7	-56.3	-73.1	0	0	0	114.2	F102 L111 I113 F121 Q124 G128 L129 L135 F150 L153	F102-F126 HydrophobicContact CE2-CD1 4.05Å; L111-F126 HydrophobicContact CD2-CD1 4.14Å; L111-F126 HydrophobicContact CD2-CE1 4.19Å; I113-F126 HydrophobicContact CD1-CE1 4.11Å; I113-F126 HydrophobicContact CD1-CZ 4.5Å; F121-F126 HydrophobicContact CB-CE2 4.29Å; F121-F126 HydrophobicContact CD1-CE2 4.14Å; F121-F126 AromaticContact CD1-CZ 3.73Å; F121-F126 HydrophobicContact CD1-CZ 3.73Å; F121-F126 HydrophobicContact CD2-CE2 4.06Å; F121-F126 HydrophobicContact CD2-CZ 4.01Å; F121-F126 HydrophobicContact CE1-CE1 4.45Å; F121-F126 HydrophobicContact CE1-CE2 4.47Å; F121-F126 AromaticContact CE1-CZ 3.65Å; F121-F126 HydrophobicContact CE1-CZ 3.65Å; F121-F126 HydrophobicContact CE2-CE2 4.39Å; F121-F126 AromaticContact CE2-CZ 3.93Å; F121-F126 HydrophobicContact CE2-CZ 3.93Å; F121-F126 AromaticContact CG-CE2 3.93Å; F121-F126 HydrophobicContact CG-CE2 3.93Å; F121-F126 AromaticContact CG-CZ 3.92Å; F121-F126 HydrophobicContact CG-CZ 3.92Å; F121-F126 AromaticContact CZ-CZ 3.76Å; F121-F126 HydrophobicContact CZ-CZ 3.76Å; Q124-F126 VanDerWaalsContact C-N 3.28Å; Q124-F126 PolarHBondContact O-N 2.84Å; F126-G128 PolarHBondContact O-N 3.07Å; F126-L129 HydrophobicContact CB-CD1 4.12Å; F126-L129 HydrophobicContact CD1-CD1 4.06Å; F126-L129 WeakPolarHBondContact O-CB 3.17Å; F126-L129 PolarHBondContact O-N 3.29Å; F126-L135 HydrophobicContact CD1-CD2 4.46Å; F126-L135 HydrophobicContact CE1-CD1 4.04Å; F126-L135 HydrophobicContact CE1-CD2 3.85Å; F126-L135 HydrophobicContact CE2-CD2 4.17Å; F126-L135 HydrophobicContact CZ-CD2 3.69Å; F126-F150 HydrophobicContact CD2-CD1 4.07Å; F126-F150 HydrophobicContact CD2-CE1 4.41Å; F126-F150 AromaticContact CE2-CD1 3.79Å; F126-F150 HydrophobicContact CE2-CD1 3.79Å; F126-F150 AromaticContact CE2-CE1 3.67Å; F126-F150 HydrophobicContact CE2-CE1 3.67Å; F126-F150 HydrophobicContact CZ-CE1 4.31Å; F126-L153 HydrophobicContact CB-CD1 4Å; F126-L153 HydrophobicContact CB-CD2 3.89Å; F126-L153 HydrophobicContact CB-CG 4.19Å; F126-L153 HydrophobicContact CD2-CD1 4.07Å; F126-L153 HydrophobicContact CG-CD1 4.05Å
127	L	93.5	Very high	93	Very high	51 Å²	51	35.6 Å²	35.6	27%	0.267	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	123.1	-176.8	179.7	67.5	0	0	0	111.5	L103 Q124	L103-L127 HydrophobicContact CD2-CD2 4.36Å; L103-L127 HydrophobicContact CD2-CG 4.13Å; Q124-L127 HydrophobicContact CB-CB 4.08Å; Q124-L127 HydrophobicContact CB-CD2 4.3Å; Q124-L127 HydrophobicContact CG-CD2 4.34Å; Q124-L127 WeakPolarHBondContact O-CB 2.97Å; Q124-L127 PolarHBondContact O-N 2.69Å
128	G	90.5	Very high	92.5	Very high	5 Å²	5	30.1 Å²	30.1	5%	0.052	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.5	3	-177.1	0	0	0	0	0	115.3	L105 Q106 F126	L105-G128 CarbonylContact C-O 3.54Å; L105-G128 VanDerWaalsContact C-O 3.23Å; Q106-G128 WeakPolarHBondContact CA-O 3.44Å; Q106-G128 PolarHBondContact N-O 3.22Å; F126-G128 PolarHBondContact O-N 3.07Å
129	L	95.8	Very high	91.5	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	15%	0.149	C	C	.	.			trans	-98.9	54.9	174.2	-64.3	171.7	0	0	0	111.1	F102 L105 V108 L111 F126 D131 L132 L153	F102-L129 HydrophobicContact CB-CD1 3.95Å; F102-L129 HydrophobicContact CB-CD2 3.88Å; F102-L129 HydrophobicContact CB-CG 3.66Å; F102-L129 HydrophobicContact CD1-CD1 4.08Å; F102-L129 HydrophobicContact CD1-CD2 4.32Å; F102-L129 HydrophobicContact CD1-CG 4.5Å; F102-L129 HydrophobicContact CD2-CD1 3.78Å; F102-L129 HydrophobicContact CD2-CG 4.42Å; F102-L129 HydrophobicContact CE2-CD1 4.24Å; F102-L129 HydrophobicContact CG-CD1 3.68Å; F102-L129 HydrophobicContact CG-CD2 4.22Å; F102-L129 HydrophobicContact CG-CG 3.98Å; L105-L129 HydrophobicContact CB-CD2 3.73Å; L105-L129 HydrophobicContact CD1-CD2 4.3Å; V108-L129 HydrophobicContact CB-CD2 3.91Å; V108-L129 HydrophobicContact CG1-CD2 4.14Å; L111-L129 HydrophobicContact CD2-CD1 3.63Å; F126-L129 HydrophobicContact CB-CD1 4.12Å; F126-L129 HydrophobicContact CD1-CD1 4.06Å; F126-L129 WeakPolarHBondContact O-CB 3.17Å; F126-L129 PolarHBondContact O-N 3.29Å; L129-D131 VanDerWaalsContact C-N 3.26Å; L129-D131 PolarHBondContact O-N 2.73Å; L129-L132 HydrophobicContact CB-CB 4.16Å; L129-L132 HydrophobicContact CB-CD2 4.45Å; L129-L132 HydrophobicContact CD1-CD2 4.34Å; L129-L132 WeakPolarHBondContact O-CB 3.27Å; L129-L132 PolarHBondContact O-N 3.42Å; L129-L153 HydrophobicContact CB-CD2 4.07Å
130	D	90.7	Very high	91.1	Very high	62 Å²	62	26.2 Å²	26.2	33%	0.332	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-25.6	-165.8	-47.9	-25.5	0	0	0	113.5	Q106	Q106-D130 PolarHBondContact NE2-OD2 3.48Å
131	D	93.5	Very high	90.9	Very high	46 Å²	46	27.9 Å²	27.9	25%	0.246	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	13.4	179.2	-86	27.8	0	0	0	114.6	Q106 L129 E133 K155	Q106-D131 WeakPolarHBondContact O-CB 3.19Å; L129-D131 VanDerWaalsContact C-N 3.26Å; L129-D131 PolarHBondContact O-N 2.73Å; D131-E133 PolarHBondContact O-N 3.11Å; D131-K155 IonicContact OD1-NZ 3.04Å; D131-K155 PolarHBondContact OD1-NZ 3.06Å; D131-K155 IonicContact OD2-NZ 2.65Å; D131-K155 PolarHBondContact OD2-NZ 3.3Å; D131-K155 VanDerWaalsContact OD2-NZ 3.12Å
132	L	96.4	Very high	90.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	13%	0.132	C	C	.	.			trans	-68.5	115.8	-173.3	-165.2	74.7	0	0	0	113.3	V108 L111 L129 L135 L153 K155 L156	V108-L132 HydrophobicContact CG1-CD1 4.16Å; V108-L132 WeakPolarHBondContact O-CA 3.23Å; V108-L132 WeakPolarHBondContact O-CD1 3.15Å; V108-L132 PolarHBondContact O-N 3.08Å; L111-L132 HydrophobicContact CB-CD1 3.72Å; L129-L132 HydrophobicContact CB-CB 4.16Å; L129-L132 HydrophobicContact CB-CD2 4.45Å; L129-L132 HydrophobicContact CD1-CD2 4.34Å; L129-L132 WeakPolarHBondContact O-CB 3.27Å; L129-L132 PolarHBondContact O-N 3.42Å; L132-L135 HydrophobicContact CD2-CB 4.17Å; L132-L153 HydrophobicContact CB-CD2 4.15Å; L132-L153 HydrophobicContact CD2-CD1 4.1Å; L132-L153 HydrophobicContact CD2-CD2 3.92Å; L132-K155 CarbonylContact O-C 3.5Å; L132-L156 HydrophobicContact CD2-CD1 4.32Å; L132-L156 HydrophobicContact CG-CD1 4.43Å; L132-L156 VanDerWaalsContact O-CA 3.27Å; L132-L156 WeakPolarHBondContact O-CA 3.37Å; L132-L156 PolarHBondContact O-N 3.11Å; L132-L156 VanDerWaalsContact O-N 3.13Å
133	E	88.3	Confident	90.8	Very high	9 Å²	9	29.3 Å²	29.3	4%	0.042	14%	0.138	C	C	.	.			trans	-93	-32.2	177	-67.3	167.4	-166.5	0	0	112.2	K109 D131 E157 V158 Y456 H502 N503 H527	K109-E133 HydrophobicContact CB-CG 4.37Å; K109-E133 WeakPolarHBondContact CD-OE1 2.98Å; K109-E133 HydrophobicContact CG-CG 4.4Å; K109-E133 IonicContact NZ-OE1 2.89Å; K109-E133 PolarHBondContact NZ-OE1 2.94Å; K109-E133 PolarHBondContact O-N 3.43Å; D131-E133 PolarHBondContact O-N 3.11Å; E133-E157 PolarHBondContact O-N 2.65Å; E133-V158 PolarHBondContact O-N 3.39Å; E133-V158 VanDerWaalsContact O-N 3.15Å; E133-Y456 PolarHBondContact OE2-OH 2.94Å; E133-H502 IonicContact OE2-CE1 2.92Å; E133-H502 PolarHBondContact OE2-CE1 3.28Å; E133-H502 VanDerWaalsContact OE2-CE1 3.29Å; E133-H502 IonicContact OE2-ND1 3.17Å; E133-N503 PolarHBondContact OE1-ND2 3.22Å; E133-N503 PolarHBondContact OE2-ND2 3.48Å; E133-H527 IonicContact OE1-NE2 3.12Å
134	Y	87.8	Confident	90.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.008	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	126.3	-169.7	179.1	-78	0	0	0	112	K109 R110 L111 H112 Q136 V158 I160 D431 E455	K109-Y134 PolarHBondContact O-N 2.87Å; R110-Y134 HydrophobicContact CG-CD1 3.67Å; R110-Y134 HydrophobicContact CG-CE1 4.38Å; R110-Y134 HydrophobicContact CG-CG 4Å; R110-Y134 VanDerWaalsContact NH1-CE2 3.34Å; L111-Y134 PolarHBondContact N-O 3.05Å; H112-Y134 AromaticContact CE1-CE1 3.4Å; H112-Y134 WeakPolarHBondContact CE1-CE1 3.47Å; H112-Y134 AromaticContact ND1-CE1 3.86Å; Y134-Q136 HydrophobicContact CD1-CB 4.38Å; Y134-Q136 HydrophobicContact CE1-CB 3.62Å; Y134-V158 HydrophobicContact CD2-CB 3.55Å; Y134-V158 HydrophobicContact CD2-CG1 3.39Å; Y134-V158 HydrophobicContact CD2-CG2 4.05Å; Y134-V158 HydrophobicContact CE2-CB 4.3Å; Y134-V158 HydrophobicContact CE2-CG1 3.62Å; Y134-V158 HydrophobicContact CG-CB 4.18Å; Y134-V158 HydrophobicContact CG-CG1 4.25Å; Y134-I160 HydrophobicContact CE2-CD1 3.91Å; Y134-D431 PolarHBondContact OH-OD2 3.41Å; Y134-E455 WeakPolarHBondContact CD2-OE2 3.49Å; Y134-E455 WeakPolarHBondContact CE2-OE1 3.49Å
135	L	96.6	Very high	91.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	115.3	176.2	177.8	56.4	0	0	0	110.8	L111 I113 F126 L132 F150 L153 L156 V158 L159 I160	L111-L135 HydrophobicContact CB-CD1 4.03Å; L111-L135 HydrophobicContact CD2-CD1 3.86Å; L111-L135 HydrophobicContact CG-CD1 3.94Å; I113-L135 HydrophobicContact CD1-CD1 4.02Å; I113-L135 HydrophobicContact CG1-CD1 4.19Å; F126-L135 HydrophobicContact CD1-CD2 4.46Å; F126-L135 HydrophobicContact CE1-CD1 4.04Å; F126-L135 HydrophobicContact CE1-CD2 3.85Å; F126-L135 HydrophobicContact CE2-CD2 4.17Å; F126-L135 HydrophobicContact CZ-CD2 3.69Å; L132-L135 HydrophobicContact CD2-CB 4.17Å; L135-F150 HydrophobicContact CD2-CD1 4.37Å; L135-F150 HydrophobicContact CD2-CE1 4.02Å; L135-L153 HydrophobicContact CD2-CD1 4.5Å; L135-L156 HydrophobicContact CB-CD1 3.67Å; L135-L156 HydrophobicContact CB-CD2 4.46Å; L135-V158 PolarHBondContact N-O 2.85Å; L135-L159 HydrophobicContact CB-CD1 4.18Å; L135-L159 HydrophobicContact CD2-CD1 3.91Å; L135-L159 HydrophobicContact CG-CD1 4.11Å; L135-I160 PolarHBondContact O-N 3.47Å
136	Q	88.3	Confident	91.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.9	175	-173.1	-164.2	-16.6	0	0	110.9	L111 H112 I113 N114 Y134 D138 I160	L111-Q136 PolarHBondContact O-N 2.89Å; H112-Q136 PolarHBondContact ND1-OE1 2.87Å; I113-Q136 VanDerWaalsContact CG1-O 3.3Å; I113-Q136 WeakPolarHBondContact CG1-O 3.49Å; I113-Q136 PolarHBondContact N-O 2.97Å; N114-Q136 HydrophobicContact CB-CG 4.04Å; N114-Q136 VanDerWaalsContact CG-CD 3.49Å; N114-Q136 PolarHBondContact N-O 3.4Å; N114-Q136 PolarHBondContact ND2-NE2 2.75Å; N114-Q136 PolarHBondContact OD1-NE2 3.07Å; Y134-Q136 HydrophobicContact CD1-CB 4.38Å; Y134-Q136 HydrophobicContact CE1-CB 3.62Å; Q136-D138 WeakPolarHBondContact CG-OD1 3.38Å; Q136-D138 PolarHBondContact NE2-OD1 3.36Å; Q136-I160 HydrophobicContact CB-CB 4.45Å; Q136-I160 HydrophobicContact CG-CB 4.22Å; Q136-I160 HydrophobicContact CG-CD1 4.43Å; Q136-I160 HydrophobicContact CG-CG2 4.13Å
137	A	93.7	Very high	91.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.			trans	-139	23.4	-177.1	0	0	0	0	0	114.2	I113 F121 N140 I160 L161 N164	I113-A137 HydrophobicContact CD1-CB 4.03Å; I113-A137 HydrophobicContact CG1-CB 3.77Å; F121-A137 HydrophobicContact CE2-CB 4.33Å; F121-A137 HydrophobicContact CZ-CB 3.76Å; A137-N140 PolarHBondContact O-ND2 2.99Å; A137-I160 PolarHBondContact N-O 3.24Å; A137-L161 HydrophobicContact CB-CD2 4.16Å; A137-N164 PolarHBondContact O-ND2 3.33Å
138	D	81.3	Confident	90.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.158	C	C	.	.			trans	-64.8	161.2	177.2	61.3	-45.5	0	0	0	113.8	N114 N115 Q136 N140 I160 N162	N114-D138 CarbonylContact C-O 3.51Å; N114-D138 WeakPolarHBondContact CA-O 3.4Å; N114-D138 VanDerWaalsContact CB-O 3.28Å; N114-D138 WeakPolarHBondContact CB-O 3.42Å; N114-D138 WeakPolarHBondContact CB-OD1 3.25Å; N115-D138 PolarHBondContact N-O 3.26Å; Q136-D138 WeakPolarHBondContact CG-OD1 3.38Å; Q136-D138 PolarHBondContact NE2-OD1 3.36Å; D138-N140 PolarHBondContact O-N 3.24Å; D138-I160 HydrophobicContact CB-CG2 4.26Å; D138-N162 WeakPolarHBondContact CA-O 3.47Å; D138-N162 WeakPolarHBondContact CB-ND2 3.16Å; D138-N162 WeakPolarHBondContact CB-O 3.46Å; D138-N162 WeakPolarHBondContact CB-OD1 3.47Å
139	F	76.3	Confident	91.1	Very high	30 Å²	30	30.1 Å²	30.1	13%	0.132	16%	0.155	C	C	.	.	S	Bend	trans	54.6	37	-176.3	-58.7	-94.2	0	0	0	113.9	N115 N116 N162 D163 N358 N360	N115-F139 WeakPolarHBondContact CA-O 3.36Å; N115-F139 HydrophobicContact CB-CB 4.2Å; N116-F139 PolarHBondContact N-O 2.81Å; F139-N162 PolarHBondContact N-O 3.36Å; F139-D163 HydrophobicContact CD1-CB 4.03Å; F139-D163 HydrophobicContact CD2-CB 4.31Å; F139-D163 HydrophobicContact CE1-CB 3.69Å; F139-D163 HydrophobicContact CE2-CB 3.91Å; F139-D163 HydrophobicContact CG-CB 4.31Å; F139-D163 HydrophobicContact CZ-CB 3.6Å; F139-D163 VanDerWaalsContact CZ-CG 3.48Å; F139-D163 WeakPolarHBondContact CZ-OD2 3.22Å; F139-N358 VanDerWaalsContact CE1-ND2 3.27Å; F139-N358 WeakPolarHBondContact CE1-ND2 3.39Å; F139-N358 WeakPolarHBondContact CE1-OD1 3.27Å; F139-N358 VanDerWaalsContact CZ-ND2 3.26Å; F139-N358 WeakPolarHBondContact CZ-ND2 3.5Å; F139-N358 WeakPolarHBondContact CZ-OD1 3.41Å; F139-N360 HydrophobicContact CD1-CB 4.49Å; F139-N360 HydrophobicContact CD2-CB 4.23Å; F139-N360 HydrophobicContact CE1-CB 3.92Å; F139-N360 HydrophobicContact CE2-CB 3.71Å; F139-N360 WeakPolarHBondContact CE2-ND2 3.03Å; F139-N360 HydrophobicContact CZ-CB 3.52Å; F139-N360 WeakPolarHBondContact CZ-ND2 3.34Å
140	N	86	Confident	91.1	Very high	8 Å²	8	30.1 Å²	30.1	4%	0.043	16%	0.155	C	C	.	.	S	Bend	trans	-97.9	-164	167.8	-89	-75.5	0	0	0	110.2	I113 N116 K117 I118 A137 D138 N164	I113-N140 PolarHBondContact O-ND2 3.17Å; N116-N140 WeakPolarHBondContact CA-OD1 3.34Å; N116-N140 WeakPolarHBondContact CB-OD1 3.47Å; K117-N140 PolarHBondContact N-OD1 3.47Å; K117-N140 VanDerWaalsContact N-OD1 3.14Å; I118-N140 HydrophobicContact CB-CB 4.37Å; I118-N140 WeakPolarHBondContact CB-OD1 3.37Å; I118-N140 WeakPolarHBondContact CG1-OD1 3.37Å; I118-N140 PolarHBondContact N-OD1 3.3Å; A137-N140 PolarHBondContact O-ND2 2.99Å; D138-N140 PolarHBondContact O-N 3.24Å; N140-N164 VanDerWaalsContact CA-OD1 3.25Å; N140-N164 WeakPolarHBondContact CA-OD1 3.33Å; N140-N164 WeakPolarHBondContact CB-OD1 3.47Å; N140-N164 PolarHBondContact N-OD1 3.49Å; N140-N164 PolarHBondContact O-OD1 3.23Å
141	L	89.8	Confident	91.1	Very high	72 Å²	72	30 Å²	30	38%	0.377	15%	0.152	S	C	.	.			trans	-116.6	26.8	175.1	-60.8	174.8	0	0	0	110.3	K117 I118 K119 R143 L165	K117-L141 HydrophobicContact CB-CD1 4.21Å; I118-L141 CarbonylContact O-C 3.55Å; I118-L141 VanDerWaalsContact O-CA 3.28Å; I118-L141 WeakPolarHBondContact O-CA 3.37Å; I118-L141 PolarHBondContact O-N 3.33Å; K119-L141 HydrophobicContact CG-CB 4.28Å; L141-R143 PolarHBondContact O-N 2.86Å; L141-L165 HydrophobicContact CD2-CD1 4.36Å
142	L	95.8	Very high	90.9	Very high	1 Å²	1	30 Å²	30	1%	0.005	15%	0.152	C	C	.	.			trans	-66.5	120.6	-168	-176.9	60.6	0	0	0	110.4	I118 K119 F121 I145 L161 N164 L165 I166	I118-L142 PolarHBondContact O-N 2.9Å; I118-L142 VanDerWaalsContact O-N 3.11Å; K119-L142 WeakPolarHBondContact O-CA 3.27Å; F121-L142 HydrophobicContact CB-CD1 4.49Å; F121-L142 HydrophobicContact CD1-CD1 4.37Å; F121-L142 HydrophobicContact CD2-CD1 4.03Å; F121-L142 HydrophobicContact CD2-CD2 3.66Å; F121-L142 HydrophobicContact CE2-CD1 4.38Å; F121-L142 HydrophobicContact CE2-CD2 3.41Å; F121-L142 VanDerWaalsContact CE2-CD2 3.41Å; F121-L142 HydrophobicContact CG-CD1 4.02Å; F121-L142 HydrophobicContact CG-CD2 4.44Å; F121-L142 HydrophobicContact CZ-CD2 4.01Å; L142-I145 HydrophobicContact CD1-CG1 4.21Å; L142-I145 HydrophobicContact CD2-CD1 4.18Å; L142-I145 HydrophobicContact CD2-CG1 4.33Å; L142-I145 HydrophobicContact CG-CG1 4.34Å; L142-L161 HydrophobicContact CD2-CD2 4.05Å; L142-N164 HydrophobicContact CB-CB 4.16Å; L142-N164 WeakPolarHBondContact CB-OD1 3.39Å; L142-N164 PolarHBondContact N-OD1 2.99Å; L142-L165 CarbonylContact O-C 3.57Å; L142-L165 WeakPolarHBondContact O-CA 3.1Å; L142-L165 WeakPolarHBondContact O-CB 3.25Å; L142-L165 PolarHBondContact O-N 2.84Å; L142-I166 HydrophobicContact CD2-CD1 4.08Å; L142-I166 HydrophobicContact CD2-CG1 4.36Å; L142-I166 HydrophobicContact CG-CD1 4.4Å; L142-I166 HydrophobicContact CG-CG1 4.14Å; L142-I166 PolarHBondContact O-N 3.47Å; L142-I166 VanDerWaalsContact O-N 3.08Å
143	R	92.7	Very high	90.8	Very high	138 Å²	138	30 Å²	30	52%	0.521	15%	0.153	S	C	.	.			trans	-117.9	-49.6	178.4	-67.3	168	-171.2	-165.9	-3.5	110.9	K119 L141 L165	K119-R143 PolarHBondContact O-N 3.35Å; L141-R143 PolarHBondContact O-N 2.86Å; R143-L165 HydrophobicContact CG-CB 3.58Å; R143-L165 HydrophobicContact CG-CD1 4.24Å
144	D	92.5	Very high	90.9	Very high	97 Å²	97	34.3 Å²	34.3	52%	0.519	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124.2	-167.3	-39.8	-69.7	0	0	0	109.2	S120 F121	S120-D144 CarbonylContact C-O 3.25Å; S120-D144 WeakPolarHBondContact CA-O 3.26Å; S120-D144 VanDerWaalsContact CB-O 3.28Å; S120-D144 WeakPolarHBondContact CB-O 3.27Å; F121-D144 PolarHBondContact N-O 3.04Å
145	I	96.5	Very high	91.1	Very high	15 Å²	15	38.3 Å²	38.3	8%	0.077	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.9	171.7	-60	176.7	0	0	0	106.2	L142 A149 F150 I166 L169 P170 V173	L142-I145 HydrophobicContact CD1-CG1 4.21Å; L142-I145 HydrophobicContact CD2-CD1 4.18Å; L142-I145 HydrophobicContact CD2-CG1 4.33Å; L142-I145 HydrophobicContact CG-CG1 4.34Å; I145-A149 HydrophobicContact CG2-CB 3.72Å; I145-F150 HydrophobicContact CD1-CE2 4.45Å; I145-F150 HydrophobicContact CD1-CZ 4.38Å; I145-F150 HydrophobicContact CG2-CE2 4.13Å; I145-F150 HydrophobicContact CG2-CZ 4.45Å; I145-I166 HydrophobicContact CD1-CD1 4.01Å; I145-I166 HydrophobicContact CD1-CG1 4.47Å; I145-L169 HydrophobicContact CD1-CD2 4.16Å; I145-P170 HydrophobicContact CB-CG 4.29Å; I145-P170 HydrophobicContact CG2-CG 4.19Å; I145-P170 WeakPolarHBondContact O-CG 3.49Å; I145-V173 HydrophobicContact CG2-CG2 4.06Å
146	D	94.8	Very high	90.9	Very high	60 Å²	60	38.3 Å²	38.3	32%	0.321	19%	0.193	S	C	.	.			trans	-71.8	147	175.4	-78.7	1.1	0	0	0	110.6	F121 R122 K123 G148 A149	F121-D146 PolarHBondContact O-N 3.02Å; R122-D146 WeakPolarHBondContact CA-OD2 3.3Å; K123-D146 HydrophobicContact CB-CB 4.34Å; K123-D146 PolarHBondContact N-OD2 3.06Å; D146-G148 PolarHBondContact O-N 3.39Å; D146-A149 HydrophobicContact CB-CB 4.46Å; D146-A149 VanDerWaalsContact O-CB 3.28Å; D146-A149 WeakPolarHBondContact O-CB 3.5Å; D146-A149 PolarHBondContact O-N 2.85Å
147	P	92	Very high	90.8	Very high	82 Å²	82	39.6 Å²	39.6	53%	0.532	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	124.5	168.5	-23.6	32.6	0	0	0	111.6	P170	P147-P170 HydrophobicContact CG-CB 4.07Å
148	G	89.8	Confident	90.3	Very high	9 Å²	9	40.3 Å²	40.3	9%	0.093	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	25.5	-174.8	0	0	0	0	0	115	D146 F150 Q151	D146-G148 PolarHBondContact O-N 3.39Å; G148-F150 PolarHBondContact O-N 3.05Å; G148-Q151 WeakPolarHBondContact O-CB 3.44Å; G148-Q151 PolarHBondContact O-N 2.98Å; G148-Q151 VanDerWaalsContact O-N 3.16Å
149	A	94.4	Very high	91	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.4	172.4	0	0	0	0	0	113.4	F121 I145 D146	F121-A149 HydrophobicContact CB-CB 4.19Å; I145-A149 HydrophobicContact CG2-CB 3.72Å; D146-A149 HydrophobicContact CB-CB 4.46Å; D146-A149 VanDerWaalsContact O-CB 3.28Å; D146-A149 WeakPolarHBondContact O-CB 3.5Å; D146-A149 PolarHBondContact O-N 2.85Å
150	F	95.1	Very high	91.4	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	5.4	177.3	-50.2	-62.2	0	0	0	113.7	F121 F126 L135 I145 G148 D152 L153 L159 L161 V173 F174 V177	F121-F150 AromaticContact CD2-CE1 3.89Å; F121-F150 HydrophobicContact CD2-CE1 3.89Å; F121-F150 AromaticContact CD2-CZ 3.9Å; F121-F150 HydrophobicContact CD2-CZ 3.9Å; F121-F150 HydrophobicContact CE2-CE1 4.2Å; F121-F150 HydrophobicContact CE2-CZ 4.31Å; F126-F150 HydrophobicContact CD2-CD1 4.07Å; F126-F150 HydrophobicContact CD2-CE1 4.41Å; F126-F150 AromaticContact CE2-CD1 3.79Å; F126-F150 HydrophobicContact CE2-CD1 3.79Å; F126-F150 AromaticContact CE2-CE1 3.67Å; F126-F150 HydrophobicContact CE2-CE1 3.67Å; F126-F150 HydrophobicContact CZ-CE1 4.31Å; L135-F150 HydrophobicContact CD2-CD1 4.37Å; L135-F150 HydrophobicContact CD2-CE1 4.02Å; I145-F150 HydrophobicContact CD1-CE2 4.45Å; I145-F150 HydrophobicContact CD1-CZ 4.38Å; I145-F150 HydrophobicContact CG2-CE2 4.13Å; I145-F150 HydrophobicContact CG2-CZ 4.45Å; G148-F150 PolarHBondContact O-N 3.05Å; F150-D152 PolarHBondContact O-N 3.4Å; F150-L153 HydrophobicContact CB-CD1 4.23Å; F150-L153 HydrophobicContact CD1-CD1 4.03Å; F150-L153 WeakPolarHBondContact O-CB 3.42Å; F150-L153 PolarHBondContact O-N 3.37Å; F150-L159 HydrophobicContact CD2-CD2 4.39Å; F150-L159 HydrophobicContact CE1-CD1 4.33Å; F150-L159 HydrophobicContact CE2-CD2 4.01Å; F150-L159 HydrophobicContact CZ-CD1 4.36Å; F150-L159 HydrophobicContact CZ-CD2 4.09Å; F150-L161 HydrophobicContact CZ-CD1 4.49Å; F150-V173 HydrophobicContact CD2-CG2 3.81Å; F150-V173 HydrophobicContact CE2-CG2 3.84Å; F150-F174 HydrophobicContact CD2-CD1 4.49Å; F150-F174 HydrophobicContact CD2-CE1 4.47Å; F150-F174 HydrophobicContact CE2-CE1 4.45Å; F150-V177 HydrophobicContact CB-CG2 4.03Å; F150-V177 WeakPolarHBondContact O-CG2 3.32Å
151	Q	91.1	Very high	91.7	Very high	58 Å²	58	39.4 Å²	39.4	27%	0.271	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-27.7	-169.8	178.9	167.2	30.5	0	0	114.5	G148 L153 Y176	G148-Q151 WeakPolarHBondContact O-CB 3.44Å; G148-Q151 PolarHBondContact O-N 2.98Å; G148-Q151 VanDerWaalsContact O-N 3.16Å; Q151-L153 VanDerWaalsContact C-N 3.34Å; Q151-Y176 HydrophobicContact CG-CD2 4.35Å
152	D	88.9	Confident	91.3	Very high	47 Å²	47	36 Å²	36	25%	0.251	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-10.5	-179.3	-53.6	-50.1	0	0	0	112.7	F150 N154	F150-D152 PolarHBondContact O-N 3.4Å; D152-N154 PolarHBondContact O-N 2.94Å; D152-N154 VanDerWaalsContact O-N 3.13Å; D152-N154 PolarHBondContact O-ND2 3.1Å
153	L	94.4	Very high	90.4	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	19%	0.191	C	C	.	.			trans	-92.1	58.8	-168.9	-58.1	179.6	0	0	0	113.1	F126 L129 L132 L135 F150 Q151 K155 L156	F126-L153 HydrophobicContact CB-CD1 4Å; F126-L153 HydrophobicContact CB-CD2 3.89Å; F126-L153 HydrophobicContact CB-CG 4.19Å; F126-L153 HydrophobicContact CD2-CD1 4.07Å; F126-L153 HydrophobicContact CG-CD1 4.05Å; L129-L153 HydrophobicContact CB-CD2 4.07Å; L132-L153 HydrophobicContact CB-CD2 4.15Å; L132-L153 HydrophobicContact CD2-CD1 4.1Å; L132-L153 HydrophobicContact CD2-CD2 3.92Å; L135-L153 HydrophobicContact CD2-CD1 4.5Å; F150-L153 HydrophobicContact CB-CD1 4.23Å; F150-L153 HydrophobicContact CD1-CD1 4.03Å; F150-L153 WeakPolarHBondContact O-CB 3.42Å; F150-L153 PolarHBondContact O-N 3.37Å; Q151-L153 VanDerWaalsContact C-N 3.34Å; L153-K155 PolarHBondContact O-N 3.14Å; L153-L156 HydrophobicContact CB-CB 3.97Å; L153-L156 HydrophobicContact CB-CD2 4.43Å; L153-L156 HydrophobicContact CD1-CD2 4Å; L153-L156 WeakPolarHBondContact O-CB 3.5Å; L153-L156 PolarHBondContact O-N 2.88Å; L153-L156 VanDerWaalsContact O-N 3.08Å
154	N	91.1	Very high	90.1	Very high	99 Å²	99	31.2 Å²	31.2	53%	0.529	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-2.7	-171.7	-61.7	-87.9	0	0	0	116	D152	D152-N154 PolarHBondContact O-N 2.94Å; D152-N154 VanDerWaalsContact O-N 3.13Å; D152-N154 PolarHBondContact O-ND2 3.1Å
155	K	91.3	Very high	89.8	Confident	86 Å²	86	29 Å²	29	37%	0.374	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	4.5	177.7	-61.8	-172.3	-170.9	161.5	0	114.2	D131 L132 L153 E157	D131-K155 IonicContact OD1-NZ 3.04Å; D131-K155 PolarHBondContact OD1-NZ 3.06Å; D131-K155 IonicContact OD2-NZ 2.65Å; D131-K155 PolarHBondContact OD2-NZ 3.3Å; D131-K155 VanDerWaalsContact OD2-NZ 3.12Å; L132-K155 CarbonylContact O-C 3.5Å; L153-K155 PolarHBondContact O-N 3.14Å; K155-E157 PolarHBondContact O-N 2.8Å; K155-E157 VanDerWaalsContact O-N 3.09Å
156	L	93.8	Very high	89.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.			trans	-72.4	107.4	-173.2	-179.9	71.7	0	0	0	111.2	L132 L135 L153 V158 L159 V177 P178 I179	L132-L156 HydrophobicContact CD2-CD1 4.32Å; L132-L156 HydrophobicContact CG-CD1 4.43Å; L132-L156 VanDerWaalsContact O-CA 3.27Å; L132-L156 WeakPolarHBondContact O-CA 3.37Å; L132-L156 PolarHBondContact O-N 3.11Å; L132-L156 VanDerWaalsContact O-N 3.13Å; L135-L156 HydrophobicContact CB-CD1 3.67Å; L135-L156 HydrophobicContact CB-CD2 4.46Å; L153-L156 HydrophobicContact CB-CB 3.97Å; L153-L156 HydrophobicContact CB-CD2 4.43Å; L153-L156 HydrophobicContact CD1-CD2 4Å; L153-L156 WeakPolarHBondContact O-CB 3.5Å; L153-L156 PolarHBondContact O-N 2.88Å; L153-L156 VanDerWaalsContact O-N 3.08Å; L156-V158 WeakPolarHBondContact CD1-O 3.45Å; L156-L159 HydrophobicContact CD2-CB 4.33Å; L156-L159 HydrophobicContact CD2-CD1 4.34Å; L156-L159 HydrophobicContact CD2-CD2 4.44Å; L156-V177 HydrophobicContact CB-CG1 3.8Å; L156-V177 HydrophobicContact CD2-CG1 4.07Å; L156-V177 HydrophobicContact CG-CG1 4.33Å; L156-P178 CarbonylContact O-C 3.28Å; L156-I179 PolarHBondContact O-N 2.86Å
157	E	85.3	Confident	89.8	Confident	27 Å²	27	28.3 Å²	28.3	13%	0.126	16%	0.156	C	C	.	.			trans	-94.2	-33.1	178.3	-70	-172.6	-140.4	0	0	112.9	E133 K155 T180 H181 H527	E133-E157 PolarHBondContact O-N 2.65Å; K155-E157 PolarHBondContact O-N 2.8Å; K155-E157 VanDerWaalsContact O-N 3.09Å; E157-T180 HydrophobicContact CG-CG2 4.44Å; E157-T180 PolarHBondContact O-N 3.29Å; E157-H181 PolarHBondContact O-N 3.08Å; E157-H527 IonicContact OE1-CE1 3.24Å
158	V	83.1	Confident	89.8	Confident	14 Å²	14	28.5 Å²	28.5	9%	0.085	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115.2	-173.3	-178.6	0	0	0	0	110.3	E133 Y134 L135 L156 I160 H181	E133-V158 PolarHBondContact O-N 3.39Å; E133-V158 VanDerWaalsContact O-N 3.15Å; Y134-V158 HydrophobicContact CD2-CB 3.55Å; Y134-V158 HydrophobicContact CD2-CG1 3.39Å; Y134-V158 HydrophobicContact CD2-CG2 4.05Å; Y134-V158 HydrophobicContact CE2-CB 4.3Å; Y134-V158 HydrophobicContact CE2-CG1 3.62Å; Y134-V158 HydrophobicContact CG-CB 4.18Å; Y134-V158 HydrophobicContact CG-CG1 4.25Å; L135-V158 PolarHBondContact N-O 2.85Å; L156-V158 WeakPolarHBondContact CD1-O 3.45Å; V158-I160 HydrophobicContact CG1-CD1 4.01Å; V158-I160 HydrophobicContact CG1-CG1 3.93Å; V158-H181 HydrophobicContact CG2-CB 4.3Å; V158-H181 WeakPolarHBondContact CG2-ND1 3.29Å
159	L	95.6	Very high	90.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	106.5	179.4	179.9	53.3	0	0	0	110.8	L135 F150 L156 L161 F174 I179 H181 L182 D183	L135-L159 HydrophobicContact CB-CD1 4.18Å; L135-L159 HydrophobicContact CD2-CD1 3.91Å; L135-L159 HydrophobicContact CG-CD1 4.11Å; F150-L159 HydrophobicContact CD2-CD2 4.39Å; F150-L159 HydrophobicContact CE1-CD1 4.33Å; F150-L159 HydrophobicContact CE2-CD2 4.01Å; F150-L159 HydrophobicContact CZ-CD1 4.36Å; F150-L159 HydrophobicContact CZ-CD2 4.09Å; L156-L159 HydrophobicContact CD2-CB 4.33Å; L156-L159 HydrophobicContact CD2-CD1 4.34Å; L156-L159 HydrophobicContact CD2-CD2 4.44Å; L159-L161 HydrophobicContact CD1-CD1 4.09Å; L159-L161 HydrophobicContact CD1-CD2 3.86Å; L159-L161 HydrophobicContact CD1-CG 3.82Å; L159-L161 HydrophobicContact CD2-CD1 4.01Å; L159-L161 HydrophobicContact CG-CD1 3.89Å; L159-L161 HydrophobicContact CG-CD2 4.49Å; L159-L161 HydrophobicContact CG-CG 3.91Å; L159-F174 HydrophobicContact CD2-CE1 3.89Å; L159-I179 HydrophobicContact CB-CD1 4.36Å; L159-I179 HydrophobicContact CD2-CD1 3.77Å; L159-H181 PolarHBondContact N-O 3.31Å; L159-L182 HydrophobicContact CB-CD1 4.16Å; L159-L182 HydrophobicContact CD2-CD1 4.09Å; L159-L182 HydrophobicContact CG-CD1 4.08Å; L159-D183 PolarHBondContact O-N 3.28Å
160	I	84.6	Confident	90.1	Very high	20 Å²	20	30 Å²	30	10%	0.103	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	109.7	-176.6	-59.8	172.3	0	0	0	109.6	Y134 L135 Q136 A137 D138 V158 N162 D183	Y134-I160 HydrophobicContact CE2-CD1 3.91Å; L135-I160 PolarHBondContact O-N 3.47Å; Q136-I160 HydrophobicContact CB-CB 4.45Å; Q136-I160 HydrophobicContact CG-CB 4.22Å; Q136-I160 HydrophobicContact CG-CD1 4.43Å; Q136-I160 HydrophobicContact CG-CG2 4.13Å; A137-I160 PolarHBondContact N-O 3.24Å; D138-I160 HydrophobicContact CB-CG2 4.26Å; V158-I160 HydrophobicContact CG1-CD1 4.01Å; V158-I160 HydrophobicContact CG1-CG1 3.93Å; I160-N162 WeakPolarHBondContact CG2-OD1 3.5Å; I160-D183 HydrophobicContact CG2-CB 4.41Å
161	L	93.8	Very high	90	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.177	C	C	.	.			trans	-125.2	14.6	-174.2	-62.4	177.1	0	0	0	113.3	F121 A137 L142 F150 L159 N164 I166 D183 L184 N187	F121-L161 HydrophobicContact CE2-CD2 4.01Å; A137-L161 HydrophobicContact CB-CD2 4.16Å; L142-L161 HydrophobicContact CD2-CD2 4.05Å; F150-L161 HydrophobicContact CZ-CD1 4.49Å; L159-L161 HydrophobicContact CD1-CD1 4.09Å; L159-L161 HydrophobicContact CD1-CD2 3.86Å; L159-L161 HydrophobicContact CD1-CG 3.82Å; L159-L161 HydrophobicContact CD2-CD1 4.01Å; L159-L161 HydrophobicContact CG-CD1 3.89Å; L159-L161 HydrophobicContact CG-CD2 4.49Å; L159-L161 HydrophobicContact CG-CG 3.91Å; L161-N164 WeakPolarHBondContact O-CB 3.36Å; L161-N164 PolarHBondContact O-ND2 3.29Å; L161-N164 VanDerWaalsContact O-ND2 3.08Å; L161-I166 HydrophobicContact CB-CD1 4.16Å; L161-I166 HydrophobicContact CD1-CD1 4.14Å; L161-D183 CarbonylContact C-O 3.54Å; L161-D183 WeakPolarHBondContact CA-O 3.49Å; L161-D183 WeakPolarHBondContact CB-O 3.4Å; L161-D183 PolarHBondContact N-O 3.23Å; L161-L184 HydrophobicContact CB-CD2 4.31Å; L161-L184 HydrophobicContact CD1-CD2 4.12Å; L161-N187 PolarHBondContact O-ND2 3Å
162	N	79.9	Confident	90	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	18%	0.176	C	C	.	.			trans	-64.1	163.5	-175.2	62.2	-76.5	0	0	0	114.6	D138 F139 I160 N164 D183 R185	D138-N162 WeakPolarHBondContact CA-O 3.47Å; D138-N162 WeakPolarHBondContact CB-ND2 3.16Å; D138-N162 WeakPolarHBondContact CB-O 3.46Å; D138-N162 WeakPolarHBondContact CB-OD1 3.47Å; F139-N162 PolarHBondContact N-O 3.36Å; I160-N162 WeakPolarHBondContact CG2-OD1 3.5Å; N162-N164 PolarHBondContact O-N 2.75Å; N162-N164 PolarHBondContact O-ND2 2.99Å; N162-N164 VanDerWaalsContact O-ND2 3.12Å; N162-D183 PolarHBondContact N-O 3.01Å; N162-D183 PolarHBondContact OD1-OD2 2.91Å; N162-R185 CarbonylContact C-O 3.57Å; N162-R185 WeakPolarHBondContact CA-O 3.28Å; N162-R185 HydrophobicContact CB-CB 4.04Å; N162-R185 VanDerWaalsContact CB-O 3.29Å; N162-R185 WeakPolarHBondContact CB-O 3.21Å
163	D	77.6	Confident	90.2	Very high	34 Å²	34	29 Å²	29	18%	0.182	16%	0.164	C	C	.	.	S	Bend	trans	50.5	41.9	177.4	-62.4	-87.1	0	0	0	112.9	F139 R185 K356 N358	F139-D163 HydrophobicContact CD1-CB 4.03Å; F139-D163 HydrophobicContact CD2-CB 4.31Å; F139-D163 HydrophobicContact CE1-CB 3.69Å; F139-D163 HydrophobicContact CE2-CB 3.91Å; F139-D163 HydrophobicContact CG-CB 4.31Å; F139-D163 HydrophobicContact CZ-CB 3.6Å; F139-D163 VanDerWaalsContact CZ-CG 3.48Å; F139-D163 WeakPolarHBondContact CZ-OD2 3.22Å; D163-R185 PolarHBondContact N-O 3.42Å; D163-K356 IonicContact OD1-NZ 2.65Å; D163-N358 PolarHBondContact OD1-ND2 2.86Å
164	N	85.9	Confident	90.2	Very high	3 Å²	3	29 Å²	29	2%	0.016	17%	0.165	C	C	.	.	S	Bend	trans	-111.2	-159.4	176	-89.9	-71.5	0	0	0	110.9	A137 N140 L142 L161 N162 I166 N187	A137-N164 PolarHBondContact O-ND2 3.33Å; N140-N164 VanDerWaalsContact CA-OD1 3.25Å; N140-N164 WeakPolarHBondContact CA-OD1 3.33Å; N140-N164 WeakPolarHBondContact CB-OD1 3.47Å; N140-N164 PolarHBondContact N-OD1 3.49Å; N140-N164 PolarHBondContact O-OD1 3.23Å; L142-N164 HydrophobicContact CB-CB 4.16Å; L142-N164 WeakPolarHBondContact CB-OD1 3.39Å; L142-N164 PolarHBondContact N-OD1 2.99Å; L161-N164 WeakPolarHBondContact O-CB 3.36Å; L161-N164 PolarHBondContact O-ND2 3.29Å; L161-N164 VanDerWaalsContact O-ND2 3.08Å; N162-N164 PolarHBondContact O-N 2.75Å; N162-N164 PolarHBondContact O-ND2 2.99Å; N162-N164 VanDerWaalsContact O-ND2 3.12Å; N164-I166 HydrophobicContact CB-CG1 4.45Å; N164-N187 WeakPolarHBondContact CA-OD1 3.38Å; N164-N187 WeakPolarHBondContact CB-OD1 3.36Å
165	L	87.4	Confident	90.2	Very high	51 Å²	51	27.5 Å²	27.5	27%	0.267	15%	0.154	S	C	.	.			trans	-127.1	21.9	-175.3	-60.9	175.2	0	0	0	112.8	L141 L142 R143 S167 N187	L141-L165 HydrophobicContact CD2-CD1 4.36Å; L142-L165 CarbonylContact O-C 3.57Å; L142-L165 WeakPolarHBondContact O-CA 3.1Å; L142-L165 WeakPolarHBondContact O-CB 3.25Å; L142-L165 PolarHBondContact O-N 2.84Å; R143-L165 HydrophobicContact CG-CB 3.58Å; R143-L165 HydrophobicContact CG-CD1 4.24Å; L165-S167 PolarHBondContact O-N 3.03Å; L165-N187 PolarHBondContact N-OD1 2.97Å
166	I	97	Very high	90.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.			trans	-67.3	117.7	-176.5	-55.8	167.5	0	0	0	109.2	L142 I145 L161 N164 L169 N187 R188 L189	L142-I166 HydrophobicContact CD2-CD1 4.08Å; L142-I166 HydrophobicContact CD2-CG1 4.36Å; L142-I166 HydrophobicContact CG-CD1 4.4Å; L142-I166 HydrophobicContact CG-CG1 4.14Å; L142-I166 PolarHBondContact O-N 3.47Å; L142-I166 VanDerWaalsContact O-N 3.08Å; I145-I166 HydrophobicContact CD1-CD1 4.01Å; I145-I166 HydrophobicContact CD1-CG1 4.47Å; L161-I166 HydrophobicContact CB-CD1 4.16Å; L161-I166 HydrophobicContact CD1-CD1 4.14Å; N164-I166 HydrophobicContact CB-CG1 4.45Å; I166-L169 HydrophobicContact CG2-CD2 4.01Å; I166-N187 HydrophobicContact CB-CB 4.32Å; I166-N187 WeakPolarHBondContact CB-OD1 3.2Å; I166-N187 WeakPolarHBondContact CG1-OD1 3.28Å; I166-N187 PolarHBondContact N-OD1 2.78Å; I166-R188 CarbonylContact O-C 3.08Å; I166-R188 VanDerWaalsContact O-C 3.23Å; I166-R188 VanDerWaalsContact O-CA 3.27Å; I166-R188 WeakPolarHBondContact O-CA 3.14Å; I166-R188 PolarHBondContact O-N 3.25Å; I166-L189 HydrophobicContact CG2-CD2 4.05Å; I166-L189 PolarHBondContact O-N 2.86Å
167	S	92.8	Very high	90	Very high	60 Å²	60	30.9 Å²	30.9	42%	0.42	17%	0.167	S	C	.	.			trans	-89.1	-27.3	177.7	54	0	0	0	0	114	L165 R188	L165-S167 PolarHBondContact O-N 3.03Å; S167-R188 WeakPolarHBondContact CA-O 3.44Å
168	T	93.1	Very high	90.1	Very high	86 Å²	86	32.1 Å²	32.1	53%	0.528	18%	0.177	S	C	.	.			trans	-158.9	138.9	-171.5	42.5	0	0	0	0	108.3
169	L	95.2	Very high	90.5	Very high	17 Å²	17	31.6 Å²	31.6	9%	0.089	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-84.7	143.5	164.8	-65.4	-179.9	0	0	0	109.8	I145 I166 V173 F174 L184 L192 V197	I145-L169 HydrophobicContact CD1-CD2 4.16Å; I166-L169 HydrophobicContact CG2-CD2 4.01Å; L169-V173 HydrophobicContact CB-CG1 4.22Å; L169-V173 HydrophobicContact CD1-CG1 4.48Å; L169-F174 HydrophobicContact CD1-CE2 3.91Å; L169-F174 HydrophobicContact CD1-CZ 3.73Å; L169-L184 HydrophobicContact CD1-CD1 4.21Å; L169-L192 HydrophobicContact CD1-CD1 3.94Å; L169-V197 HydrophobicContact CB-CG1 4.47Å; L169-V197 HydrophobicContact CD1-CG1 4.12Å
170	P	94.6	Very high	89.8	Confident	23 Å²	23	31.9 Å²	31.9	15%	0.149	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-75.5	158.9	177	32.2	-34.4	0	0	0	111.3	I145 P147 V173	I145-P170 HydrophobicContact CB-CG 4.29Å; I145-P170 HydrophobicContact CG2-CG 4.19Å; I145-P170 WeakPolarHBondContact O-CG 3.49Å; P147-P170 HydrophobicContact CG-CB 4.07Å; P170-V173 HydrophobicContact CG-CB 3.86Å; P170-V173 HydrophobicContact CG-CG2 3.89Å; P170-V173 WeakPolarHBondContact O-CB 3.35Å; P170-V173 PolarHBondContact O-N 3.44Å
171	A	92.5	Very high	89.5	Confident	38 Å²	38	31.4 Å²	31.4	31%	0.314	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	138.8	170.2	0	0	0	0	0	111.7	V173 E196	A171-V173 VanDerWaalsContact C-N 3.25Å; A171-V173 PolarHBondContact O-N 3.32Å; A171-E196 HydrophobicContact CB-CB 3.97Å; A171-E196 HydrophobicContact CB-CG 4.38Å; A171-E196 WeakPolarHBondContact CB-OE2 3.33Å
172	N	91.7	Very high	89.5	Confident	46 Å²	46	31.6 Å²	31.6	25%	0.246	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	30.3	175.7	-61.8	-91.1	0	0	0	114.4	F174 Q175 E196 Q200	N172-F174 VanDerWaalsContact C-N 3.33Å; N172-F174 PolarHBondContact O-N 2.9Å; N172-Q175 HydrophobicContact CB-CB 4.29Å; N172-Q175 WeakPolarHBondContact O-CB 3.21Å; N172-Q175 PolarHBondContact O-N 3.3Å; N172-E196 WeakPolarHBondContact CA-O 3.43Å; N172-E196 PolarHBondContact N-O 3.39Å; N172-E196 PolarHBondContact ND2-OE1 3.05Å; N172-E196 VanDerWaalsContact ND2-OE1 3.15Å; N172-Q200 PolarHBondContact OD1-NE2 3Å
173	V	94.3	Very high	89.6	Confident	1 Å²	1	32 Å²	32	1%	0.006	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.5	-176.1	65.2	0	0	0	0	114.2	I145 F150 L169 P170 A171 V197	I145-V173 HydrophobicContact CG2-CG2 4.06Å; F150-V173 HydrophobicContact CD2-CG2 3.81Å; F150-V173 HydrophobicContact CE2-CG2 3.84Å; L169-V173 HydrophobicContact CB-CG1 4.22Å; L169-V173 HydrophobicContact CD1-CG1 4.48Å; P170-V173 HydrophobicContact CG-CB 3.86Å; P170-V173 HydrophobicContact CG-CG2 3.89Å; P170-V173 WeakPolarHBondContact O-CB 3.35Å; P170-V173 PolarHBondContact O-N 3.44Å; A171-V173 VanDerWaalsContact C-N 3.25Å; A171-V173 PolarHBondContact O-N 3.32Å; V173-V197 HydrophobicContact CG1-CG1 4.4Å
174	F	93.3	Very high	90.3	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.018	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	12.7	-177.5	-54.4	-44.6	0	0	0	112.6	F150 L159 L169 N172 Y176 V177 I179 L182 V197 Q200 I201	F150-F174 HydrophobicContact CD2-CD1 4.49Å; F150-F174 HydrophobicContact CD2-CE1 4.47Å; F150-F174 HydrophobicContact CE2-CE1 4.45Å; L159-F174 HydrophobicContact CD2-CE1 3.89Å; L169-F174 HydrophobicContact CD1-CE2 3.91Å; L169-F174 HydrophobicContact CD1-CZ 3.73Å; N172-F174 VanDerWaalsContact C-N 3.33Å; N172-F174 PolarHBondContact O-N 2.9Å; F174-Y176 PolarHBondContact O-N 2.98Å; F174-V177 WeakPolarHBondContact O-CB 3.5Å; F174-V177 PolarHBondContact O-N 3.03Å; F174-I179 HydrophobicContact CB-CD1 4.36Å; F174-I179 HydrophobicContact CD1-CD1 3.27Å; F174-I179 HydrophobicContact CE1-CD1 3.58Å; F174-I179 HydrophobicContact CG-CD1 3.85Å; F174-I179 HydrophobicContact CZ-CD1 4.38Å; F174-L182 HydrophobicContact CE2-CD2 3.9Å; F174-L182 HydrophobicContact CZ-CD1 4.23Å; F174-L182 HydrophobicContact CZ-CD2 3.79Å; F174-V197 HydrophobicContact CD2-CG1 4.36Å; F174-V197 HydrophobicContact CE2-CG1 4.11Å; F174-Q200 HydrophobicContact CB-CB 4.2Å; F174-I201 HydrophobicContact CB-CG2 3.95Å; F174-I201 HydrophobicContact CD2-CG2 3.69Å; F174-I201 HydrophobicContact CE2-CG2 4.47Å; F174-I201 HydrophobicContact CG-CG2 4.01Å
175	Q	91.2	Very high	90.2	Very high	67 Å²	67	30.4 Å²	30.4	31%	0.313	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	123.9	-179.2	-161.2	-175.1	48.7	0	0	110.2	N172 V177	N172-Q175 HydrophobicContact CB-CB 4.29Å; N172-Q175 WeakPolarHBondContact O-CB 3.21Å; N172-Q175 PolarHBondContact O-N 3.3Å; Q175-V177 VanDerWaalsContact C-N 3.3Å
176	Y	89.1	Confident	89.7	Confident	150 Å²	150	28.4 Å²	28.4	59%	0.588	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	11.5	-173.6	-42.8	-72	0	0	0	116.1	Q151 F174	Q151-Y176 HydrophobicContact CG-CD2 4.35Å; F174-Y176 PolarHBondContact O-N 2.98Å
177	V	91.6	Very high	89.2	Confident	7 Å²	7	28.4 Å²	28.4	4%	0.042	16%	0.159	C	C	.	.			trans	-107.7	117.3	-178.3	-164.8	0	0	0	0	110.7	F150 L156 F174 Q175 I179	F150-V177 HydrophobicContact CB-CG2 4.03Å; F150-V177 WeakPolarHBondContact O-CG2 3.32Å; L156-V177 HydrophobicContact CB-CG1 3.8Å; L156-V177 HydrophobicContact CD2-CG1 4.07Å; L156-V177 HydrophobicContact CG-CG1 4.33Å; F174-V177 WeakPolarHBondContact O-CB 3.5Å; F174-V177 PolarHBondContact O-N 3.03Å; Q175-V177 VanDerWaalsContact C-N 3.3Å; V177-I179 HydrophobicContact CB-CD1 4.48Å; V177-I179 HydrophobicContact CB-CG1 4.12Å; V177-I179 HydrophobicContact CG1-CD1 4.01Å; V177-I179 HydrophobicContact CG1-CG1 3.54Å; V177-I179 PolarHBondContact O-N 2.97Å
178	P	88.3	Confident	89.1	Confident	52 Å²	52	31.9 Å²	31.9	34%	0.338	16%	0.162	S	C	.	.			trans	-82.7	53.8	-173.2	36.1	-38.1	0	0	0	112.9	L156 T180	L156-P178 CarbonylContact O-C 3.28Å; P178-T180 WeakPolarHBondContact O-CG2 3.45Å; P178-T180 PolarHBondContact O-N 3.15Å
179	I	90.5	Very high	89.2	Confident	4 Å²	4	27.8 Å²	27.8	2%	0.021	14%	0.137	C	C	.	.			trans	-65.5	124.9	-173.3	-55.1	-175	0	0	0	111	L156 L159 F174 V177 H181 L182 I201 I204	L156-I179 PolarHBondContact O-N 2.86Å; L159-I179 HydrophobicContact CB-CD1 4.36Å; L159-I179 HydrophobicContact CD2-CD1 3.77Å; F174-I179 HydrophobicContact CB-CD1 4.36Å; F174-I179 HydrophobicContact CD1-CD1 3.27Å; F174-I179 HydrophobicContact CE1-CD1 3.58Å; F174-I179 HydrophobicContact CG-CD1 3.85Å; F174-I179 HydrophobicContact CZ-CD1 4.38Å; V177-I179 HydrophobicContact CB-CD1 4.48Å; V177-I179 HydrophobicContact CB-CG1 4.12Å; V177-I179 HydrophobicContact CG1-CD1 4.01Å; V177-I179 HydrophobicContact CG1-CG1 3.54Å; V177-I179 PolarHBondContact O-N 2.97Å; I179-H181 WeakPolarHBondContact CG2-O 3.15Å; I179-L182 HydrophobicContact CG2-CB 4.02Å; I179-I201 HydrophobicContact CB-CG2 4.29Å; I179-I204 HydrophobicContact CG2-CD1 4.08Å
180	T	81.4	Confident	89.1	Confident	5 Å²	5	32.2 Å²	32.2	3%	0.031	16%	0.156	C	C	.	.	S	Bend	trans	-115.4	-16.3	176.2	80.7	0	0	0	0	113.5	E157 P178 A205 E206 K498	E157-T180 HydrophobicContact CG-CG2 4.44Å; E157-T180 PolarHBondContact O-N 3.29Å; P178-T180 WeakPolarHBondContact O-CG2 3.45Å; P178-T180 PolarHBondContact O-N 3.15Å; T180-A205 WeakPolarHBondContact O-CA 3.33Å; T180-A205 WeakPolarHBondContact O-CB 3.4Å; T180-A205 PolarHBondContact O-N 2.95Å; T180-E206 PolarHBondContact O-N 3.4Å; T180-E206 VanDerWaalsContact O-N 3.11Å; T180-K498 VanDerWaalsContact CB-NZ 3.31Å; T180-K498 PolarHBondContact OG1-NZ 2.89Å
181	H	79.4	Confident	89	Confident	11 Å²	11	33.2 Å²	33.2	5%	0.051	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	124.5	170.4	-42	90.2	0	0	0	110.4	E157 V158 L159 I179 E206 K498	E157-H181 PolarHBondContact O-N 3.08Å; V158-H181 HydrophobicContact CG2-CB 4.3Å; V158-H181 WeakPolarHBondContact CG2-ND1 3.29Å; L159-H181 PolarHBondContact N-O 3.31Å; I179-H181 WeakPolarHBondContact CG2-O 3.15Å; H181-E206 CarbonylContact C-O 3.08Å; H181-E206 WeakPolarHBondContact CA-O 3.3Å; H181-E206 HydrophobicContact CB-CB 4.14Å; H181-E206 IonicContact CD2-OE2 3.5Å; H181-E206 PolarHBondContact CD2-OE2 2.92Å; H181-E206 IonicContact CG-OE2 3.83Å; H181-K498 PolarHBondContact CE1-NZ 3.35Å; H181-K498 WeakPolarHBondContact NE2-CE 3.17Å; H181-K498 PolarHBondContact NE2-NZ 2.93Å
182	L	92.7	Very high	89	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.016	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	112.8	-176.1	178.1	57	0	0	0	111.3	L159 F174 I179 L184 I201 I204 E206 I207 L208	L159-L182 HydrophobicContact CB-CD1 4.16Å; L159-L182 HydrophobicContact CD2-CD1 4.09Å; L159-L182 HydrophobicContact CG-CD1 4.08Å; F174-L182 HydrophobicContact CE2-CD2 3.9Å; F174-L182 HydrophobicContact CZ-CD1 4.23Å; F174-L182 HydrophobicContact CZ-CD2 3.79Å; I179-L182 HydrophobicContact CG2-CB 4.02Å; L182-L184 HydrophobicContact CD1-CD1 4.39Å; L182-L184 HydrophobicContact CD1-CD2 4.29Å; L182-L184 HydrophobicContact CD1-CG 4.06Å; L182-L184 HydrophobicContact CD2-CD1 3.95Å; L182-L184 HydrophobicContact CD2-CG 4.47Å; L182-L184 HydrophobicContact CG-CD1 4.02Å; L182-L184 HydrophobicContact CG-CG 4.02Å; L182-I201 HydrophobicContact CD2-CD1 4.19Å; L182-I204 HydrophobicContact CB-CD1 3.98Å; L182-E206 PolarHBondContact N-O 2.96Å; L182-I207 HydrophobicContact CB-CG1 4.34Å; L182-I207 HydrophobicContact CD2-CD1 4.16Å; L182-I207 HydrophobicContact CD2-CG1 4.38Å; L182-I207 HydrophobicContact CG-CG1 4.44Å; L182-I207 WeakPolarHBondContact O-CA 3.4Å; L182-L208 PolarHBondContact O-N 2.96Å
183	D	82.2	Confident	89	Confident	11 Å²	11	32.1 Å²	32.1	6%	0.059	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	112.2	176	-169.3	-4.6	0	0	0	111.6	L159 I160 L161 N162 R185 L208	L159-D183 PolarHBondContact O-N 3.28Å; I160-D183 HydrophobicContact CG2-CB 4.41Å; L161-D183 CarbonylContact C-O 3.54Å; L161-D183 WeakPolarHBondContact CA-O 3.49Å; L161-D183 WeakPolarHBondContact CB-O 3.4Å; L161-D183 PolarHBondContact N-O 3.23Å; N162-D183 PolarHBondContact N-O 3.01Å; N162-D183 PolarHBondContact OD1-OD2 2.91Å; D183-R185 VanDerWaalsContact CG-NE 3.33Å; D183-R185 VanDerWaalsContact OD1-CB 3.31Å; D183-R185 WeakPolarHBondContact OD1-CB 3.11Å; D183-R185 WeakPolarHBondContact OD1-CG 3.48Å; D183-R185 IonicContact OD1-CZ 3.8Å; D183-R185 PolarHBondContact OD1-N 2.9Å; D183-R185 IonicContact OD1-NE 3.29Å; D183-R185 PolarHBondContact OD1-NE 3.03Å; D183-R185 IonicContact OD2-CZ 2.71Å; D183-R185 VanDerWaalsContact OD2-CZ 3.23Å; D183-R185 IonicContact OD2-NE 2.6Å; D183-R185 PolarHBondContact OD2-NE 3.12Å; D183-R185 IonicContact OD2-NH2 3.05Å; D183-R185 PolarHBondContact OD2-NH2 2.96Å; D183-L208 HydrophobicContact CB-CB 4.46Å; D183-L208 HydrophobicContact CB-CD1 4.3Å
184	L	93.1	Very high	88.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.173	C	C	.	.			trans	-113.4	10	178.1	-68.3	167.3	0	0	0	112.5	L161 L169 L182 N187 L189 L208 L209 N212	L161-L184 HydrophobicContact CB-CD2 4.31Å; L161-L184 HydrophobicContact CD1-CD2 4.12Å; L169-L184 HydrophobicContact CD1-CD1 4.21Å; L182-L184 HydrophobicContact CD1-CD1 4.39Å; L182-L184 HydrophobicContact CD1-CD2 4.29Å; L182-L184 HydrophobicContact CD1-CG 4.06Å; L182-L184 HydrophobicContact CD2-CD1 3.95Å; L182-L184 HydrophobicContact CD2-CG 4.47Å; L182-L184 HydrophobicContact CG-CD1 4.02Å; L182-L184 HydrophobicContact CG-CG 4.02Å; L184-N187 WeakPolarHBondContact O-CB 3.21Å; L184-N187 PolarHBondContact O-ND2 3.06Å; L184-L189 HydrophobicContact CB-CD1 3.98Å; L184-L189 HydrophobicContact CD1-CD1 3.98Å; L184-L189 HydrophobicContact CD2-CD1 4.46Å; L184-L189 HydrophobicContact CG-CD1 4.37Å; L184-L208 PolarHBondContact N-O 2.68Å; L184-L209 HydrophobicContact CB-CD2 4.41Å; L184-L209 HydrophobicContact CD1-CD2 4.21Å; L184-N212 PolarHBondContact O-ND2 3.08Å
185	R	83.4	Confident	88.7	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.011	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	147.7	-172.1	-68.2	176.6	-68.4	170.5	1.2	113.6	N162 D163 D183 N187 L208 E210 F381	N162-R185 CarbonylContact C-O 3.57Å; N162-R185 WeakPolarHBondContact CA-O 3.28Å; N162-R185 HydrophobicContact CB-CB 4.04Å; N162-R185 VanDerWaalsContact CB-O 3.29Å; N162-R185 WeakPolarHBondContact CB-O 3.21Å; D163-R185 PolarHBondContact N-O 3.42Å; D183-R185 VanDerWaalsContact CG-NE 3.33Å; D183-R185 VanDerWaalsContact OD1-CB 3.31Å; D183-R185 WeakPolarHBondContact OD1-CB 3.11Å; D183-R185 WeakPolarHBondContact OD1-CG 3.48Å; D183-R185 IonicContact OD1-CZ 3.8Å; D183-R185 PolarHBondContact OD1-N 2.9Å; D183-R185 IonicContact OD1-NE 3.29Å; D183-R185 PolarHBondContact OD1-NE 3.03Å; D183-R185 IonicContact OD2-CZ 2.71Å; D183-R185 VanDerWaalsContact OD2-CZ 3.23Å; D183-R185 IonicContact OD2-NE 2.6Å; D183-R185 PolarHBondContact OD2-NE 3.12Å; D183-R185 IonicContact OD2-NH2 3.05Å; D183-R185 PolarHBondContact OD2-NH2 2.96Å; R185-N187 PolarHBondContact O-N 2.86Å; R185-N187 PolarHBondContact O-ND2 3.28Å; R185-L208 HydrophobicContact CG-CB 3.67Å; R185-E210 CarbonylContact C-O 3.56Å; R185-E210 VanDerWaalsContact CA-O 3.24Å; R185-E210 WeakPolarHBondContact CA-O 3.44Å; R185-E210 HydrophobicContact CG-CB 3.98Å; R185-F381 VanDerWaalsContact NH1-CE1 3.34Å
186	G	76.5	Confident	88.5	Confident	9 Å²	9	45.5 Å²	45.5	9%	0.093	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	18.5	172.5	0	0	0	0	0	115.4	E210 D211	G186-E210 PolarHBondContact N-O 3.44Å; G186-D211 WeakPolarHBondContact CA-O 3.09Å
187	N	86.9	Confident	88.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-87.1	-154.5	175.6	-86.8	-77.6	0	0	0	111.1	L161 N164 L165 I166 L184 R185 L189 N212	L161-N187 PolarHBondContact O-ND2 3Å; N164-N187 WeakPolarHBondContact CA-OD1 3.38Å; N164-N187 WeakPolarHBondContact CB-OD1 3.36Å; L165-N187 PolarHBondContact N-OD1 2.97Å; I166-N187 HydrophobicContact CB-CB 4.32Å; I166-N187 WeakPolarHBondContact CB-OD1 3.2Å; I166-N187 WeakPolarHBondContact CG1-OD1 3.28Å; I166-N187 PolarHBondContact N-OD1 2.78Å; L184-N187 WeakPolarHBondContact O-CB 3.21Å; L184-N187 PolarHBondContact O-ND2 3.06Å; R185-N187 PolarHBondContact O-N 2.86Å; R185-N187 PolarHBondContact O-ND2 3.28Å; N187-L189 HydrophobicContact CB-CG 4.42Å; N187-N212 VanDerWaalsContact CA-OD1 3.3Å; N187-N212 WeakPolarHBondContact CA-OD1 3.43Å; N187-N212 WeakPolarHBondContact CB-OD1 3.42Å; N187-N212 PolarHBondContact N-OD1 3.48Å
188	R	90.3	Very high	88.6	Confident	132 Å²	132	38.2 Å²	38.2	50%	0.498	18%	0.184	S	C	.	.			trans	-124.3	21.9	-179	-57	-64.3	161.3	-164.3	-8.4	112.3	I166 S167 N212	I166-R188 CarbonylContact O-C 3.08Å; I166-R188 VanDerWaalsContact O-C 3.23Å; I166-R188 VanDerWaalsContact O-CA 3.27Å; I166-R188 WeakPolarHBondContact O-CA 3.14Å; I166-R188 PolarHBondContact O-N 3.25Å; S167-R188 WeakPolarHBondContact CA-O 3.44Å; R188-N212 PolarHBondContact N-OD1 3.18Å
189	L	95.1	Very high	88.7	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.188	C	C	.	.			trans	-64.1	132	178.7	-58.6	173.4	0	0	0	110.3	I166 L184 N187 N212 P213 W214	I166-L189 HydrophobicContact CG2-CD2 4.05Å; I166-L189 PolarHBondContact O-N 2.86Å; L184-L189 HydrophobicContact CB-CD1 3.98Å; L184-L189 HydrophobicContact CD1-CD1 3.98Å; L184-L189 HydrophobicContact CD2-CD1 4.46Å; L184-L189 HydrophobicContact CG-CD1 4.37Å; N187-L189 HydrophobicContact CB-CG 4.42Å; L189-N212 HydrophobicContact CB-CB 4.21Å; L189-N212 VanDerWaalsContact CB-OD1 3.31Å; L189-N212 WeakPolarHBondContact CB-OD1 3.05Å; L189-N212 WeakPolarHBondContact CG-OD1 3.09Å; L189-N212 PolarHBondContact N-OD1 2.77Å; L189-P213 CarbonylContact O-C 3.54Å; L189-P213 WeakPolarHBondContact O-CD 3.14Å; L189-P213 WeakPolarHBondContact O-CG 3.17Å; L189-W214 HydrophobicContact CB-CH2 3.78Å; L189-W214 HydrophobicContact CB-CZ2 4.33Å; L189-W214 HydrophobicContact CB-CZ3 3.98Å; L189-W214 HydrophobicContact CD1-CH2 4Å; L189-W214 HydrophobicContact CD1-CZ2 4.49Å
190	K	92.4	Very high	88.6	Confident	110 Å²	110	41.7 Å²	41.7	48%	0.478	20%	0.195	S	C	.	.	S	Bend	trans	-104.1	-35.1	173.3	-69.7	-169.5	161.5	-148.6	0	112.9	P213 D215	K190-P213 HydrophobicContact CG-CG 4.49Å; K190-D215 HydrophobicContact CB-CB 4.13Å; K190-D215 IonicContact NZ-OD2 3.91Å; K190-D215 PolarHBondContact O-N 3.41Å
191	T	93.3	Very high	88.9	Confident	44 Å²	44	41.6 Å²	41.6	27%	0.27	19%	0.194	S	C	.	.			trans	-143	160.4	-177.9	55.8	0	0	0	0	108.4	D219 L220	T191-D219 HydrophobicContact CG2-CB 3.78Å; T191-L220 HydrophobicContact CG2-CD1 4.45Å
192	L	93.3	Very high	88.7	Confident	2 Å²	2	46 Å²	46	1%	0.01	22%	0.224	C	C	.	.			trans	-141.4	102.4	176.7	-170.7	58.3	0	0	0	106.5	L169 V197 L198 L209 W214 L223	L169-L192 HydrophobicContact CD1-CD1 3.94Å; L192-V197 HydrophobicContact CD1-CG1 4.06Å; L192-L198 HydrophobicContact CD2-CD2 3.76Å; L192-L198 HydrophobicContact CG-CD1 4.27Å; L192-L198 HydrophobicContact CG-CD2 3.89Å; L192-L198 HydrophobicContact CG-CG 4.15Å; L192-L209 HydrophobicContact CD2-CD2 4.13Å; L192-W214 HydrophobicContact CB-CH2 4.24Å; L192-W214 HydrophobicContact CB-CZ3 4.06Å; L192-W214 HydrophobicContact CD2-CH2 4.48Å; L192-L223 HydrophobicContact CB-CD1 4.3Å; L192-L223 HydrophobicContact CB-CD2 4.25Å; L192-L223 HydrophobicContact CD2-CD1 4.09Å
193	P	91.1	Very high	87.8	Confident	60 Å²	60	47.8 Å²	47.8	39%	0.39	24%	0.243	S	C	.	.			trans	-71.2	150.3	-171.5	29.5	-35.2	0	0	0	111.3	V197 L198	P193-V197 HydrophobicContact CG-CB 4.29Å; P193-V197 HydrophobicContact CG-CG2 3.93Å; P193-L198 WeakPolarHBondContact O-CG 3.31Å; P193-L198 PolarHBondContact O-N 2.8Å
194	Y	90.3	Very high	87.9	Confident	106 Å²	106	47.5 Å²	47.5	42%	0.416	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-54	175	174.8	-93.3	0	0	0	111.8	L198 E199 W226	Y194-L198 HydrophobicContact CD2-CB 4.09Å; Y194-L198 PolarHBondContact O-N 3.45Å; Y194-L198 VanDerWaalsContact O-N 3.09Å; Y194-E199 HydrophobicContact CE1-CB 3.97Å; Y194-E199 HydrophobicContact CE2-CB 4.29Å; Y194-E199 PolarHBondContact O-N 2.78Å; Y194-W226 HydrophobicContact CD2-CB 4.38Å; Y194-W226 AromaticContact CD2-CD1 3.82Å; Y194-W226 HydrophobicContact CD2-CG 4.37Å; Y194-W226 AromaticContact CE2-CD1 3.81Å
195	E	90.7	Very high	86.8	Confident	150 Å²	150	47.5 Å²	47.5	70%	0.701	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	142.1	173.9	-60.2	179.6	173.9	0	0	110.5	V197	E195-V197 PolarHBondContact O-N 2.85Å
196	E	87.9	Confident	86.3	Confident	97 Å²	97	47.8 Å²	47.8	45%	0.453	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	-5.8	179.2	-48.3	-166.6	108.7	0	0	117	A171 N172 E199	A171-E196 HydrophobicContact CB-CB 3.97Å; A171-E196 HydrophobicContact CB-CG 4.38Å; A171-E196 WeakPolarHBondContact CB-OE2 3.33Å; N172-E196 WeakPolarHBondContact CA-O 3.43Å; N172-E196 PolarHBondContact N-O 3.39Å; N172-E196 PolarHBondContact ND2-OE1 3.05Å; N172-E196 VanDerWaalsContact ND2-OE1 3.15Å; E196-E199 WeakPolarHBondContact CA-OE1 3.3Å; E196-E199 PolarHBondContact N-OE1 2.84Å
197	V	92.2	Very high	86.9	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.1	-70.7	-177.5	-176.4	0	0	0	0	113	L169 V173 F174 L192 P193 E195 E199 Q200	L169-V197 HydrophobicContact CB-CG1 4.47Å; L169-V197 HydrophobicContact CD1-CG1 4.12Å; V173-V197 HydrophobicContact CG1-CG1 4.4Å; F174-V197 HydrophobicContact CD2-CG1 4.36Å; F174-V197 HydrophobicContact CE2-CG1 4.11Å; L192-V197 HydrophobicContact CD1-CG1 4.06Å; P193-V197 HydrophobicContact CG-CB 4.29Å; P193-V197 HydrophobicContact CG-CG2 3.93Å; E195-V197 PolarHBondContact O-N 2.85Å; V197-E199 PolarHBondContact O-N 2.98Å; V197-Q200 WeakPolarHBondContact O-CB 3.49Å; V197-Q200 PolarHBondContact O-N 2.84Å
198	L	90.3	Very high	86.6	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-72	-29.5	-174.8	-62.4	169.8	0	0	0	113.2	L192 P193 Y194 Q200 I201 L223 W226	L192-L198 HydrophobicContact CD2-CD2 3.76Å; L192-L198 HydrophobicContact CG-CD1 4.27Å; L192-L198 HydrophobicContact CG-CD2 3.89Å; L192-L198 HydrophobicContact CG-CG 4.15Å; P193-L198 WeakPolarHBondContact O-CG 3.31Å; P193-L198 PolarHBondContact O-N 2.8Å; Y194-L198 HydrophobicContact CD2-CB 4.09Å; Y194-L198 PolarHBondContact O-N 3.45Å; Y194-L198 VanDerWaalsContact O-N 3.09Å; L198-Q200 PolarHBondContact O-N 3.22Å; L198-Q200 VanDerWaalsContact O-N 3.12Å; L198-I201 HydrophobicContact CD2-CD1 4.09Å; L198-I201 WeakPolarHBondContact O-CG1 3.25Å; L198-I201 PolarHBondContact O-N 2.79Å; L198-L223 HydrophobicContact CD1-CD1 3.92Å; L198-W226 HydrophobicContact CB-CD2 4.15Å; L198-W226 HydrophobicContact CB-CG 4.21Å; L198-W226 HydrophobicContact CB-CZ2 4.43Å; L198-W226 HydrophobicContact CD1-CB 4.12Å; L198-W226 HydrophobicContact CD1-CD2 3.89Å; L198-W226 HydrophobicContact CD1-CE3 4.02Å; L198-W226 HydrophobicContact CD1-CG 3.95Å; L198-W226 HydrophobicContact CD2-CD2 4.07Å; L198-W226 HydrophobicContact CD2-CE3 3.98Å; L198-W226 HydrophobicContact CD2-CH2 3.85Å; L198-W226 HydrophobicContact CD2-CZ2 3.93Å; L198-W226 HydrophobicContact CD2-CZ3 3.88Å; L198-W226 HydrophobicContact CG-CD2 4.27Å
199	E	89.7	Confident	86.5	Confident	91 Å²	91	41.2 Å²	41.2	43%	0.425	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-60	-19.5	173.4	69.7	179.9	170.2	0	0	113.2	Y194 E196 V197	Y194-E199 HydrophobicContact CE1-CB 3.97Å; Y194-E199 HydrophobicContact CE2-CB 4.29Å; Y194-E199 PolarHBondContact O-N 2.78Å; E196-E199 WeakPolarHBondContact CA-OE1 3.3Å; E196-E199 PolarHBondContact N-OE1 2.84Å; V197-E199 PolarHBondContact O-N 2.98Å
200	Q	88.1	Confident	85.7	Confident	37 Å²	37	41.6 Å²	41.6	17%	0.173	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-87.7	-10.2	-177.1	-50.5	-159.8	-25.1	0	0	113.3	N172 F174 V197 L198 P202	N172-Q200 PolarHBondContact OD1-NE2 3Å; F174-Q200 HydrophobicContact CB-CB 4.2Å; V197-Q200 WeakPolarHBondContact O-CB 3.49Å; V197-Q200 PolarHBondContact O-N 2.84Å; L198-Q200 PolarHBondContact O-N 3.22Å; L198-Q200 VanDerWaalsContact O-N 3.12Å; Q200-P202 WeakPolarHBondContact O-CD 3.38Å
201	I	88.4	Confident	84.9	Confident	3 Å²	3	39 Å²	39	2%	0.015	21%	0.209	C	C	.	.			trans	-119.4	52.1	-179.2	56.5	166.5	0	0	0	113.1	F174 I179 L182 L198 G203 I204 I207 W226	F174-I201 HydrophobicContact CB-CG2 3.95Å; F174-I201 HydrophobicContact CD2-CG2 3.69Å; F174-I201 HydrophobicContact CE2-CG2 4.47Å; F174-I201 HydrophobicContact CG-CG2 4.01Å; I179-I201 HydrophobicContact CB-CG2 4.29Å; L182-I201 HydrophobicContact CD2-CD1 4.19Å; L198-I201 HydrophobicContact CD2-CD1 4.09Å; L198-I201 WeakPolarHBondContact O-CG1 3.25Å; L198-I201 PolarHBondContact O-N 2.79Å; I201-G203 PolarHBondContact O-N 3.36Å; I201-I204 HydrophobicContact CB-CB 4.44Å; I201-I204 HydrophobicContact CD1-CD1 4.48Å; I201-I204 HydrophobicContact CD1-CG1 4.36Å; I201-I204 WeakPolarHBondContact O-CB 3.42Å; I201-I204 WeakPolarHBondContact O-CG2 3.22Å; I201-I204 PolarHBondContact O-N 3.45Å; I201-I207 HydrophobicContact CD1-CD1 4.31Å; I201-W226 HydrophobicContact CD1-CH2 4.09Å; I201-W226 HydrophobicContact CD1-CZ2 3.98Å; I201-W226 HydrophobicContact CG1-CZ2 4.11Å
202	P	74.1	Confident	84.4	Confident	103 Å²	103	37.2 Å²	37.2	67%	0.669	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-22.4	-178.6	30.4	-36.7	0	0	0	113.5	Q200 I204	Q200-P202 WeakPolarHBondContact O-CD 3.38Å; P202-I204 VanDerWaalsContact C-N 3.33Å
203	G	74.5	Confident	84	Confident	41 Å²	41	38.2 Å²	38.2	42%	0.423	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	14.5	177.7	0	0	0	0	0	115	I201	I201-G203 PolarHBondContact O-N 3.36Å
204	I	83.4	Confident	84.1	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.026	19%	0.186	C	C	.	.			trans	-64.4	133.6	-178.4	-160.8	63.2	0	0	0	111.1	I179 L182 I201 P202 E206 I207 W226 I230	I179-I204 HydrophobicContact CG2-CD1 4.08Å; L182-I204 HydrophobicContact CB-CD1 3.98Å; I201-I204 HydrophobicContact CB-CB 4.44Å; I201-I204 HydrophobicContact CD1-CD1 4.48Å; I201-I204 HydrophobicContact CD1-CG1 4.36Å; I201-I204 WeakPolarHBondContact O-CB 3.42Å; I201-I204 WeakPolarHBondContact O-CG2 3.22Å; I201-I204 PolarHBondContact O-N 3.45Å; P202-I204 VanDerWaalsContact C-N 3.33Å; I204-E206 WeakPolarHBondContact CD1-O 3.49Å; I204-I207 HydrophobicContact CG1-CB 4.09Å; I204-W226 HydrophobicContact CG2-CH2 3.9Å; I204-W226 HydrophobicContact CG2-CZ2 3.74Å; I204-I230 HydrophobicContact CG2-CD1 3.84Å; I204-I230 HydrophobicContact CG2-CG1 4.16Å
205	A	70.3	Confident	84.2	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.008	18%	0.176	C	C	.	.	S	Bend	trans	-118.1	-18.1	178.2	0	0	0	0	0	113.1	T180 A234 L235 I475 K498	T180-A205 WeakPolarHBondContact O-CA 3.33Å; T180-A205 WeakPolarHBondContact O-CB 3.4Å; T180-A205 PolarHBondContact O-N 2.95Å; A205-A234 CarbonylContact O-C 3.23Å; A205-A234 WeakPolarHBondContact O-CA 3.21Å; A205-L235 PolarHBondContact O-N 2.99Å; A205-I475 VanDerWaalsContact O-CD1 3.29Å; A205-I475 WeakPolarHBondContact O-CD1 3.35Å; A205-K498 HydrophobicContact CB-CD 3.5Å
206	E	73.9	Confident	84.3	Confident	8 Å²	8	25.1 Å²	25.1	4%	0.037	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	126.6	171.3	177.6	171.4	-140.1	0	0	109	T180 H181 L182 I204 L208 L235 Y429 Y451	T180-E206 PolarHBondContact O-N 3.4Å; T180-E206 VanDerWaalsContact O-N 3.11Å; H181-E206 CarbonylContact C-O 3.08Å; H181-E206 WeakPolarHBondContact CA-O 3.3Å; H181-E206 HydrophobicContact CB-CB 4.14Å; H181-E206 IonicContact CD2-OE2 3.5Å; H181-E206 PolarHBondContact CD2-OE2 2.92Å; H181-E206 IonicContact CG-OE2 3.83Å; L182-E206 PolarHBondContact N-O 2.96Å; I204-E206 WeakPolarHBondContact CD1-O 3.49Å; E206-L208 HydrophobicContact CG-CD1 4.43Å; E206-L208 HydrophobicContact CG-CD2 3.94Å; E206-L208 HydrophobicContact CG-CG 3.96Å; E206-L235 WeakPolarHBondContact CA-O 3.23Å; E206-L235 HydrophobicContact CB-CB 4.3Å; E206-L235 HydrophobicContact CG-CB 4.31Å; E206-L235 HydrophobicContact CG-CD2 4.07Å; E206-L235 WeakPolarHBondContact OE1-CD2 3.41Å; E206-Y429 PolarHBondContact OE1-OH 3.29Å; E206-Y451 VanDerWaalsContact OE1-CE2 3.24Å; E206-Y451 WeakPolarHBondContact OE1-CE2 3.4Å; E206-Y451 WeakPolarHBondContact OE2-CE2 3.04Å; E206-Y451 PolarHBondContact OE2-OH 3.19Å
207	I	88	Confident	84.5	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	118.1	169.6	-168.3	172.7	0	0	0	109.7	L182 I201 I204 L209 W226 I230 L235 G237	L182-I207 HydrophobicContact CB-CG1 4.34Å; L182-I207 HydrophobicContact CD2-CD1 4.16Å; L182-I207 HydrophobicContact CD2-CG1 4.38Å; L182-I207 HydrophobicContact CG-CG1 4.44Å; L182-I207 WeakPolarHBondContact O-CA 3.4Å; I201-I207 HydrophobicContact CD1-CD1 4.31Å; I204-I207 HydrophobicContact CG1-CB 4.09Å; I207-L209 HydrophobicContact CD1-CD1 4.41Å; I207-L209 HydrophobicContact CD1-CD2 4.07Å; I207-L209 HydrophobicContact CD1-CG 4.44Å; I207-L209 HydrophobicContact CG1-CD1 4.42Å; I207-L209 HydrophobicContact CG1-CD2 3.93Å; I207-L209 HydrophobicContact CG1-CG 4.07Å; I207-W226 HydrophobicContact CD1-CH2 3.68Å; I207-W226 HydrophobicContact CD1-CZ3 3.86Å; I207-W226 HydrophobicContact CG2-CH2 4.06Å; I207-W226 HydrophobicContact CG2-CZ3 4.03Å; I207-I230 HydrophobicContact CG2-CD1 4.36Å; I207-L235 PolarHBondContact N-O 2.86Å; I207-G237 PolarHBondContact O-N 3.31Å
208	L	80.6	Confident	84.4	Confident	3 Å²	3	25.2 Å²	25.2	2%	0.016	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.1	-175.7	-52	178.9	0	0	0	109.8	L182 D183 L184 R185 E206 Y429	L182-L208 PolarHBondContact O-N 2.96Å; D183-L208 HydrophobicContact CB-CB 4.46Å; D183-L208 HydrophobicContact CB-CD1 4.3Å; L184-L208 PolarHBondContact N-O 2.68Å; R185-L208 HydrophobicContact CG-CB 3.67Å; E206-L208 HydrophobicContact CG-CD1 4.43Å; E206-L208 HydrophobicContact CG-CD2 3.94Å; E206-L208 HydrophobicContact CG-CG 3.96Å; L208-Y429 VanDerWaalsContact CD1-OH 3.32Å; L208-Y429 WeakPolarHBondContact CD1-OH 3.36Å
209	L	88.7	Confident	84.4	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.181	C	C	.	.			trans	-132.3	-0.1	-162	-65.3	179.4	0	0	0	113.4	L184 L192 I207 N212 W214 L223 V239	L184-L209 HydrophobicContact CB-CD2 4.41Å; L184-L209 HydrophobicContact CD1-CD2 4.21Å; L192-L209 HydrophobicContact CD2-CD2 4.13Å; I207-L209 HydrophobicContact CD1-CD1 4.41Å; I207-L209 HydrophobicContact CD1-CD2 4.07Å; I207-L209 HydrophobicContact CD1-CG 4.44Å; I207-L209 HydrophobicContact CG1-CD1 4.42Å; I207-L209 HydrophobicContact CG1-CD2 3.93Å; I207-L209 HydrophobicContact CG1-CG 4.07Å; L209-N212 PolarHBondContact O-ND2 3.16Å; L209-W214 HydrophobicContact CB-CZ2 3.89Å; L209-W214 HydrophobicContact CD2-CH2 4.22Å; L209-W214 HydrophobicContact CD2-CZ2 3.97Å; L209-W214 HydrophobicContact CG-CZ2 4.37Å; L209-W214 PolarHBondContact O-NE1 2.74Å; L209-L223 HydrophobicContact CD1-CD1 4.38Å; L209-V239 HydrophobicContact CB-CG2 3.89Å; L209-V239 HydrophobicContact CD1-CG2 3.68Å; L209-V239 HydrophobicContact CG-CG2 4.45Å
210	E	79.2	Confident	84.6	Confident	9 Å²	9	26.3 Å²	26.3	4%	0.042	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	162	178.4	-69.1	81.9	173.7	0	0	113.5	R185 G186 N212 G237 R238	R185-E210 CarbonylContact C-O 3.56Å; R185-E210 VanDerWaalsContact CA-O 3.24Å; R185-E210 WeakPolarHBondContact CA-O 3.44Å; R185-E210 HydrophobicContact CG-CB 3.98Å; G186-E210 PolarHBondContact N-O 3.44Å; E210-N212 PolarHBondContact O-N 3.05Å; E210-N212 PolarHBondContact O-ND2 2.81Å; E210-G237 VanDerWaalsContact CD-CA 3.47Å; E210-G237 WeakPolarHBondContact OE1-CA 3.45Å; E210-G237 VanDerWaalsContact OE2-CA 3.32Å; E210-G237 WeakPolarHBondContact OE2-CA 3.36Å; E210-R238 VanDerWaalsContact CD-N 3.26Å; E210-R238 HydrophobicContact CG-CB 4.41Å; E210-R238 PolarHBondContact OE1-N 3.13Å
211	D	74.8	Confident	84.7	Confident	54 Å²	54	25.2 Å²	25.2	29%	0.289	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	23	174.2	-56.2	-50.7	0	0	0	115.9	G186 I350 K356	G186-D211 WeakPolarHBondContact CA-O 3.09Å; D211-I350 WeakPolarHBondContact OD1-CD1 3.06Å; D211-K356 WeakPolarHBondContact OD2-CD 3.04Å; D211-K356 WeakPolarHBondContact OD2-CE 3.24Å; D211-K356 IonicContact OD2-NZ 2.77Å; D211-K356 PolarHBondContact OD2-NZ 2.87Å
212	N	82.9	Confident	84.8	Confident	7 Å²	7	27.4 Å²	27.4	4%	0.037	17%	0.172	C	C	.	.	S	Bend	trans	-99.6	144.6	170.1	-81.3	-86.7	0	0	0	110.4	L184 N187 R188 L189 L209 E210 W214	L184-N212 PolarHBondContact O-ND2 3.08Å; N187-N212 VanDerWaalsContact CA-OD1 3.3Å; N187-N212 WeakPolarHBondContact CA-OD1 3.43Å; N187-N212 WeakPolarHBondContact CB-OD1 3.42Å; N187-N212 PolarHBondContact N-OD1 3.48Å; R188-N212 PolarHBondContact N-OD1 3.18Å; L189-N212 HydrophobicContact CB-CB 4.21Å; L189-N212 VanDerWaalsContact CB-OD1 3.31Å; L189-N212 WeakPolarHBondContact CB-OD1 3.05Å; L189-N212 WeakPolarHBondContact CG-OD1 3.09Å; L189-N212 PolarHBondContact N-OD1 2.77Å; L209-N212 PolarHBondContact O-ND2 3.16Å; E210-N212 PolarHBondContact O-N 3.05Å; E210-N212 PolarHBondContact O-ND2 2.81Å; N212-W214 HydrophobicContact CB-CD2 4.2Å; N212-W214 HydrophobicContact CB-CG 4.47Å; N212-W214 HydrophobicContact CB-CZ2 3.77Å; N212-W214 PolarHBondContact O-N 3.28Å
213	P	84.8	Confident	85.7	Confident	23 Å²	23	22.5 Å²	22.5	15%	0.149	14%	0.14	C	C	.	.			trans	-77.2	60.4	-177.4	34.3	-39.1	0	0	0	112.5	L189 K190 D215 E242	L189-P213 CarbonylContact O-C 3.54Å; L189-P213 WeakPolarHBondContact O-CD 3.14Å; L189-P213 WeakPolarHBondContact O-CG 3.17Å; K190-P213 HydrophobicContact CG-CG 4.49Å; P213-D215 PolarHBondContact O-N 2.71Å; P213-E242 WeakPolarHBondContact CA-OE2 3.29Å; P213-E242 VanDerWaalsContact CB-OE2 3.24Å; P213-E242 WeakPolarHBondContact CB-OE2 3.22Å
214	W	93.8	Very high	86.5	Confident	1 Å²	1	21 Å²	21	0%	0.004	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	130.2	-174.4	-63.1	110.6	0	0	0	112.6	L189 L192 L209 N212 L220 L223 V239 E242 A243	L189-W214 HydrophobicContact CB-CH2 3.78Å; L189-W214 HydrophobicContact CB-CZ2 4.33Å; L189-W214 HydrophobicContact CB-CZ3 3.98Å; L189-W214 HydrophobicContact CD1-CH2 4Å; L189-W214 HydrophobicContact CD1-CZ2 4.49Å; L192-W214 HydrophobicContact CB-CH2 4.24Å; L192-W214 HydrophobicContact CB-CZ3 4.06Å; L192-W214 HydrophobicContact CD2-CH2 4.48Å; L209-W214 HydrophobicContact CB-CZ2 3.89Å; L209-W214 HydrophobicContact CD2-CH2 4.22Å; L209-W214 HydrophobicContact CD2-CZ2 3.97Å; L209-W214 HydrophobicContact CG-CZ2 4.37Å; L209-W214 PolarHBondContact O-NE1 2.74Å; N212-W214 HydrophobicContact CB-CD2 4.2Å; N212-W214 HydrophobicContact CB-CG 4.47Å; N212-W214 HydrophobicContact CB-CZ2 3.77Å; N212-W214 PolarHBondContact O-N 3.28Å; W214-L220 HydrophobicContact CB-CD2 4.25Å; W214-L220 HydrophobicContact CE3-CD1 3.69Å; W214-L220 HydrophobicContact CZ3-CD1 4.16Å; W214-L223 HydrophobicContact CE3-CD2 4.28Å; W214-L223 HydrophobicContact CH2-CD2 4.28Å; W214-L223 HydrophobicContact CZ3-CD2 3.98Å; W214-V239 HydrophobicContact CB-CG1 4.24Å; W214-V239 HydrophobicContact CD2-CG1 3.91Å; W214-V239 HydrophobicContact CG-CG1 3.67Å; W214-E242 PolarHBondContact O-N 3.25Å; W214-A243 PolarHBondContact O-N 2.91Å
215	D	92.2	Very high	86.8	Confident	39 Å²	39	25 Å²	25	21%	0.209	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	85.2	-177.8	-153	-20.4	0	0	0	109.1	K190 P213 T217 A243	K190-D215 HydrophobicContact CB-CB 4.13Å; K190-D215 IonicContact NZ-OD2 3.91Å; K190-D215 PolarHBondContact O-N 3.41Å; P213-D215 PolarHBondContact O-N 2.71Å; D215-T217 PolarHBondContact O-N 2.79Å; D215-T217 PolarHBondContact O-OG1 2.65Å; D215-A243 HydrophobicContact CB-CB 4.33Å; D215-A243 VanDerWaalsContact OD1-CB 3.27Å; D215-A243 WeakPolarHBondContact OD1-CB 3.46Å
216	C	92.8	Very high	87.7	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.007	15%	0.145	C	C	.	.			trans	-70.1	66.8	-174.1	-69.5	0	0	0	0	112.9	L220 C241 A243 P244 L247 L260	C216-L220 HydrophobicContact CB-CD2 4.21Å; C216-L220 WeakPolarHBondContact SG-CD2 3.32Å; C216-C241 HydrophobicContact CB-CB 3.74Å; C216-C241 WeakPolarHBondContact CB-SG 3.09Å; C216-C241 WeakPolarHBondContact SG-CA 3.34Å; C216-C241 WeakPolarHBondContact SG-CB 3.34Å; C216-C241 CovalentContact SG-SG 2.02Å; C216-C241 PolarHBondContact SG-SG 3.48Å; C216-A243 WeakPolarHBondContact CB-O 3.46Å; C216-A243 PolarHBondContact N-O 3.21Å; C216-P244 WeakPolarHBondContact O-CD 3.48Å; C216-L247 HydrophobicContact CB-CD1 3.91Å; C216-L247 WeakPolarHBondContact O-CD1 3.49Å; C216-L260 HydrophobicContact CB-CD2 3.64Å; C216-L260 WeakPolarHBondContact O-CD2 3.24Å
217	T	91.8	Very high	88.3	Confident	46 Å²	46	26.2 Å²	26.2	28%	0.282	15%	0.145	S	C	.	.	S	Bend	trans	-112.5	-168.9	171.6	63.7	0	0	0	0	109.3	D215 D219 L220 L260	D215-T217 PolarHBondContact O-N 2.79Å; D215-T217 PolarHBondContact O-OG1 2.65Å; T217-D219 PolarHBondContact O-N 2.82Å; T217-L220 PolarHBondContact O-N 3.24Å; T217-L260 CarbonylContact C-O 3.57Å
218	C	91.2	Very high	88.2	Confident	55 Å²	55	31.7 Å²	31.7	37%	0.372	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-56.7	-30.9	176	-74.8	0	0	0	0	114.1	L220 L221 L260 C261	C218-L220 PolarHBondContact O-N 2.98Å; C218-L220 VanDerWaalsContact O-N 3.14Å; C218-L221 WeakPolarHBondContact O-CB 3.35Å; C218-L221 PolarHBondContact O-N 2.84Å; C218-L260 PolarHBondContact N-O 3.04Å; C218-C261 WeakPolarHBondContact CA-SG 3.32Å; C218-C261 HydrophobicContact CB-CB 4.5Å; C218-C261 WeakPolarHBondContact CB-SG 3.25Å; C218-C261 WeakPolarHBondContact SG-CA 3.23Å; C218-C261 WeakPolarHBondContact SG-CB 3.39Å; C218-C261 CovalentContact SG-SG 2.04Å; C218-C261 PolarHBondContact SG-SG 3.33Å
219	D	90.3	Very high	88.3	Confident	116 Å²	116	38.1 Å²	38.1	62%	0.62	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-69.9	-12.2	-176.4	-55.2	-6.5	0	0	0	112.3	T191 T217	T191-D219 HydrophobicContact CG2-CB 3.78Å; T217-D219 PolarHBondContact O-N 2.82Å
220	L	92.8	Very high	87.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-98.6	-3.2	173.5	-154	69.5	0	0	0	113.1	T191 W214 C216 T217 C218 S222 L223 K224 V239 L252	T191-L220 HydrophobicContact CG2-CD1 4.45Å; W214-L220 HydrophobicContact CB-CD2 4.25Å; W214-L220 HydrophobicContact CE3-CD1 3.69Å; W214-L220 HydrophobicContact CZ3-CD1 4.16Å; C216-L220 HydrophobicContact CB-CD2 4.21Å; C216-L220 WeakPolarHBondContact SG-CD2 3.32Å; T217-L220 PolarHBondContact O-N 3.24Å; C218-L220 PolarHBondContact O-N 2.98Å; C218-L220 VanDerWaalsContact O-N 3.14Å; L220-S222 VanDerWaalsContact C-N 3.33Å; L220-S222 PolarHBondContact O-N 3.46Å; L220-L223 HydrophobicContact CD1-CB 4.16Å; L220-L223 HydrophobicContact CD1-CD2 3.68Å; L220-L223 HydrophobicContact CG-CB 4.33Å; L220-L223 HydrophobicContact CG-CD2 4.23Å; L220-L223 PolarHBondContact O-N 2.84Å; L220-K224 PolarHBondContact O-N 2.65Å; L220-K224 VanDerWaalsContact O-N 3.12Å; L220-V239 HydrophobicContact CD2-CG1 4.43Å; L220-L252 HydrophobicContact CD2-CD1 3.99Å; L220-L252 HydrophobicContact CD2-CD2 4.12Å; L220-L252 HydrophobicContact CG-CD2 4.28Å
221	L	90.9	Very high	87.3	Confident	15 Å²	15	41.1 Å²	41.1	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-40.9	-179.7	-179.9	61.1	0	0	0	111.5	C218 L223 K224 E225 E257 L260	C218-L221 WeakPolarHBondContact O-CB 3.35Å; C218-L221 PolarHBondContact O-N 2.84Å; L221-L223 VanDerWaalsContact C-N 3.29Å; L221-L223 PolarHBondContact O-N 3.23Å; L221-K224 WeakPolarHBondContact O-CA 3.25Å; L221-K224 WeakPolarHBondContact O-CB 3.45Å; L221-K224 PolarHBondContact O-N 2.98Å; L221-K224 VanDerWaalsContact O-N 3.07Å; L221-E225 HydrophobicContact CD1-CG 4.23Å; L221-E225 HydrophobicContact CG-CG 4.31Å; L221-E225 WeakPolarHBondContact CG-OE1 3.42Å; L221-E225 WeakPolarHBondContact O-CG 3.34Å; L221-E225 PolarHBondContact O-N 2.86Å; L221-E257 HydrophobicContact CD1-CB 4.4Å; L221-E257 HydrophobicContact CD1-CG 4.01Å; L221-E257 HydrophobicContact CD2-CG 4.05Å; L221-L260 HydrophobicContact CD1-CD1 4.2Å
222	S	91.1	Very high	86.5	Confident	48 Å²	48	47.8 Å²	47.8	34%	0.336	25%	0.25	S	S	.	.	H	α-helix	trans	-64.5	-31.8	178.1	-49.8	0	0	0	0	113	L220 W226	L220-S222 VanDerWaalsContact C-N 3.33Å; L220-S222 PolarHBondContact O-N 3.46Å; S222-W226 VanDerWaalsContact O-CB 3.26Å; S222-W226 WeakPolarHBondContact O-CB 3.35Å; S222-W226 PolarHBondContact O-N 2.97Å
223	L	92.3	Very high	85.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.8	-42.8	171	178.5	62.1	0	0	0	110.8	L192 L198 L209 W214 L220 L221 W226 L227 V239 L252	L192-L223 HydrophobicContact CB-CD1 4.3Å; L192-L223 HydrophobicContact CB-CD2 4.25Å; L192-L223 HydrophobicContact CD2-CD1 4.09Å; L198-L223 HydrophobicContact CD1-CD1 3.92Å; L209-L223 HydrophobicContact CD1-CD1 4.38Å; W214-L223 HydrophobicContact CE3-CD2 4.28Å; W214-L223 HydrophobicContact CH2-CD2 4.28Å; W214-L223 HydrophobicContact CZ3-CD2 3.98Å; L220-L223 HydrophobicContact CD1-CB 4.16Å; L220-L223 HydrophobicContact CD1-CD2 3.68Å; L220-L223 HydrophobicContact CG-CB 4.33Å; L220-L223 HydrophobicContact CG-CD2 4.23Å; L220-L223 PolarHBondContact O-N 2.84Å; L221-L223 VanDerWaalsContact C-N 3.29Å; L221-L223 PolarHBondContact O-N 3.23Å; L223-W226 HydrophobicContact CD1-CE3 4.03Å; L223-W226 HydrophobicContact CD1-CZ3 4.46Å; L223-W226 PolarHBondContact O-N 3.41Å; L223-L227 HydrophobicContact CD1-CD1 4.11Å; L223-L227 HydrophobicContact CD1-CG 4.06Å; L223-L227 HydrophobicContact CG-CD1 4.01Å; L223-L227 HydrophobicContact CG-CG 4.35Å; L223-L227 WeakPolarHBondContact O-CB 3.19Å; L223-L227 VanDerWaalsContact O-CG 3.27Å; L223-L227 WeakPolarHBondContact O-CG 3.25Å; L223-L227 PolarHBondContact O-N 3.37Å; L223-V239 HydrophobicContact CD2-CG1 4.39Å; L223-V239 HydrophobicContact CD2-CG2 4.4Å; L223-L252 HydrophobicContact CD2-CD2 4.35Å; L223-L252 HydrophobicContact CG-CD2 4.35Å
224	K	90.8	Very high	84	Confident	10 Å²	10	47.2 Å²	47.2	4%	0.043	25%	0.247	C	C	.	.	H	α-helix	trans	-61.1	-49.5	176	179.5	174.5	174.4	59.5	0	111.6	L220 L221 W226 L227 E228 L252 T255 L260	L220-K224 PolarHBondContact O-N 2.65Å; L220-K224 VanDerWaalsContact O-N 3.12Å; L221-K224 WeakPolarHBondContact O-CA 3.25Å; L221-K224 WeakPolarHBondContact O-CB 3.45Å; L221-K224 PolarHBondContact O-N 2.98Å; L221-K224 VanDerWaalsContact O-N 3.07Å; K224-W226 VanDerWaalsContact C-N 3.3Å; K224-W226 PolarHBondContact O-N 3.44Å; K224-L227 PolarHBondContact O-N 3.44Å; K224-E228 WeakPolarHBondContact CE-OE1 3.49Å; K224-E228 WeakPolarHBondContact CG-OE1 3.4Å; K224-E228 IonicContact NZ-OE1 3.8Å; K224-E228 PolarHBondContact NZ-OE1 3Å; K224-E228 WeakPolarHBondContact O-CB 3.43Å; K224-E228 WeakPolarHBondContact O-CG 3.22Å; K224-E228 PolarHBondContact O-N 3.34Å; K224-L252 HydrophobicContact CB-CD1 4.21Å; K224-L252 HydrophobicContact CB-CD2 4.05Å; K224-L252 HydrophobicContact CB-CG 4.06Å; K224-L252 HydrophobicContact CD-CD1 4.29Å; K224-L252 HydrophobicContact CD-CG 4.47Å; K224-L252 HydrophobicContact CG-CG 4.33Å; K224-L252 PolarHBondContact NZ-O 3.35Å; K224-T255 WeakPolarHBondContact CE-O 3.5Å; K224-T255 PolarHBondContact NZ-O 3.08Å; K224-L260 HydrophobicContact CB-CD1 4.35Å; K224-L260 HydrophobicContact CD-CD1 3.67Å
225	E	89.6	Confident	82.3	Confident	88 Å²	88	47.7 Å²	47.7	41%	0.411	25%	0.25	S	C	.	.	H	α-helix	trans	-60.4	-39.3	177.5	-71.1	173.3	179.9	0	0	111.4	L221 E228 N229	L221-E225 HydrophobicContact CD1-CG 4.23Å; L221-E225 HydrophobicContact CG-CG 4.31Å; L221-E225 WeakPolarHBondContact CG-OE1 3.42Å; L221-E225 WeakPolarHBondContact O-CG 3.34Å; L221-E225 PolarHBondContact O-N 2.86Å; E225-E228 PolarHBondContact O-N 2.92Å; E225-N229 WeakPolarHBondContact O-CB 3.31Å; E225-N229 PolarHBondContact O-N 3.07Å; E225-N229 PolarHBondContact O-ND2 3Å
226	W	89.3	Confident	81.5	Confident	28 Å²	28	48.3 Å²	48.3	11%	0.106	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-47	174.1	-176.9	79.3	0	0	0	112.3	Y194 L198 I201 I204 I207 S222 L223 K224 E228 N229 I230	Y194-W226 HydrophobicContact CD2-CB 4.38Å; Y194-W226 AromaticContact CD2-CD1 3.82Å; Y194-W226 HydrophobicContact CD2-CG 4.37Å; Y194-W226 AromaticContact CE2-CD1 3.81Å; L198-W226 HydrophobicContact CB-CD2 4.15Å; L198-W226 HydrophobicContact CB-CG 4.21Å; L198-W226 HydrophobicContact CB-CZ2 4.43Å; L198-W226 HydrophobicContact CD1-CB 4.12Å; L198-W226 HydrophobicContact CD1-CD2 3.89Å; L198-W226 HydrophobicContact CD1-CE3 4.02Å; L198-W226 HydrophobicContact CD1-CG 3.95Å; L198-W226 HydrophobicContact CD2-CD2 4.07Å; L198-W226 HydrophobicContact CD2-CE3 3.98Å; L198-W226 HydrophobicContact CD2-CH2 3.85Å; L198-W226 HydrophobicContact CD2-CZ2 3.93Å; L198-W226 HydrophobicContact CD2-CZ3 3.88Å; L198-W226 HydrophobicContact CG-CD2 4.27Å; I201-W226 HydrophobicContact CD1-CH2 4.09Å; I201-W226 HydrophobicContact CD1-CZ2 3.98Å; I201-W226 HydrophobicContact CG1-CZ2 4.11Å; I204-W226 HydrophobicContact CG2-CH2 3.9Å; I204-W226 HydrophobicContact CG2-CZ2 3.74Å; I207-W226 HydrophobicContact CD1-CH2 3.68Å; I207-W226 HydrophobicContact CD1-CZ3 3.86Å; I207-W226 HydrophobicContact CG2-CH2 4.06Å; I207-W226 HydrophobicContact CG2-CZ3 4.03Å; S222-W226 VanDerWaalsContact O-CB 3.26Å; S222-W226 WeakPolarHBondContact O-CB 3.35Å; S222-W226 PolarHBondContact O-N 2.97Å; L223-W226 HydrophobicContact CD1-CE3 4.03Å; L223-W226 HydrophobicContact CD1-CZ3 4.46Å; L223-W226 PolarHBondContact O-N 3.41Å; K224-W226 VanDerWaalsContact C-N 3.3Å; K224-W226 PolarHBondContact O-N 3.44Å; W226-E228 VanDerWaalsContact C-N 3.26Å; W226-E228 PolarHBondContact O-N 3.32Å; W226-N229 CarbonylContact O-C 3.16Å; W226-N229 PolarHBondContact O-N 3.08Å; W226-N229 VanDerWaalsContact O-N 3.13Å; W226-I230 HydrophobicContact CE3-CD1 4.25Å; W226-I230 HydrophobicContact CH2-CD1 3.62Å; W226-I230 HydrophobicContact CZ2-CD1 3.99Å; W226-I230 HydrophobicContact CZ3-CD1 3.76Å; W226-I230 WeakPolarHBondContact O-CB 3.09Å; W226-I230 PolarHBondContact O-N 3.03Å
227	L	87.6	Confident	80.2	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-25.3	177.3	-70.6	177.7	0	0	0	113.8	L223 K224 I230 I236 V239 L252	L223-L227 HydrophobicContact CD1-CD1 4.11Å; L223-L227 HydrophobicContact CD1-CG 4.06Å; L223-L227 HydrophobicContact CG-CD1 4.01Å; L223-L227 HydrophobicContact CG-CG 4.35Å; L223-L227 WeakPolarHBondContact O-CB 3.19Å; L223-L227 VanDerWaalsContact O-CG 3.27Å; L223-L227 WeakPolarHBondContact O-CG 3.25Å; L223-L227 PolarHBondContact O-N 3.37Å; K224-L227 PolarHBondContact O-N 3.44Å; L227-I230 HydrophobicContact CD2-CD1 4.39Å; L227-I230 VanDerWaalsContact O-CG2 3.24Å; L227-I230 WeakPolarHBondContact O-CG2 3.23Å; L227-I236 HydrophobicContact CD1-CG2 4.4Å; L227-I236 HydrophobicContact CD2-CD1 4.42Å; L227-I236 HydrophobicContact CD2-CG1 4.32Å; L227-I236 HydrophobicContact CD2-CG2 3.7Å; L227-V239 HydrophobicContact CD1-CG2 3.86Å; L227-L252 HydrophobicContact CD1-CD2 4.32Å
228	E	84.6	Confident	79.3	Confident	114 Å²	114	48.8 Å²	48.8	53%	0.533	25%	0.249	S	C	.	.	H	α-helix	trans	-81	-23.9	174	-74	176.7	-171.1	0	0	113.2	K224 E225 W226	K224-E228 WeakPolarHBondContact CE-OE1 3.49Å; K224-E228 WeakPolarHBondContact CG-OE1 3.4Å; K224-E228 IonicContact NZ-OE1 3.8Å; K224-E228 PolarHBondContact NZ-OE1 3Å; K224-E228 WeakPolarHBondContact O-CB 3.43Å; K224-E228 WeakPolarHBondContact O-CG 3.22Å; K224-E228 PolarHBondContact O-N 3.34Å; E225-E228 PolarHBondContact O-N 2.92Å; W226-E228 VanDerWaalsContact C-N 3.26Å; W226-E228 PolarHBondContact O-N 3.32Å
229	N	83.3	Confident	79.1	Confident	139 Å²	139	46.2 Å²	46.2	74%	0.743	23%	0.231	S	C	*	.	H	α-helix	trans	-102.9	-10.6	179.6	-72.6	-74	0	0	0	114.5	E225 W226	E225-N229 WeakPolarHBondContact O-CB 3.31Å; E225-N229 PolarHBondContact O-N 3.07Å; E225-N229 PolarHBondContact O-ND2 3Å; W226-N229 CarbonylContact O-C 3.16Å; W226-N229 PolarHBondContact O-N 3.08Å; W226-N229 VanDerWaalsContact O-N 3.13Å
230	I	78.7	Confident	78.7	Confident	14 Å²	14	42.2 Å²	42.2	7%	0.072	21%	0.211	C	C	.	.	S	Bend	trans	-54.9	148.5	176.2	-155.4	168.9	0	0	0	110.7	I204 I207 W226 L227 K232 A234 I236	I204-I230 HydrophobicContact CG2-CD1 3.84Å; I204-I230 HydrophobicContact CG2-CG1 4.16Å; I207-I230 HydrophobicContact CG2-CD1 4.36Å; W226-I230 HydrophobicContact CE3-CD1 4.25Å; W226-I230 HydrophobicContact CH2-CD1 3.62Å; W226-I230 HydrophobicContact CZ2-CD1 3.99Å; W226-I230 HydrophobicContact CZ3-CD1 3.76Å; W226-I230 WeakPolarHBondContact O-CB 3.09Å; W226-I230 PolarHBondContact O-N 3.03Å; L227-I230 HydrophobicContact CD2-CD1 4.39Å; L227-I230 VanDerWaalsContact O-CG2 3.24Å; L227-I230 WeakPolarHBondContact O-CG2 3.23Å; I230-K232 PolarHBondContact O-N 3.05Å; I230-A234 HydrophobicContact CD1-CB 3.98Å; I230-A234 HydrophobicContact CG1-CB 3.89Å; I230-I236 HydrophobicContact CD1-CG1 4.48Å; I230-I236 HydrophobicContact CG2-CD1 3.52Å; I230-I236 HydrophobicContact CG2-CG1 4.18Å
231	P	67.4	Low	78.4	Confident	58 Å²	58	42.3 Å²	42.3	38%	0.377	21%	0.212	S	C	.	.			trans	-52.7	130.4	177	-28.7	36	0	0	0	111.1	N233 A234	P231-N233 WeakPolarHBondContact CB-OD1 3.4Å; P231-N233 PolarHBondContact O-N 2.84Å; P231-A234 VanDerWaalsContact O-CB 3.28Å; P231-A234 WeakPolarHBondContact O-CB 3.46Å; P231-A234 PolarHBondContact O-N 2.91Å
232	K	57.7	Low	78.2	Confident	193 Å²	193	46.7 Å²	46.7	84%	0.839	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-10.2	-172	-64.5	-178.9	179.9	177.4	0	114.3	I230 R474	I230-K232 PolarHBondContact O-N 3.05Å; K232-R474 VanDerWaalsContact O-CZ 3.27Å; K232-R474 PolarHBondContact O-NH1 3.31Å; K232-R474 PolarHBondContact O-NH2 3.14Å
233	N	54	Low	77.8	Confident	14 Å²	14	45.8 Å²	45.8	8%	0.075	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-14.4	174.4	53.5	-68.6	0	0	0	114.7	P231 S497 I522	P231-N233 WeakPolarHBondContact CB-OD1 3.4Å; P231-N233 PolarHBondContact O-N 2.84Å; N233-S497 VanDerWaalsContact CB-CB 3.41Å; N233-S497 VanDerWaalsContact CB-OG 3.31Å; N233-S497 WeakPolarHBondContact CB-OG 3.37Å; N233-I522 HydrophobicContact CB-CD1 3.94Å; N233-I522 WeakPolarHBondContact ND2-CG2 3.26Å; N233-I522 WeakPolarHBondContact OD1-CD1 3.33Å
234	A	62	Low	77.6	Confident	5 Å²	5	48 Å²	48	4%	0.041	24%	0.242	C	C	.	.	S	Bend	trans	-63.9	140.6	171	0	0	0	0	0	109.7	A205 I230 P231	A205-A234 CarbonylContact O-C 3.23Å; A205-A234 WeakPolarHBondContact O-CA 3.21Å; I230-A234 HydrophobicContact CD1-CB 3.98Å; I230-A234 HydrophobicContact CG1-CB 3.89Å; P231-A234 VanDerWaalsContact O-CB 3.28Å; P231-A234 WeakPolarHBondContact O-CB 3.46Å; P231-A234 PolarHBondContact O-N 2.91Å
235	L	59.1	Low	77.3	Confident	11 Å²	11	53.6 Å²	53.6	6%	0.058	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	117.6	175.1	-169.4	70.2	0	0	0	108.9	A205 E206 I207 Y451 I475	A205-L235 PolarHBondContact O-N 2.99Å; E206-L235 WeakPolarHBondContact CA-O 3.23Å; E206-L235 HydrophobicContact CB-CB 4.3Å; E206-L235 HydrophobicContact CG-CB 4.31Å; E206-L235 HydrophobicContact CG-CD2 4.07Å; E206-L235 WeakPolarHBondContact OE1-CD2 3.41Å; I207-L235 PolarHBondContact N-O 2.86Å; L235-Y451 HydrophobicContact CD2-CD2 3.47Å; L235-Y451 VanDerWaalsContact CD2-CD2 3.47Å; L235-Y451 HydrophobicContact CD2-CE2 4.2Å; L235-Y451 HydrophobicContact CD2-CG 3.74Å; L235-I475 HydrophobicContact CB-CD1 3.85Å
236	I	75.5	Confident	77.2	Confident	51 Å²	51	56.2 Å²	56.2	26%	0.262	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.5	-173.5	-58.5	168.2	0	0	0	108.6	L227 I230	L227-I236 HydrophobicContact CD1-CG2 4.4Å; L227-I236 HydrophobicContact CD2-CD1 4.42Å; L227-I236 HydrophobicContact CD2-CG1 4.32Å; L227-I236 HydrophobicContact CD2-CG2 3.7Å; I230-I236 HydrophobicContact CD1-CG1 4.48Å; I230-I236 HydrophobicContact CG2-CD1 3.52Å; I230-I236 HydrophobicContact CG2-CG1 4.18Å
237	G	63.5	Low	77.1	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.279	C	S	.	.			trans	-69.2	144.8	167.7	0	0	0	0	0	111.9	I207 E210 V239	I207-G237 PolarHBondContact O-N 3.31Å; E210-G237 VanDerWaalsContact CD-CA 3.47Å; E210-G237 WeakPolarHBondContact OE1-CA 3.45Å; E210-G237 VanDerWaalsContact OE2-CA 3.32Å; E210-G237 WeakPolarHBondContact OE2-CA 3.36Å; G237-V239 PolarHBondContact O-N 3.1Å
238	R	74.5	Confident	76.9	Confident	58 Å²	58	60 Å²	60	22%	0.219	30%	0.302	C	S	.	.			trans	-70.8	119.8	-173.8	-69.8	178	-67.3	170	1.7	112	E210 V240 S353 E379	E210-R238 VanDerWaalsContact CD-N 3.26Å; E210-R238 HydrophobicContact CG-CB 4.41Å; E210-R238 PolarHBondContact OE1-N 3.13Å; R238-V240 PolarHBondContact O-N 3.05Å; R238-S353 PolarHBondContact NH1-OG 2.94Å; R238-E379 IonicContact NH2-OE1 3.89Å; R238-E379 PolarHBondContact NH2-OE1 3.07Å
239	V	86.6	Confident	76.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.293	C	S	.	.			trans	-90.4	95.4	174.5	-177	0	0	0	0	108.9	L209 W214 L220 L223 L227 G237 L252	L209-V239 HydrophobicContact CB-CG2 3.89Å; L209-V239 HydrophobicContact CD1-CG2 3.68Å; L209-V239 HydrophobicContact CG-CG2 4.45Å; W214-V239 HydrophobicContact CB-CG1 4.24Å; W214-V239 HydrophobicContact CD2-CG1 3.91Å; W214-V239 HydrophobicContact CG-CG1 3.67Å; L220-V239 HydrophobicContact CD2-CG1 4.43Å; L223-V239 HydrophobicContact CD2-CG1 4.39Å; L223-V239 HydrophobicContact CD2-CG2 4.4Å; L227-V239 HydrophobicContact CD1-CG2 3.86Å; G237-V239 PolarHBondContact O-N 3.1Å; V239-L252 HydrophobicContact CB-CB 3.89Å; V239-L252 HydrophobicContact CB-CD2 4.08Å; V239-L252 HydrophobicContact CG1-CB 3.91Å; V239-L252 HydrophobicContact CG1-CD2 3.69Å; V239-L252 HydrophobicContact CG1-CG 4.4Å; V239-L252 WeakPolarHBondContact O-CB 3.49Å; V239-L252 PolarHBondContact O-N 2.96Å
240	V	81.6	Confident	76	Confident	33 Å²	33	52.3 Å²	52.3	20%	0.2	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-95.6	127	176.4	-176.8	0	0	0	0	109.6	R238 E242	R238-V240 PolarHBondContact O-N 3.05Å; V240-E242 PolarHBondContact O-N 2.73Å
241	C	86.1	Confident	76.1	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.014	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	129.1	179.3	-58.2	0	0	0	0	111.7	C216 L247 Q248 G249 K250	C216-C241 HydrophobicContact CB-CB 3.74Å; C216-C241 WeakPolarHBondContact CB-SG 3.09Å; C216-C241 WeakPolarHBondContact SG-CA 3.34Å; C216-C241 WeakPolarHBondContact SG-CB 3.34Å; C216-C241 CovalentContact SG-SG 2.02Å; C216-C241 PolarHBondContact SG-SG 3.48Å; C241-L247 HydrophobicContact CB-CB 4.14Å; C241-L247 WeakPolarHBondContact CB-O 3.45Å; C241-Q248 CarbonylContact O-C 3.59Å; C241-Q248 WeakPolarHBondContact O-CA 3.3Å; C241-G249 PolarHBondContact O-N 2.86Å; C241-K250 PolarHBondContact N-O 3.26Å
242	E	86.6	Confident	77.1	Confident	106 Å²	106	50.4 Å²	50.4	50%	0.495	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-39.9	165.2	-168.9	179.2	159.1	0	0	111	P213 W214 V240 Q248	P213-E242 WeakPolarHBondContact CA-OE2 3.29Å; P213-E242 VanDerWaalsContact CB-OE2 3.24Å; P213-E242 WeakPolarHBondContact CB-OE2 3.22Å; W214-E242 PolarHBondContact O-N 3.25Å; V240-E242 PolarHBondContact O-N 2.73Å; E242-Q248 WeakPolarHBondContact O-CB 3.25Å; E242-Q248 VanDerWaalsContact O-CG 3.31Å; E242-Q248 WeakPolarHBondContact O-CG 3.3Å
243	A	82.2	Confident	78.3	Confident	29 Å²	29	44.9 Å²	44.9	24%	0.24	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	161.9	174	0	0	0	0	0	110.8	W214 D215 C216	W214-A243 PolarHBondContact O-N 2.91Å; D215-A243 HydrophobicContact CB-CB 4.33Å; D215-A243 VanDerWaalsContact OD1-CB 3.27Å; D215-A243 WeakPolarHBondContact OD1-CB 3.46Å; C216-A243 WeakPolarHBondContact CB-O 3.46Å; C216-A243 PolarHBondContact N-O 3.21Å
244	P	89.6	Confident	79.7	Confident	47 Å²	47	50.9 Å²	50.9	31%	0.305	26%	0.264	S	S	.	.	S	Bend	cis	-67.9	162.8	-17.2	31.9	-35.9	0	0	0	111.1	C216 R246 L247 Q248	C216-P244 WeakPolarHBondContact O-CD 3.48Å; P244-R246 PolarHBondContact O-N 3.01Å; P244-L247 PolarHBondContact O-N 3.13Å; P244-Q248 PolarHBondContact O-N 2.84Å
245	T	84.4	Confident	80.8	Confident	127 Å²	127	51 Å²	51	78%	0.779	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-16.4	-175.7	53.1	0	0	0	0	115.5
246	R	87.7	Confident	82.2	Confident	144 Å²	144	53.8 Å²	53.8	54%	0.543	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-28.9	172.6	-166.4	-171.3	71.5	80.7	-4.5	113.4	P244 D259	P244-R246 PolarHBondContact O-N 3.01Å; R246-D259 IonicContact CZ-OD1 3.01Å; R246-D259 VanDerWaalsContact CZ-OD1 3.22Å; R246-D259 IonicContact NH1-OD1 2.7Å; R246-D259 PolarHBondContact NH1-OD1 3.29Å; R246-D259 VanDerWaalsContact NH2-C 3.29Å; R246-D259 PolarHBondContact NH2-O 2.65Å; R246-D259 IonicContact NH2-OD1 3.71Å; R246-D259 PolarHBondContact NH2-OD1 3.01Å
247	L	87.1	Confident	82.7	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.031	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-2	-176.1	-67.8	176.4	0	0	0	112.9	C216 C241 P244 G249 K250 T255 D259 L260	C216-L247 HydrophobicContact CB-CD1 3.91Å; C216-L247 WeakPolarHBondContact O-CD1 3.49Å; C241-L247 HydrophobicContact CB-CB 4.14Å; C241-L247 WeakPolarHBondContact CB-O 3.45Å; P244-L247 PolarHBondContact O-N 3.13Å; L247-G249 PolarHBondContact O-N 2.99Å; L247-K250 HydrophobicContact CD2-CD 4.09Å; L247-K250 WeakPolarHBondContact O-CB 3.38Å; L247-K250 PolarHBondContact O-N 3.49Å; L247-T255 HydrophobicContact CD2-CG2 4.4Å; L247-D259 HydrophobicContact CD2-CB 4.27Å; L247-L260 HydrophobicContact CD1-CD2 4.13Å
248	Q	83.1	Confident	83.8	Confident	109 Å²	109	58.8 Å²	58.8	51%	0.509	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	124.1	-175.7	-174.1	170.7	35.3	0	0	112.5	C241 E242 P244	C241-Q248 CarbonylContact O-C 3.59Å; C241-Q248 WeakPolarHBondContact O-CA 3.3Å; E242-Q248 WeakPolarHBondContact O-CB 3.25Å; E242-Q248 VanDerWaalsContact O-CG 3.31Å; E242-Q248 WeakPolarHBondContact O-CG 3.3Å; P244-Q248 PolarHBondContact O-N 2.84Å
249	G	73.4	Confident	84.4	Confident	34 Å²	34	57.4 Å²	57.4	35%	0.351	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	2.8	-177.6	0	0	0	0	0	115.5	C241 L247	C241-G249 PolarHBondContact O-N 2.86Å; L247-G249 PolarHBondContact O-N 2.99Å
250	K	75.4	Confident	84.5	Confident	58 Å²	58	57.7 Å²	57.7	25%	0.252	30%	0.302	S	S	.	.			trans	-89.3	143.8	172.4	-172	172.6	169.9	-179.5	0	110.8	C241 L247 E254 T255 D259	C241-K250 PolarHBondContact N-O 3.26Å; L247-K250 HydrophobicContact CD2-CD 4.09Å; L247-K250 WeakPolarHBondContact O-CB 3.38Å; L247-K250 PolarHBondContact O-N 3.49Å; K250-E254 WeakPolarHBondContact CE-O 3.44Å; K250-E254 HydrophobicContact CG-CB 4.32Å; K250-E254 PolarHBondContact NZ-O 2.66Å; K250-T255 HydrophobicContact CD-CG2 4.05Å; K250-T255 HydrophobicContact CG-CG2 4.31Å; K250-D259 IonicContact NZ-OD2 3.22Å; K250-D259 PolarHBondContact NZ-OD2 3.29Å
251	D	80.5	Confident	84.8	Confident	31 Å²	31	56.3 Å²	56.3	17%	0.166	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-76.8	136.6	173	-168.8	-62.6	0	0	0	110.5	N253 E254 T255	D251-N253 PolarHBondContact O-N 2.93Å; D251-N253 VanDerWaalsContact OD1-CB 3.3Å; D251-N253 WeakPolarHBondContact OD1-CB 3.08Å; D251-N253 PolarHBondContact OD1-N 3.12Å; D251-N253 PolarHBondContact OD1-ND2 3.26Å; D251-E254 HydrophobicContact CB-CG 4.28Å; D251-E254 WeakPolarHBondContact O-CB 3.28Å; D251-E254 PolarHBondContact O-N 3.41Å; D251-T255 PolarHBondContact O-N 3.27Å
252	L	88.3	Confident	84.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-57.4	-32.4	-179.5	-174.3	62.5	0	0	0	112.6	L220 L223 K224 L227 V239 E254 T255 L260	L220-L252 HydrophobicContact CD2-CD1 3.99Å; L220-L252 HydrophobicContact CD2-CD2 4.12Å; L220-L252 HydrophobicContact CG-CD2 4.28Å; L223-L252 HydrophobicContact CD2-CD2 4.35Å; L223-L252 HydrophobicContact CG-CD2 4.35Å; K224-L252 HydrophobicContact CB-CD1 4.21Å; K224-L252 HydrophobicContact CB-CD2 4.05Å; K224-L252 HydrophobicContact CB-CG 4.06Å; K224-L252 HydrophobicContact CD-CD1 4.29Å; K224-L252 HydrophobicContact CD-CG 4.47Å; K224-L252 HydrophobicContact CG-CG 4.33Å; K224-L252 PolarHBondContact NZ-O 3.35Å; L227-L252 HydrophobicContact CD1-CD2 4.32Å; V239-L252 HydrophobicContact CB-CB 3.89Å; V239-L252 HydrophobicContact CB-CD2 4.08Å; V239-L252 HydrophobicContact CG1-CB 3.91Å; V239-L252 HydrophobicContact CG1-CD2 3.69Å; V239-L252 HydrophobicContact CG1-CG 4.4Å; V239-L252 WeakPolarHBondContact O-CB 3.49Å; V239-L252 PolarHBondContact O-N 2.96Å; L252-E254 VanDerWaalsContact C-N 3.27Å; L252-E254 PolarHBondContact O-N 3.36Å; L252-T255 PolarHBondContact O-N 2.8Å; L252-T255 PolarHBondContact O-OG1 3.49Å; L252-L260 HydrophobicContact CD1-CD1 3.94Å; L252-L260 HydrophobicContact CD1-CD2 4.02Å
253	N	84	Confident	83.7	Confident	77 Å²	77	61 Å²	61	41%	0.412	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-68.3	-26	176.9	-62.2	-55.6	0	0	0	112.5	D251	D251-N253 PolarHBondContact O-N 2.93Å; D251-N253 VanDerWaalsContact OD1-CB 3.3Å; D251-N253 WeakPolarHBondContact OD1-CB 3.08Å; D251-N253 PolarHBondContact OD1-N 3.12Å; D251-N253 PolarHBondContact OD1-ND2 3.26Å
254	E	83.4	Confident	82.6	Confident	141 Å²	141	65 Å²	65	66%	0.659	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-85.2	-9.1	175.1	-61.5	-173.8	165.7	0	0	113	K250 D251 L252	K250-E254 WeakPolarHBondContact CE-O 3.44Å; K250-E254 HydrophobicContact CG-CB 4.32Å; K250-E254 PolarHBondContact NZ-O 2.66Å; D251-E254 HydrophobicContact CB-CG 4.28Å; D251-E254 WeakPolarHBondContact O-CB 3.28Å; D251-E254 PolarHBondContact O-N 3.41Å; L252-E254 VanDerWaalsContact C-N 3.27Å; L252-E254 PolarHBondContact O-N 3.36Å
255	T	84.8	Confident	80.6	Confident	6 Å²	6	68.7 Å²	68.7	4%	0.037	36%	0.355	C	S	.	.			trans	-78.6	152.8	175.2	70.4	0	0	0	0	111.9	K224 L247 K250 D251 L252 L260	K224-T255 WeakPolarHBondContact CE-O 3.5Å; K224-T255 PolarHBondContact NZ-O 3.08Å; L247-T255 HydrophobicContact CD2-CG2 4.4Å; K250-T255 HydrophobicContact CD-CG2 4.05Å; K250-T255 HydrophobicContact CG-CG2 4.31Å; D251-T255 PolarHBondContact O-N 3.27Å; L252-T255 PolarHBondContact O-N 2.8Å; L252-T255 PolarHBondContact O-OG1 3.49Å; T255-L260 HydrophobicContact CG2-CD2 4.46Å
256	T	87.5	Confident	78.7	Confident	70 Å²	70	72.4 Å²	72.4	43%	0.429	36%	0.355	S	S	.	.			trans	-99.1	164.8	166.3	64.8	0	0	0	0	110.7	Q258 D259 L260	T256-Q258 PolarHBondContact O-N 3.07Å; T256-D259 VanDerWaalsContact O-CB 3.27Å; T256-D259 WeakPolarHBondContact O-CB 3.14Å; T256-D259 PolarHBondContact O-N 3.1Å; T256-D259 PolarHBondContact OG1-N 3.43Å; T256-D259 VanDerWaalsContact OG1-N 3.13Å; T256-L260 PolarHBondContact O-N 3.15Å
257	E	87.4	Confident	76.8	Confident	67 Å²	67	71.9 Å²	71.9	31%	0.313	37%	0.367	S	S	.	.	H	α-helix	trans	-55.4	-39.3	170.9	-175.7	-164.5	-167.4	0	0	111.5	L221 D259 L260 C261 K264	L221-E257 HydrophobicContact CD1-CB 4.4Å; L221-E257 HydrophobicContact CD1-CG 4.01Å; L221-E257 HydrophobicContact CD2-CG 4.05Å; E257-D259 VanDerWaalsContact C-N 3.28Å; E257-D259 PolarHBondContact O-N 2.97Å; E257-L260 PolarHBondContact O-N 3.29Å; E257-C261 WeakPolarHBondContact O-CA 3.29Å; E257-C261 WeakPolarHBondContact O-CB 3.02Å; E257-C261 PolarHBondContact O-N 3.05Å; E257-K264 WeakPolarHBondContact OE1-CD 3.38Å; E257-K264 WeakPolarHBondContact OE1-CE 3Å; E257-K264 IonicContact OE1-NZ 3.98Å; E257-K264 PolarHBondContact OE1-NZ 2.9Å
258	Q	85.8	Confident	74.5	Confident	90 Å²	90	78.1 Å²	78.1	42%	0.421	40%	0.401	S	S	.	.	H	α-helix	trans	-74.7	-17.8	179.5	-57.7	74.4	30.4	0	0	112.8	T256	T256-Q258 PolarHBondContact O-N 3.07Å
259	D	86.3	Confident	72.7	Confident	29 Å²	29	77.9 Å²	77.9	16%	0.155	41%	0.411	C	S	.	.	H	α-helix	trans	-68.5	-46.6	168.1	-106.3	-20.3	0	0	0	110.2	R246 L247 K250 T256 E257	R246-D259 IonicContact CZ-OD1 3.01Å; R246-D259 VanDerWaalsContact CZ-OD1 3.22Å; R246-D259 IonicContact NH1-OD1 2.7Å; R246-D259 PolarHBondContact NH1-OD1 3.29Å; R246-D259 VanDerWaalsContact NH2-C 3.29Å; R246-D259 PolarHBondContact NH2-O 2.65Å; R246-D259 IonicContact NH2-OD1 3.71Å; R246-D259 PolarHBondContact NH2-OD1 3.01Å; L247-D259 HydrophobicContact CD2-CB 4.27Å; K250-D259 IonicContact NZ-OD2 3.22Å; K250-D259 PolarHBondContact NZ-OD2 3.29Å; T256-D259 VanDerWaalsContact O-CB 3.27Å; T256-D259 WeakPolarHBondContact O-CB 3.14Å; T256-D259 PolarHBondContact O-N 3.1Å; T256-D259 PolarHBondContact OG1-N 3.43Å; T256-D259 VanDerWaalsContact OG1-N 3.13Å; E257-D259 VanDerWaalsContact C-N 3.28Å; E257-D259 PolarHBondContact O-N 2.97Å
260	L	88.6	Confident	71.4	Confident	5 Å²	5	81.7 Å²	81.7	3%	0.026	43%	0.432	C	S	.	.	H	α-helix	trans	-75.9	-39.5	-179.8	-59.7	178.2	0	0	0	112.6	C216 T217 C218 L221 K224 L247 L252 T255 T256 E257 P262	C216-L260 HydrophobicContact CB-CD2 3.64Å; C216-L260 WeakPolarHBondContact O-CD2 3.24Å; T217-L260 CarbonylContact C-O 3.57Å; C218-L260 PolarHBondContact N-O 3.04Å; L221-L260 HydrophobicContact CD1-CD1 4.2Å; K224-L260 HydrophobicContact CB-CD1 4.35Å; K224-L260 HydrophobicContact CD-CD1 3.67Å; L247-L260 HydrophobicContact CD1-CD2 4.13Å; L252-L260 HydrophobicContact CD1-CD1 3.94Å; L252-L260 HydrophobicContact CD1-CD2 4.02Å; T255-L260 HydrophobicContact CG2-CD2 4.46Å; T256-L260 PolarHBondContact O-N 3.15Å; E257-L260 PolarHBondContact O-N 3.29Å; L260-P262 VanDerWaalsContact C-CD 3.41Å; L260-P262 VanDerWaalsContact O-CD 3.3Å; L260-P262 WeakPolarHBondContact O-CD 3.32Å
261	C	89.3	Confident	69.6	Low	4 Å²	4	87.1 Å²	87.1	3%	0.027	46%	0.463	C	S	.	.			trans	-120.5	65	-175.2	-74.4	0	0	0	0	113.6	C218 E257 L263 K264	C218-C261 WeakPolarHBondContact CA-SG 3.32Å; C218-C261 HydrophobicContact CB-CB 4.5Å; C218-C261 WeakPolarHBondContact CB-SG 3.25Å; C218-C261 WeakPolarHBondContact SG-CA 3.23Å; C218-C261 WeakPolarHBondContact SG-CB 3.39Å; C218-C261 CovalentContact SG-SG 2.04Å; C218-C261 PolarHBondContact SG-SG 3.33Å; E257-C261 WeakPolarHBondContact O-CA 3.29Å; E257-C261 WeakPolarHBondContact O-CB 3.02Å; E257-C261 PolarHBondContact O-N 3.05Å; C261-L263 PolarHBondContact O-N 3.21Å; C261-K264 HydrophobicContact CB-CB 4.17Å; C261-K264 HydrophobicContact CB-CD 4.22Å; C261-K264 PolarHBondContact O-N 3.18Å
262	P	78.9	Confident	67.6	Low	82 Å²	82	91.5 Å²	91.5	53%	0.532	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-8.4	177.9	28.1	-36.3	0	0	0	114.4	L260	L260-P262 VanDerWaalsContact C-CD 3.41Å; L260-P262 VanDerWaalsContact O-CD 3.3Å; L260-P262 WeakPolarHBondContact O-CD 3.32Å
263	L	70.4	Confident	65.1	Low	124 Å²	124	95.7 Å²	95.7	65%	0.649	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-19.9	177.6	-72.4	168.5	0	0	0	114.3	C261 N265 R266	C261-L263 PolarHBondContact O-N 3.21Å; L263-N265 PolarHBondContact O-N 2.04Å; L263-R266 PolarHBondContact O-N 3.21Å
264	K	58.6	Low	62.8	Low	114 Å²	114	97.6 Å²	97.6	50%	0.496	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-57.6	-36.8	-178.4	-123.7	174.7	176.6	177	0	111.5	E257 C261 R266	E257-K264 WeakPolarHBondContact OE1-CD 3.38Å; E257-K264 WeakPolarHBondContact OE1-CE 3Å; E257-K264 IonicContact OE1-NZ 3.98Å; E257-K264 PolarHBondContact OE1-NZ 2.9Å; C261-K264 HydrophobicContact CB-CB 4.17Å; C261-K264 HydrophobicContact CB-CD 4.22Å; C261-K264 PolarHBondContact O-N 3.18Å; K264-R266 PolarHBondContact O-N 2.86Å
265	N	47.3	Very low	60.5	Low	124 Å²	124	96 Å²	96	66%	0.663	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-92.4	18.4	178.7	-66	4.4	0	0	0	114.2	L263	L263-N265 PolarHBondContact O-N 2.04Å
266	R	44.3	Very low	58.3	Low	205 Å²	205	100.9 Å²	100.9	77%	0.774	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-106.9	3.4	173.4	-90.1	-166.4	174.4	-159.7	-0.2	114.6	L263 K264	L263-R266 PolarHBondContact O-N 3.21Å; K264-R266 PolarHBondContact O-N 2.86Å
267	V	47.3	Very low	55.6	Low	134 Å²	134	105.9 Å²	105.9	81%	0.812	61%	0.606	S	S	*	*			trans	-107.3	69.8	172.9	-169.3	0	0	0	0	109.9
268	D	39.8	Very low	52.9	Low	137 Å²	137	111.5 Å²	111.5	73%	0.733	63%	0.632	S	S	*	*	S	Bend	trans	-148.2	144.5	148.6	-149.5	-33.2	0	0	0	110.8
269	S	44.6	Very low	50.2	Low	103 Å²	103	115.8 Å²	115.8	72%	0.72	65%	0.652	S	S	*	*	S	Bend	trans	51.9	72.9	158.4	-65.6	0	0	0	0	118.6
270	S	45.8	Very low	47.4	Very low	115 Å²	115	120.9 Å²	120.9	80%	0.804	68%	0.684	S	S	*	*	S	Bend	trans	171.4	29.1	138.6	48.4	0	0	0	0	117.9
271	L	37.9	Very low	44.4	Very low	172 Å²	172	129.5 Å²	129.5	90%	0.901	72%	0.722	S	S	*	*			trans	-125	122.5	166.4	-72.5	175.6	0	0	0	111.5
272	P	38.4	Very low	41.6	Very low	122 Å²	122	133.1 Å²	133.1	79%	0.792	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-73.9	147.5	175.6	31.2	-33.9	0	0	0	111
273	A	36.4	Very low	39.6	Very low	88 Å²	88	135 Å²	135	73%	0.727	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-61.7	141.5	175.6	0	0	0	0	0	111.3
274	P	36.1	Very low	37.8	Very low	117 Å²	117	132 Å²	132	76%	0.76	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-58.7	139.7	167.6	-20.2	32.4	0	0	0	110.2	A276	P274-A276 PolarHBondContact O-N 2.98Å
275	P	34	Very low	36.5	Very low	109 Å²	109	133 Å²	133	71%	0.708	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.3	135.7	176.1	28.4	-34	0	0	0	110	Q277	P275-Q277 PolarHBondContact O-N 3.43Å
276	A	38.4	Very low	35.6	Very low	107 Å²	107	135 Å²	135	88%	0.884	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-63.2	127.1	165.2	0	0	0	0	0	109	P274	P274-A276 PolarHBondContact O-N 2.98Å
277	Q	32.4	Very low	35.4	Very low	176 Å²	176	129.8 Å²	129.8	82%	0.822	78%	0.783	S	S	*	*			trans	-129.3	149.4	169.6	-67.3	-158.7	-55.3	0	0	109.7	P275	P275-Q277 PolarHBondContact O-N 3.43Å
278	E	29.3	Very low	34.9	Very low	184 Å²	184	129.4 Å²	129.4	86%	0.86	78%	0.781	S	S	*	*			trans	-70.8	146.7	-154.8	-63.9	151.1	121.7	0	0	113.8	T280	E278-T280 PolarHBondContact O-N 3.12Å
279	E	30.8	Very low	34.6	Very low	181 Å²	181	128.8 Å²	128.8	85%	0.846	79%	0.785	S	S	*	*			trans	-69	121.1	168	-66.4	-170.9	153.9	0	0	110.5
280	T	26.3	Very low	33.9	Very low	136 Å²	136	133 Å²	133	83%	0.834	79%	0.791	S	S	*	*			trans	-123	96.8	168.9	-24.2	0	0	0	0	111.1	E278	E278-T280 PolarHBondContact O-N 3.12Å
281	F	26.3	Very low	32.9	Very low	186 Å²	186	137.2 Å²	137.2	82%	0.816	80%	0.795	S	S	*	*			trans	-54.2	151.9	160	-90.9	-102.1	0	0	0	110.5
282	A	30.1	Very low	32.4	Very low	80 Å²	80	134.4 Å²	134.4	66%	0.661	79%	0.785	S	S	*	*			cis	-159.6	-158	8.8	0	0	0	0	0	108
283	P	37.8	Very low	31.7	Very low	122 Å²	122	136.1 Å²	136.1	79%	0.792	79%	0.787	S	S	*	*			cis	-129.5	159.1	-19.4	37.2	-21.4	0	0	0	114.6
284	G	32.4	Very low	31.2	Very low	59 Å²	59	135.6 Å²	135.6	61%	0.608	79%	0.79	S	S	*	*			trans	-105.9	141.7	162.4	0	0	0	0	0	111.8
285	P	31.4	Very low	30.7	Very low	135 Å²	135	138.6 Å²	138.6	88%	0.877	79%	0.794	S	S	*	*			trans	-70.4	146.2	173.1	-19.7	33.6	0	0	0	113.7
286	L	27.8	Very low	30.2	Very low	167 Å²	167	140.3 Å²	140.3	87%	0.874	79%	0.793	S	S	*	*			trans	-88.2	170.9	-179.1	-99.3	85.1	0	0	0	114.3
287	P	40.6	Very low	29.6	Very low	95 Å²	95	141.7 Å²	141.7	62%	0.617	79%	0.785	S	S	*	*			trans	-116.3	169.3	-159.9	44.1	-37.1	0	0	0	116.8
288	T	37	Very low	29.3	Very low	126 Å²	126	142.1 Å²	142.1	77%	0.773	79%	0.787	S	S	*	*			trans	67.7	165.3	165.7	74.8	0	0	0	0	116.5
289	P	31.6	Very low	29	Very low	124 Å²	124	137.2 Å²	137.2	81%	0.805	78%	0.778	S	S	*	*				-135.4	159.2	76.7	38.5	-24.9	0	0	0	115.7
290	F	30.8	Very low	28.9	Very low	192 Å²	192	135.4 Å²	135.4	84%	0.842	78%	0.78	S	S	*	*			trans	-69	153.4	161.5	-98	-101.5	0	0	0	111.8
291	K	25.3	Very low	30	Very low	204 Å²	204	135.1 Å²	135.1	89%	0.887	78%	0.78	S	S	*	*			trans	-157.8	164.3	134	-119.5	169.9	-174	177.5	0	114
292	T	26.6	Very low	29.9	Very low	113 Å²	113	129.3 Å²	129.3	69%	0.693	77%	0.773	S	S	*	*			trans	-99.6	148	-165.4	55.1	0	0	0	0	113
293	N	25.1	Very low	29.7	Very low	158 Å²	158	131.7 Å²	131.7	85%	0.845	78%	0.784	S	S	*	*				178.1	159.4	112.4	-84.7	1.7	0	0	0	108.2
294	G	25.2	Very low	29.2	Very low	77 Å²	77	130.1 Å²	130.1	79%	0.794	78%	0.782	S	S	*	*			trans	-125.3	169.4	175.1	0	0	0	0	0	111.6
295	Q	24.6	Very low	29.8	Very low	179 Å²	179	132.2 Å²	132.2	84%	0.836	79%	0.785	S	S	*	*			trans	-152.9	170.8	149.7	-162.8	145.4	2.8	0	0	110.4
296	E	25.3	Very low	29.6	Very low	145 Å²	145	133.6 Å²	133.6	68%	0.678	79%	0.785	S	S	*	*			trans	-64.4	153.7	-172.2	-57.7	126.4	132	0	0	114.4
297	D	24.6	Very low	29.5	Very low	137 Å²	137	129.5 Å²	129.5	73%	0.733	78%	0.783	S	S	*	*				179.9	132.8	104	-105	-18.5	0	0	0	117
298	H	26.2	Very low	28.7	Very low	184 Å²	184	128.6 Å²	128.6	85%	0.852	79%	0.791	S	S	*	*			trans	42.6	-174.4	144.9	-74.1	-60.4	0	0	0	123.1
299	A	23.9	Very low	28.2	Very low	82 Å²	82	129 Å²	129	68%	0.678	79%	0.793	S	S	*	*			trans	-153.9	-174.1	-150.3	0	0	0	0	0	115.1
300	T	27	Very low	28	Very low	143 Å²	143	132.2 Å²	132.2	88%	0.877	80%	0.795	S	S	*	*			trans	75.9	156.6	168.2	44	0	0	0	0	119.1
301	P	49.8	Very low	27.9	Very low	129 Å²	129	130.2 Å²	130.2	84%	0.838	79%	0.791	S	S	*	*			trans	-133.3	179	-144.8	44.7	-29.8	0	0	0	117.1
302	G	25.1	Very low	28.4	Very low	65 Å²	65	126.5 Å²	126.5	67%	0.67	79%	0.788	S	S	*	*			trans	135.6	-177.3	133.9	0	0	0	0	0	120
303	S	24.7	Very low	28.4	Very low	129 Å²	129	123.9 Å²	123.9	90%	0.902	78%	0.784	S	S	*	*			trans	82.2	131.9	170.9	75.1	0	0	0	0	120.5
304	A	29	Very low	28.4	Very low	89 Å²	89	123.2 Å²	123.2	74%	0.736	78%	0.78	S	S	*	*			trans	-108.1	-177.2	155.2	0	0	0	0	0	108.2
305	P	43.9	Very low	28.4	Very low	104 Å²	104	129.5 Å²	129.5	68%	0.675	78%	0.78	S	S	*	*				-161.6	177.1	92.7	43	-23.4	0	0	0	118.3
306	N	28.3	Very low	28.3	Very low	163 Å²	163	129.1 Å²	129.1	87%	0.872	78%	0.778	S	S	*	*			trans	66.5	150.7	153.7	-59.4	-25	0	0	0	120.4
307	G	25.3	Very low	28.3	Very low	81 Å²	81	129.9 Å²	129.9	84%	0.835	79%	0.785	S	S	*	*			cis	146.1	124.1	-11.9	0	0	0	0	0	115
308	G	23.6	Very low	28.3	Very low	77 Å²	77	133.4 Å²	133.4	79%	0.794	79%	0.794	S	S	*	*			trans	-178.4	138.9	173.4	0	0	0	0	0	114.4
309	T	27	Very low	28.3	Very low	133 Å²	133	132.1 Å²	132.1	82%	0.816	79%	0.792	S	S	*	*			trans	-153.1	168.4	-166.1	55.9	0	0	0	0	115
310	K	26.5	Very low	28.5	Very low	192 Å²	192	138.7 Å²	138.7	84%	0.835	80%	0.799	S	S	*	*			trans	163.7	166.5	154.1	-86.3	146.5	-166.9	172.4	0	107.8
311	I	28.5	Very low	28.4	Very low	151 Å²	151	137.4 Å²	137.4	77%	0.774	79%	0.793	S	S	*	*			cis	-171.4	151.5	-26	-97.2	174.7	0	0	0	103.9
312	P	36.3	Very low	27.2	Very low	125 Å²	125	137 Å²	137	81%	0.812	79%	0.789	S	S	*	*			cis	-103	-155.6	-15.5	42.3	-30.6	0	0	0	109.8
313	G	26.4	Very low	27.1	Very low	59 Å²	59	138.6 Å²	138.6	61%	0.608	80%	0.795	S	S	*	*			cis	133.9	145.1	-15.8	0	0	0	0	0	115.5
314	N	25.5	Very low	27.1	Very low	144 Å²	144	136.7 Å²	136.7	77%	0.77	79%	0.787	S	S	*	*			trans	65.5	126.1	169.7	-59	9.3	0	0	0	120.4
315	W	24.2	Very low	27.1	Very low	208 Å²	208	140.3 Å²	140.3	79%	0.788	79%	0.793	S	S	*	*			cis	-159.6	143.3	-23.8	-99.5	115.2	0	0	0	110.1
316	Q	23.1	Very low	26.2	Very low	172 Å²	172	139.1 Å²	139.1	80%	0.804	79%	0.792	S	S	*	*			trans	48.6	109.9	162.2	-54.7	-162.5	6.3	0	0	121
317	I	26.3	Very low	26.1	Very low	160 Å²	160	138.7 Å²	138.7	82%	0.821	80%	0.795	S	S	*	*			trans	-133.5	131.4	151.4	-61.2	-179.9	0	0	0	108.2
318	K	23.8	Very low	26.2	Very low	211 Å²	211	138.8 Å²	138.8	92%	0.917	80%	0.796	S	S	*	*			trans	-80.8	132.2	172.2	-84.8	-175.3	174.3	179.1	0	110.3
319	I	26.8	Very low	26.4	Very low	158 Å²	158	141.2 Å²	141.2	81%	0.81	80%	0.801	S	S	*	*			trans	-83.9	137.7	-165.9	-60.7	170.2	0	0	0	111.8	P321	I319-P321 HydrophobicContact CG2-CG 4.47Å
320	R	26.9	Very low	26.4	Very low	219 Å²	219	139.5 Å²	139.5	83%	0.826	80%	0.8	S	S	*	*			trans	-134.5	109.9	167.8	-175.5	-167.4	-163.5	-154.8	8	108.7
321	P	26.6	Very low	26.8	Very low	117 Å²	117	141.4 Å²	141.4	76%	0.76	80%	0.802	S	S	*	*			trans	-71.7	143.8	171.7	-17.2	32.4	0	0	0	111.1	I319	I319-P321 HydrophobicContact CG2-CG 4.47Å
322	T	22.7	Very low	26.9	Very low	121 Å²	121	142.3 Å²	142.3	74%	0.742	81%	0.809	S	S	*	*			trans	-147	151	167.4	-56.6	0	0	0	0	107.8
323	A	25	Very low	27.1	Very low	97 Å²	97	145 Å²	145	80%	0.802	81%	0.807	S	S	*	*			trans	-90.1	166.3	-158.6	0	0	0	0	0	115.8
324	A	24.4	Very low	27.5	Very low	89 Å²	89	147.8 Å²	147.8	74%	0.736	82%	0.815	S	S	*	*			trans	158.1	148.8	157.9	0	0	0	0	0	108
325	I	28.2	Very low	28	Very low	165 Å²	165	148.3 Å²	148.3	85%	0.846	82%	0.817	S	S	*	*			cis	-164	168.8	3.5	-111	161.3	0	0	0	106.5
326	A	24.8	Very low	28.5	Very low	80 Å²	80	142 Å²	142	66%	0.661	81%	0.809	S	S	*	*			cis	-179.1	128.1	-45.9	0	0	0	0	0	110.1
327	T	25.8	Very low	29.3	Very low	153 Å²	153	141 Å²	141	94%	0.939	81%	0.81	S	S	*	*			trans	-157.1	138.6	159.2	45.2	0	0	0	0	108.6
328	G	27.6	Very low	30.3	Very low	83 Å²	83	139.1 Å²	139.1	86%	0.856	81%	0.81	S	S	*	*			cis	158	89.6	-10.6	0	0	0	0	0	112.1
329	S	27.7	Very low	31.9	Very low	129 Å²	129	134 Å²	134	90%	0.902	79%	0.792	S	S	*	*			trans	-150.2	168.1	171	-163.2	0	0	0	0	112.8
330	A	28.4	Very low	34.3	Very low	97 Å²	97	130.9 Å²	130.9	80%	0.802	78%	0.783	S	S	*	*			trans	-64.8	145.3	-156.3	0	0	0	0	0	116.2
331	R	34.8	Very low	36.8	Very low	232 Å²	232	122.3 Å²	122.3	88%	0.875	76%	0.756	S	S	*	*			trans	-85	129.2	162.4	-70.3	173.4	171.6	162.6	-3.1	109.7
332	N	30.7	Very low	39.6	Very low	170 Å²	170	116.9 Å²	116.9	91%	0.909	72%	0.721	S	S	*	*			trans	-114.5	131.8	142.2	-91	-20.4	0	0	0	108.1
333	K	39.5	Very low	42.1	Very low	180 Å²	180	115.1 Å²	115.1	78%	0.783	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-103	138.9	174.9	-100.8	-166.6	173.9	-168.9	0	109.3
334	P	35.7	Very low	44.5	Very low	119 Å²	119	112.4 Å²	112.4	77%	0.773	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-83.2	137.9	142.5	-14.7	31.4	0	0	0	110.9
335	L	34.5	Very low	47.3	Very low	154 Å²	154	109.2 Å²	109.2	81%	0.806	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-83.6	153.7	141.8	-120.9	65.5	0	0	0	106
336	A	35.1	Very low	50	Low	75 Å²	75	103.9 Å²	103.9	62%	0.62	66%	0.657	S	S	*	*	S	Bend	cis	-152.9	169.4	2.4	0	0	0	0	0	110.3	S338	A336-S338 PolarHBondContact O-N 3.23Å
337	N	40	Very low	52.9	Low	153 Å²	153	101.7 Å²	101.7	82%	0.818	64%	0.636	S	S	*	*			trans	40.9	69.5	157.7	-61.7	3.9	0	0	0	118.1	L339	N337-L339 PolarHBondContact O-N 3.14Å
338	S	47.7	Very low	55.3	Low	119 Å²	119	98.3 Å²	98.3	83%	0.832	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-70.9	119.9	152.6	45.1	0	0	0	0	109.6	A336	A336-S338 PolarHBondContact O-N 3.23Å
339	L	58.2	Low	57.4	Low	103 Å²	103	101.4 Å²	101.4	54%	0.539	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-65.6	144.6	160.6	-92.2	67.6	0	0	0	108.2	N337 L374	N337-L339 PolarHBondContact O-N 3.14Å; L339-L374 HydrophobicContact CB-CD2 3.67Å; L339-L374 HydrophobicContact CD2-CD2 4.23Å
340	P	75.1	Confident	58.9	Low	94 Å²	94	96.5 Å²	96.5	61%	0.61	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-64.5	139.1	173.3	27.3	-32.4	0	0	0	110	P372	P340-P372 HydrophobicContact CG-CG 4.16Å; P340-P372 WeakPolarHBondContact O-CD 3.36Å; P340-P372 WeakPolarHBondContact O-CG 3.3Å
341	C	81.3	Confident	59.8	Low	39 Å²	39	95.9 Å²	95.9	26%	0.264	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-58.5	149.5	172.1	-168.3	0	0	0	0	110.9	G343 C345 C347	C341-G343 PolarHBondContact O-N 3.14Å; C341-C345 PolarHBondContact SG-O 2.64Å; C341-C345 VanDerWaalsContact SG-O 3.35Å; C341-C347 VanDerWaalsContact CA-SG 3.55Å; C341-C347 HydrophobicContact CB-CB 3.63Å; C341-C347 WeakPolarHBondContact CB-SG 3.18Å; C341-C347 WeakPolarHBondContact SG-CB 3.43Å; C341-C347 PolarHBondContact SG-N 3.24Å; C341-C347 VanDerWaalsContact SG-N 3.37Å; C341-C347 CovalentContact SG-SG 2.03Å; C341-C347 PolarHBondContact SG-SG 2.81Å
342	P	84.3	Confident	60.8	Low	3 Å²	3	88.5 Å²	88.5	2%	0.019	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-49.4	139.8	171.6	-30.7	36.1	0	0	0	113.3	G344 C345 M357 K371 P372	P342-G344 PolarHBondContact O-N 2.03Å; P342-C345 HydrophobicContact CB-CB 4.43Å; P342-C345 PolarHBondContact O-N 3.01Å; P342-M357 HydrophobicContact CG-SD 3.71Å; P342-K371 WeakPolarHBondContact CA-O 3.26Å; P342-P372 WeakPolarHBondContact CG-O 3.08Å
343	G	75.4	Confident	62	Low	83 Å²	83	81 Å²	81	86%	0.856	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	103.8	-174.9	0	0	0	0	0	112.6	C341	C341-G343 PolarHBondContact O-N 3.14Å
344	G	74.8	Confident	63.6	Low	40 Å²	40	73.1 Å²	73.1	41%	0.412	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.7	-8.9	179.2	0	0	0	0	0	115.5	P342 R362	P342-G344 PolarHBondContact O-N 2.03Å; G344-R362 VanDerWaalsContact O-CD 3.27Å; G344-R362 WeakPolarHBondContact O-CD 3.48Å; G344-R362 PolarHBondContact O-NE 2.97Å; G344-R362 PolarHBondContact O-NH1 2.93Å
345	C	84.8	Confident	65.8	Low	22 Å²	22	68.8 Å²	68.8	15%	0.149	45%	0.453	C	S	.	.			trans	-91.4	161	173.9	-54.4	0	0	0	0	111.9	C341 P342 M357 N358 C359	C341-C345 PolarHBondContact SG-O 2.64Å; C341-C345 VanDerWaalsContact SG-O 3.35Å; P342-C345 HydrophobicContact CB-CB 4.43Å; P342-C345 PolarHBondContact O-N 3.01Å; C345-M357 HydrophobicContact CB-CG 4.4Å; C345-N358 CarbonylContact C-O 3.53Å; C345-N358 VanDerWaalsContact CA-O 3.26Å; C345-N358 WeakPolarHBondContact CA-O 3.32Å; C345-N358 VanDerWaalsContact CB-O 3.31Å; C345-N358 WeakPolarHBondContact CB-O 3.36Å; C345-C359 HydrophobicContact CB-CB 4.1Å; C345-C359 WeakPolarHBondContact CB-SG 3.46Å; C345-C359 WeakPolarHBondContact SG-CB 3.3Å; C345-C359 CovalentContact SG-SG 2.04Å; C345-C359 PolarHBondContact SG-SG 2.84Å
346	S	83.1	Confident	68	Low	53 Å²	53	61.9 Å²	61.9	37%	0.371	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	147	158.4	-156.8	0	0	0	0	109.9	D348 M357 N358	S346-D348 WeakPolarHBondContact CB-OD2 3.2Å; S346-D348 PolarHBondContact OG-OD2 2.87Å; S346-M357 WeakPolarHBondContact O-CA 3.45Å; S346-N358 PolarHBondContact N-O 2.82Å; S346-N358 PolarHBondContact O-N 2.03Å
347	C	86.1	Confident	70.5	Confident	34 Å²	34	58.3 Å²	58.3	23%	0.23	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	106.3	175.8	-66.1	0	0	0	0	108.7	C341 L355 K356 L374	C341-C347 VanDerWaalsContact CA-SG 3.55Å; C341-C347 HydrophobicContact CB-CB 3.63Å; C341-C347 WeakPolarHBondContact CB-SG 3.18Å; C341-C347 WeakPolarHBondContact SG-CB 3.43Å; C341-C347 PolarHBondContact SG-N 3.24Å; C341-C347 VanDerWaalsContact SG-N 3.37Å; C341-C347 CovalentContact SG-SG 2.03Å; C341-C347 PolarHBondContact SG-SG 2.81Å; C347-L355 HydrophobicContact CB-CD1 4.35Å; C347-K356 CarbonylContact C-O 3.59Å; C347-K356 WeakPolarHBondContact CA-O 3.39Å; C347-L374 WeakPolarHBondContact SG-CD1 3.4Å
348	D	76.4	Confident	72.6	Confident	83 Å²	83	51.5 Å²	51.5	44%	0.444	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122	-168.5	-65.8	-75.4	0	0	0	109	S346 I350 K356	S346-D348 WeakPolarHBondContact CB-OD2 3.2Å; S346-D348 PolarHBondContact OG-OD2 2.87Å; D348-I350 PolarHBondContact O-N 2.97Å; D348-K356 PolarHBondContact N-O 3.37Å; D348-K356 PolarHBondContact O-N 2.98Å
349	H	71	Confident	74.6	Confident	148 Å²	148	45.9 Å²	45.9	69%	0.685	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	106.7	-174.1	-168.6	-39.9	0	0	0	110	G354 L355	H349-G354 CarbonylContact C-O 3.55Å; H349-G354 PolarHBondContact ND1-O 2.94Å; H349-L355 HydrophobicContact CB-CD1 4.1Å
350	I	59.2	Low	75.8	Confident	25 Å²	25	41 Å²	41	13%	0.128	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	128.9	180	-49.8	171.6	0	0	0	108.5	D211 D348 G352 G354 K356	D211-I350 WeakPolarHBondContact OD1-CD1 3.06Å; D348-I350 PolarHBondContact O-N 2.97Å; I350-G352 PolarHBondContact O-N 2.92Å; I350-G354 PolarHBondContact N-O 2.93Å; I350-G354 PolarHBondContact O-N 2.95Å; I350-K356 HydrophobicContact CD1-CB 3.99Å; I350-K356 HydrophobicContact CG1-CB 4.46Å
351	P	48.5	Very low	76.1	Confident	85 Å²	85	37.3 Å²	37.3	55%	0.552	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	127.2	169	-22.7	34.5	0	0	0	110.1	S353	P351-S353 VanDerWaalsContact C-N 3.25Å; P351-S353 PolarHBondContact O-N 2.89Å; P351-S353 VanDerWaalsContact O-N 3.09Å
352	G	55.1	Low	76.3	Confident	77 Å²	77	41.6 Å²	41.6	79%	0.794	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-52.5	-174.6	0	0	0	0	0	114.2	I350 G354	I350-G352 PolarHBondContact O-N 2.92Å; G352-G354 VanDerWaalsContact C-N 3.34Å; G352-G354 PolarHBondContact O-N 2.85Å
353	S	55.3	Low	76.3	Confident	12 Å²	12	45.4 Å²	45.4	8%	0.084	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	22	-173.2	-55.4	0	0	0	0	115.6	R238 P351 Q378	R238-S353 PolarHBondContact NH1-OG 2.94Å; P351-S353 VanDerWaalsContact C-N 3.25Å; P351-S353 PolarHBondContact O-N 2.89Å; P351-S353 VanDerWaalsContact O-N 3.09Å; S353-Q378 VanDerWaalsContact C-CD 3.48Å; S353-Q378 PolarHBondContact O-OE1 2.99Å
354	G	74.1	Confident	76.9	Confident	14 Å²	14	42.3 Å²	42.3	14%	0.144	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	68.3	-134.9	171.3	0	0	0	0	0	114.1	H349 I350 G352	H349-G354 CarbonylContact C-O 3.55Å; H349-G354 PolarHBondContact ND1-O 2.94Å; I350-G354 PolarHBondContact N-O 2.93Å; I350-G354 PolarHBondContact O-N 2.95Å; G352-G354 VanDerWaalsContact C-N 3.34Å; G352-G354 PolarHBondContact O-N 2.85Å
355	L	82	Confident	77.5	Confident	29 Å²	29	44 Å²	44	15%	0.152	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.1	-174.1	-172.1	65.4	0	0	0	111	C347 H349 L374 V377 Q378	C347-L355 HydrophobicContact CB-CD1 4.35Å; H349-L355 HydrophobicContact CB-CD1 4.1Å; L355-L374 HydrophobicContact CD2-CB 4.36Å; L355-L374 HydrophobicContact CD2-CD1 4.04Å; L355-V377 HydrophobicContact CD2-CG2 4.21Å; L355-V377 CarbonylContact O-C 3.57Å; L355-V377 VanDerWaalsContact O-CA 3.31Å; L355-V377 WeakPolarHBondContact O-CA 3.06Å; L355-Q378 PolarHBondContact O-N 3.07Å
356	K	81.6	Confident	77.7	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.035	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	134.9	167	167.9	164.5	168.6	162.5	0	109	D163 D211 C347 D348 I350 E379 F381	D163-K356 IonicContact OD1-NZ 2.65Å; D211-K356 WeakPolarHBondContact OD2-CD 3.04Å; D211-K356 WeakPolarHBondContact OD2-CE 3.24Å; D211-K356 IonicContact OD2-NZ 2.77Å; D211-K356 PolarHBondContact OD2-NZ 2.87Å; C347-K356 CarbonylContact C-O 3.59Å; C347-K356 WeakPolarHBondContact CA-O 3.39Å; D348-K356 PolarHBondContact N-O 3.37Å; D348-K356 PolarHBondContact O-N 2.98Å; I350-K356 HydrophobicContact CD1-CB 3.99Å; I350-K356 HydrophobicContact CG1-CB 4.46Å; K356-E379 HydrophobicContact CB-CB 4.36Å; K356-E379 HydrophobicContact CG-CB 4.45Å; K356-F381 HydrophobicContact CD-CD2 4.35Å; K356-F381 HydrophobicContact CD-CE2 3.65Å; K356-F381 HydrophobicContact CD-CZ 4.33Å; K356-F381 HydrophobicContact CG-CD2 4.23Å; K356-F381 HydrophobicContact CG-CE2 3.87Å
357	M	87.5	Confident	77.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	112.6	176.2	-172.1	169.1	75.9	0	0	109.9	P342 C345 S346 L370 L374 V377 E379 L380 F381 Y398	P342-M357 HydrophobicContact CG-SD 3.71Å; C345-M357 HydrophobicContact CB-CG 4.4Å; S346-M357 WeakPolarHBondContact O-CA 3.45Å; M357-L370 HydrophobicContact CE-CD1 4.34Å; M357-L374 HydrophobicContact SD-CD1 4Å; M357-V377 HydrophobicContact CB-CG1 3.89Å; M357-V377 HydrophobicContact CB-CG2 4.24Å; M357-V377 HydrophobicContact SD-CG2 4.41Å; M357-E379 PolarHBondContact N-O 3.36Å; M357-L380 HydrophobicContact CB-CD1 4.44Å; M357-L380 HydrophobicContact CE-CD1 3.43Å; M357-L380 VanDerWaalsContact CE-CD1 3.43Å; M357-L380 HydrophobicContact CE-CD2 4.49Å; M357-F381 PolarHBondContact O-N 2.93Å; M357-Y398 HydrophobicContact CE-CE1 4.08Å
358	N	84.3	Confident	77.8	Confident	11 Å²	11	42.3 Å²	42.3	6%	0.059	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	107.3	-176.7	-171.5	-24.6	0	0	0	110.3	F139 D163 C345 S346 N360	F139-N358 VanDerWaalsContact CE1-ND2 3.27Å; F139-N358 WeakPolarHBondContact CE1-ND2 3.39Å; F139-N358 WeakPolarHBondContact CE1-OD1 3.27Å; F139-N358 VanDerWaalsContact CZ-ND2 3.26Å; F139-N358 WeakPolarHBondContact CZ-ND2 3.5Å; F139-N358 WeakPolarHBondContact CZ-OD1 3.41Å; D163-N358 PolarHBondContact OD1-ND2 2.86Å; C345-N358 CarbonylContact C-O 3.53Å; C345-N358 VanDerWaalsContact CA-O 3.26Å; C345-N358 WeakPolarHBondContact CA-O 3.32Å; C345-N358 VanDerWaalsContact CB-O 3.31Å; C345-N358 WeakPolarHBondContact CB-O 3.36Å; S346-N358 PolarHBondContact N-O 2.82Å; S346-N358 PolarHBondContact O-N 2.03Å; N358-N360 PolarHBondContact OD1-N 3.06Å
359	C	88.4	Confident	78.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.255	C	S	.	.			trans	-117.9	23.1	-179	-63.7	0	0	0	0	111.8	C345 R362 L370 F381 L382 N385	C345-C359 HydrophobicContact CB-CB 4.1Å; C345-C359 WeakPolarHBondContact CB-SG 3.46Å; C345-C359 WeakPolarHBondContact SG-CB 3.3Å; C345-C359 CovalentContact SG-SG 2.04Å; C345-C359 PolarHBondContact SG-SG 2.84Å; C359-R362 WeakPolarHBondContact O-CG 3.4Å; C359-L370 HydrophobicContact CB-CD2 4.47Å; C359-F381 CarbonylContact C-O 3.07Å; C359-F381 WeakPolarHBondContact CA-O 3.45Å; C359-F381 WeakPolarHBondContact CB-O 3.46Å; C359-F381 PolarHBondContact N-O 2.98Å; C359-L382 HydrophobicContact CB-CD2 3.56Å; C359-L382 HydrophobicContact CB-CG 4.43Å; C359-N385 PolarHBondContact O-ND2 3.44Å
360	N	83.1	Confident	78.8	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	142.4	-177.6	-72.1	6.5	0	0	0	111.8	F139 N358 R362 F381 L382 R383	F139-N360 HydrophobicContact CD1-CB 4.49Å; F139-N360 HydrophobicContact CD2-CB 4.23Å; F139-N360 HydrophobicContact CE1-CB 3.92Å; F139-N360 HydrophobicContact CE2-CB 3.71Å; F139-N360 WeakPolarHBondContact CE2-ND2 3.03Å; F139-N360 HydrophobicContact CZ-CB 3.52Å; F139-N360 WeakPolarHBondContact CZ-ND2 3.34Å; N358-N360 PolarHBondContact OD1-N 3.06Å; N360-R362 WeakPolarHBondContact O-CG 3.45Å; N360-R362 PolarHBondContact O-N 3.19Å; N360-R362 PolarHBondContact O-NE 2.92Å; N360-R362 VanDerWaalsContact O-NE 3.11Å; N360-F381 WeakPolarHBondContact OD1-CB 3.43Å; N360-F381 PolarHBondContact OD1-O 3.1Å; N360-L382 WeakPolarHBondContact OD1-CA 3.29Å; N360-L382 PolarHBondContact OD1-N 2.95Å; N360-R383 VanDerWaalsContact CA-O 3.3Å; N360-R383 WeakPolarHBondContact CA-O 3.03Å; N360-R383 PolarHBondContact OD1-N 3.19Å
361	N	82.9	Confident	79.9	Confident	18 Å²	18	41.3 Å²	41.3	10%	0.096	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	55.2	-177.8	-172	54.9	0	0	0	114.7	N91 N115 R383 D384	N91-N361 PolarHBondContact ND2-OD1 3.32Å; N91-N361 PolarHBondContact OD1-ND2 2.96Å; N91-N361 PolarHBondContact OD1-OD1 3.49Å; N115-N361 HydrophobicContact CB-CB 4.01Å; N115-N361 PolarHBondContact ND2-ND2 3.17Å; N115-N361 WeakPolarHBondContact OD1-CB 3.48Å; N115-N361 PolarHBondContact OD1-ND2 3.38Å; N361-R383 PolarHBondContact N-O 3.3Å; N361-D384 WeakPolarHBondContact CA-O 3.23Å; N361-D384 HydrophobicContact CB-CB 3.88Å
362	R	84.6	Confident	81.5	Confident	128 Å²	128	39.4 Å²	39.4	48%	0.483	23%	0.234	S	C	.	.	S	Bend	trans	-112.3	11.6	177.7	-57.2	-57.1	162.5	143.8	2.7	113.8	G344 C359 N360 V364 N385	G344-R362 VanDerWaalsContact O-CD 3.27Å; G344-R362 WeakPolarHBondContact O-CD 3.48Å; G344-R362 PolarHBondContact O-NE 2.97Å; G344-R362 PolarHBondContact O-NH1 2.93Å; C359-R362 WeakPolarHBondContact O-CG 3.4Å; N360-R362 WeakPolarHBondContact O-CG 3.45Å; N360-R362 PolarHBondContact O-N 3.19Å; N360-R362 PolarHBondContact O-NE 2.92Å; N360-R362 VanDerWaalsContact O-NE 3.11Å; R362-V364 HydrophobicContact CB-CG2 3.96Å; R362-V364 PolarHBondContact O-N 2.9Å; R362-N385 WeakPolarHBondContact CA-OD1 3.49Å; R362-N385 PolarHBondContact N-OD1 3.28Å
363	N	84.9	Confident	82.8	Confident	84 Å²	84	38.9 Å²	38.9	45%	0.449	21%	0.209	S	C	.	.			trans	52.4	31.1	-174.6	-71.2	-98.9	0	0	0	112.7	S365 N385 K386	N363-S365 PolarHBondContact O-N 2.81Å; N363-N385 PolarHBondContact N-OD1 3.32Å; N363-K386 WeakPolarHBondContact OD1-CE 3.36Å
364	V	88.1	Confident	84	Confident	17 Å²	17	38.9 Å²	38.9	10%	0.103	21%	0.209	C	C	.	.			trans	-63.6	121.7	177.3	175.7	0	0	0	0	108.5	R362 S366 L370 N385 K386 I387	R362-V364 HydrophobicContact CB-CG2 3.96Å; R362-V364 PolarHBondContact O-N 2.9Å; V364-S366 WeakPolarHBondContact CG1-O 3.39Å; V364-L370 HydrophobicContact CG2-CD2 4.26Å; V364-N385 HydrophobicContact CB-CB 4.18Å; V364-N385 WeakPolarHBondContact CB-OD1 3.39Å; V364-N385 PolarHBondContact N-OD1 3.49Å; V364-K386 CarbonylContact O-C 3.57Å; V364-K386 PolarHBondContact O-N 3.24Å; V364-I387 HydrophobicContact CG1-CG1 4.34Å; V364-I387 PolarHBondContact O-N 3.25Å
365	S	86.7	Confident	83.9	Confident	76 Å²	76	42 Å²	42	53%	0.531	23%	0.228	S	C	.	.	S	Bend	trans	-92.1	-24	178.1	-57.6	0	0	0	0	112	N363	N363-S365 PolarHBondContact O-N 2.81Å
366	S	88.3	Confident	83.9	Confident	29 Å²	29	45.4 Å²	45.4	20%	0.203	25%	0.247	C	C	.	.			trans	-148.9	144.4	173.6	-175.5	0	0	0	0	112.6	V364 A368 D369	V364-S366 WeakPolarHBondContact CG1-O 3.39Å; S366-A368 PolarHBondContact O-N 2.95Å; S366-A368 WeakPolarHBondContact OG-CB 3.49Å; S366-A368 PolarHBondContact OG-N 3.28Å; S366-D369 WeakPolarHBondContact CB-OD2 3.19Å; S366-D369 PolarHBondContact N-OD2 3.02Å; S366-D369 VanDerWaalsContact O-CB 3.29Å; S366-D369 WeakPolarHBondContact O-CB 3.24Å; S366-D369 PolarHBondContact O-N 2.93Å
367	L	85.9	Confident	84.1	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.8	169	-71.7	75.7	0	0	0	112.4	D369 L370 L382 I387 I390 H394 F395	L367-D369 PolarHBondContact O-N 2.93Å; L367-L370 HydrophobicContact CB-CD1 4.31Å; L367-L370 HydrophobicContact CG-CD1 4.36Å; L367-L382 HydrophobicContact CD1-CD1 4.33Å; L367-L382 HydrophobicContact CD2-CD1 3.85Å; L367-L382 HydrophobicContact CG-CD1 3.81Å; L367-I387 HydrophobicContact CD1-CD1 3.72Å; L367-I387 HydrophobicContact CD1-CG1 4.11Å; L367-I387 HydrophobicContact CD1-CG2 3.63Å; L367-I390 HydrophobicContact CD1-CG2 4.12Å; L367-H394 HydrophobicContact CB-CB 3.82Å; L367-H394 HydrophobicContact CD2-CB 4.02Å; L367-F395 HydrophobicContact CD2-CD1 4.43Å; L367-F395 HydrophobicContact CD2-CE1 3.57Å; L367-F395 HydrophobicContact CD2-CE2 4.31Å; L367-F395 HydrophobicContact CD2-CZ 3.51Å
368	A	85.6	Confident	84.1	Confident	44 Å²	44	46.9 Å²	46.9	36%	0.364	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-13.5	171.5	0	0	0	0	0	113.8	S366 K371	S366-A368 PolarHBondContact O-N 2.95Å; S366-A368 WeakPolarHBondContact OG-CB 3.49Å; S366-A368 PolarHBondContact OG-N 3.28Å; A368-K371 WeakPolarHBondContact O-CE 3.39Å; A368-K371 PolarHBondContact O-NZ 2.93Å
369	D	83.6	Confident	84.1	Confident	92 Å²	92	46.5 Å²	46.5	49%	0.492	25%	0.251	S	S	.	.	S	Bend	trans	-84.3	-21.3	178.8	-55.2	-37.6	0	0	0	112	S366 L367 K371	S366-D369 WeakPolarHBondContact CB-OD2 3.19Å; S366-D369 PolarHBondContact N-OD2 3.02Å; S366-D369 VanDerWaalsContact O-CB 3.29Å; S366-D369 WeakPolarHBondContact O-CB 3.24Å; S366-D369 PolarHBondContact O-N 2.93Å; L367-D369 PolarHBondContact O-N 2.93Å; D369-K371 PolarHBondContact O-N 2.8Å
370	L	84.7	Confident	84.2	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.031	25%	0.251	C	S	.	.			trans	-66	93.1	177.3	-58.7	175	0	0	0	110.9	M357 C359 V364 L367 L382	M357-L370 HydrophobicContact CE-CD1 4.34Å; C359-L370 HydrophobicContact CB-CD2 4.47Å; V364-L370 HydrophobicContact CG2-CD2 4.26Å; L367-L370 HydrophobicContact CB-CD1 4.31Å; L367-L370 HydrophobicContact CG-CD1 4.36Å; L370-L382 HydrophobicContact CD1-CD1 4.31Å; L370-L382 HydrophobicContact CD1-CD2 3.98Å; L370-L382 HydrophobicContact CD2-CD2 4.39Å
371	K	82.8	Confident	84.3	Confident	138 Å²	138	46.5 Å²	46.5	60%	0.6	25%	0.251	S	S	*	.			trans	-130.2	132.5	-176.1	-71.1	170.3	-177.8	130.5	0	111.4	P342 A368 D369	P342-K371 WeakPolarHBondContact CA-O 3.26Å; A368-K371 WeakPolarHBondContact O-CE 3.39Å; A368-K371 PolarHBondContact O-NZ 2.93Å; D369-K371 PolarHBondContact O-N 2.8Å
372	P	83.3	Confident	84.7	Confident	44 Å²	44	45.6 Å²	45.6	29%	0.286	25%	0.247	S	C	.	.	S	Bend	cis	-74.6	147.7	-0.8	33.5	-36.3	0	0	0	112	P340 P342 L374	P340-P372 HydrophobicContact CG-CG 4.16Å; P340-P372 WeakPolarHBondContact O-CD 3.36Å; P340-P372 WeakPolarHBondContact O-CG 3.3Å; P342-P372 WeakPolarHBondContact CG-O 3.08Å; P372-L374 PolarHBondContact O-N 2.7Å
373	K	80.4	Confident	84.8	Confident	66 Å²	66	39.8 Å²	39.8	29%	0.287	23%	0.225	S	C	.	.			trans	-65.8	136.1	169.9	-73.4	-160.8	-179.5	-165.8	0	109.9	S393 H394 D397	K373-S393 PolarHBondContact NZ-O 3.2Å; K373-H394 PolarHBondContact NZ-O 3.4Å; K373-D397 HydrophobicContact CD-CB 4.06Å; K373-D397 WeakPolarHBondContact CD-OD2 3.38Å; K373-D397 WeakPolarHBondContact CE-OD2 3.47Å; K373-D397 IonicContact NZ-OD2 2.65Å; K373-D397 PolarHBondContact NZ-OD2 2.92Å
374	L	81	Confident	84.6	Confident	13 Å²	13	36.4 Å²	36.4	7%	0.068	21%	0.207	C	C	.	.			trans	-107.2	119.8	-179.8	-66.4	170.9	0	0	0	110.4	L339 C347 L355 M357 P372 V377 Y398	L339-L374 HydrophobicContact CB-CD2 3.67Å; L339-L374 HydrophobicContact CD2-CD2 4.23Å; C347-L374 WeakPolarHBondContact SG-CD1 3.4Å; L355-L374 HydrophobicContact CD2-CB 4.36Å; L355-L374 HydrophobicContact CD2-CD1 4.04Å; M357-L374 HydrophobicContact SD-CD1 4Å; P372-L374 PolarHBondContact O-N 2.7Å; L374-V377 HydrophobicContact CB-CG2 3.82Å; L374-Y398 WeakPolarHBondContact O-CD1 3.44Å; L374-Y398 WeakPolarHBondContact O-CE1 3.37Å
375	S	73	Confident	84.6	Confident	80 Å²	80	35.9 Å²	35.9	56%	0.559	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	148.2	164.3	52.6	0	0	0	0	110.4
376	N	80.8	Confident	84.8	Confident	100 Å²	100	35.4 Å²	35.4	54%	0.535	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	15.2	-178.6	-48.5	-20.1	0	0	0	116.5	Q378	N376-Q378 PolarHBondContact O-N 2.81Å
377	V	87.4	Confident	85	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	125.8	162.7	-178.1	0	0	0	0	108.8	L355 M357 L374 E379 L380 Y398 N400 L401	L355-V377 HydrophobicContact CD2-CG2 4.21Å; L355-V377 CarbonylContact O-C 3.57Å; L355-V377 VanDerWaalsContact O-CA 3.31Å; L355-V377 WeakPolarHBondContact O-CA 3.06Å; M357-V377 HydrophobicContact CB-CG1 3.89Å; M357-V377 HydrophobicContact CB-CG2 4.24Å; M357-V377 HydrophobicContact SD-CG2 4.41Å; L374-V377 HydrophobicContact CB-CG2 3.82Å; V377-E379 VanDerWaalsContact CG1-O 3.31Å; V377-E379 WeakPolarHBondContact CG1-O 3.24Å; V377-L380 HydrophobicContact CG1-CB 4.22Å; V377-Y398 HydrophobicContact CB-CD1 4.08Å; V377-Y398 HydrophobicContact CB-CE1 4.44Å; V377-Y398 HydrophobicContact CG2-CD1 4.15Å; V377-Y398 HydrophobicContact CG2-CE1 4.05Å; V377-N400 CarbonylContact O-C 3.57Å; V377-L401 HydrophobicContact CB-CD2 4.38Å; V377-L401 HydrophobicContact CG1-CD2 3.83Å
378	Q	85.9	Confident	85.3	Confident	38 Å²	38	39.5 Å²	39.5	18%	0.178	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-29.5	173.2	-70.4	-168.1	18.7	0	0	112	S353 L355 N376 L401 I402 L403	S353-Q378 VanDerWaalsContact C-CD 3.48Å; S353-Q378 PolarHBondContact O-OE1 2.99Å; L355-Q378 PolarHBondContact O-N 3.07Å; N376-Q378 PolarHBondContact O-N 2.81Å; Q378-L401 CarbonylContact O-C 3.57Å; Q378-L401 WeakPolarHBondContact O-CA 3.07Å; Q378-I402 HydrophobicContact CB-CD1 4.4Å; Q378-I402 HydrophobicContact CB-CG1 4.24Å; Q378-I402 HydrophobicContact CG-CD1 4.41Å; Q378-I402 HydrophobicContact CG-CG1 4.48Å; Q378-I402 PolarHBondContact O-N 3.21Å; Q378-L403 PolarHBondContact O-N 3.45Å; Q378-L403 VanDerWaalsContact O-N 3.15Å
379	E	84.3	Confident	85.6	Confident	3 Å²	3	38.5 Å²	38.5	1%	0.014	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	121.4	-176.5	-55.5	-175.6	-172.1	0	0	109.3	R238 K356 M357 V377 F381 L403	R238-E379 IonicContact NH2-OE1 3.89Å; R238-E379 PolarHBondContact NH2-OE1 3.07Å; K356-E379 HydrophobicContact CB-CB 4.36Å; K356-E379 HydrophobicContact CG-CB 4.45Å; M357-E379 PolarHBondContact N-O 3.36Å; V377-E379 VanDerWaalsContact CG1-O 3.31Å; V377-E379 WeakPolarHBondContact CG1-O 3.24Å; E379-F381 HydrophobicContact CB-CE2 3.82Å; E379-L403 HydrophobicContact CB-CB 4.32Å; E379-L403 HydrophobicContact CG-CB 4.11Å
380	L	90.1	Very high	86.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	112	-175.4	174.2	50.2	0	0	0	110.5	M357 V377 L382 Y398 L401 L403 L404 D405	M357-L380 HydrophobicContact CB-CD1 4.44Å; M357-L380 HydrophobicContact CE-CD1 3.43Å; M357-L380 VanDerWaalsContact CE-CD1 3.43Å; M357-L380 HydrophobicContact CE-CD2 4.49Å; V377-L380 HydrophobicContact CG1-CB 4.22Å; L380-L382 HydrophobicContact CD1-CD1 3.89Å; L380-L382 HydrophobicContact CD1-CD2 4.46Å; L380-L382 HydrophobicContact CD1-CG 3.8Å; L380-L382 HydrophobicContact CD2-CD1 3.92Å; L380-L382 HydrophobicContact CG-CD1 3.82Å; L380-L382 HydrophobicContact CG-CG 4.13Å; L380-Y398 HydrophobicContact CD2-CD2 4.42Å; L380-Y398 HydrophobicContact CD2-CE2 4.47Å; L380-L401 HydrophobicContact CB-CD1 4.45Å; L380-L401 HydrophobicContact CB-CD2 3.58Å; L380-L401 HydrophobicContact CD2-CD1 4.33Å; L380-L403 PolarHBondContact N-O 3.03Å; L380-L404 HydrophobicContact CB-CD1 4.11Å; L380-L404 HydrophobicContact CD2-CD1 3.98Å; L380-L404 HydrophobicContact CG-CD1 3.91Å; L380-D405 PolarHBondContact O-N 3.27Å
381	F	86.4	Confident	86.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.5	177.7	-57.5	-105.3	0	0	0	109.4	R185 K356 M357 C359 N360 E379 L403 D405	R185-F381 VanDerWaalsContact NH1-CE1 3.34Å; K356-F381 HydrophobicContact CD-CD2 4.35Å; K356-F381 HydrophobicContact CD-CE2 3.65Å; K356-F381 HydrophobicContact CD-CZ 4.33Å; K356-F381 HydrophobicContact CG-CD2 4.23Å; K356-F381 HydrophobicContact CG-CE2 3.87Å; M357-F381 PolarHBondContact O-N 2.93Å; C359-F381 CarbonylContact C-O 3.07Å; C359-F381 WeakPolarHBondContact CA-O 3.45Å; C359-F381 WeakPolarHBondContact CB-O 3.46Å; C359-F381 PolarHBondContact N-O 2.98Å; N360-F381 WeakPolarHBondContact OD1-CB 3.43Å; N360-F381 PolarHBondContact OD1-O 3.1Å; E379-F381 HydrophobicContact CB-CE2 3.82Å; F381-L403 HydrophobicContact CE1-CD2 4.05Å; F381-L403 HydrophobicContact CE2-CD2 4.31Å; F381-L403 HydrophobicContact CZ-CD2 3.93Å; F381-D405 HydrophobicContact CD1-CB 4.3Å
382	L	91.1	Very high	86.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.186	C	C	.	.			trans	-132.5	21	180	-75.6	165.1	0	0	0	113	C359 N360 L367 L370 L380 N385 I387 D405 L406 N409	C359-L382 HydrophobicContact CB-CD2 3.56Å; C359-L382 HydrophobicContact CB-CG 4.43Å; N360-L382 WeakPolarHBondContact OD1-CA 3.29Å; N360-L382 PolarHBondContact OD1-N 2.95Å; L367-L382 HydrophobicContact CD1-CD1 4.33Å; L367-L382 HydrophobicContact CD2-CD1 3.85Å; L367-L382 HydrophobicContact CG-CD1 3.81Å; L370-L382 HydrophobicContact CD1-CD1 4.31Å; L370-L382 HydrophobicContact CD1-CD2 3.98Å; L370-L382 HydrophobicContact CD2-CD2 4.39Å; L380-L382 HydrophobicContact CD1-CD1 3.89Å; L380-L382 HydrophobicContact CD1-CD2 4.46Å; L380-L382 HydrophobicContact CD1-CG 3.8Å; L380-L382 HydrophobicContact CD2-CD1 3.92Å; L380-L382 HydrophobicContact CG-CD1 3.82Å; L380-L382 HydrophobicContact CG-CG 4.13Å; L382-N385 VanDerWaalsContact C-ND2 3.33Å; L382-N385 WeakPolarHBondContact O-CB 3.12Å; L382-N385 PolarHBondContact O-ND2 3.26Å; L382-I387 HydrophobicContact CB-CD1 4.05Å; L382-I387 HydrophobicContact CD1-CD1 4.37Å; L382-I387 HydrophobicContact CD2-CD1 4.41Å; L382-D405 WeakPolarHBondContact CA-O 3.33Å; L382-D405 WeakPolarHBondContact CB-O 3.31Å; L382-D405 PolarHBondContact N-O 2.93Å; L382-L406 HydrophobicContact CB-CD2 3.98Å; L382-L406 HydrophobicContact CD1-CD2 3.91Å; L382-N409 PolarHBondContact O-ND2 3.36Å
383	R	87.4	Confident	87.2	Confident	6 Å²	6	39.1 Å²	39.1	2%	0.023	20%	0.197	C	C	.	.			trans	-61	154.6	177.8	-173.9	171.6	-71.6	-89	-11.2	112.5	N360 N361 N385 D405 G407 N408 D431	N360-R383 VanDerWaalsContact CA-O 3.3Å; N360-R383 WeakPolarHBondContact CA-O 3.03Å; N360-R383 PolarHBondContact OD1-N 3.19Å; N361-R383 PolarHBondContact N-O 3.3Å; R383-N385 VanDerWaalsContact C-N 3.31Å; R383-N385 PolarHBondContact O-N 3Å; R383-N385 PolarHBondContact O-ND2 3.49Å; R383-N385 VanDerWaalsContact O-ND2 3.08Å; R383-D405 IonicContact CZ-OD1 3.61Å; R383-D405 IonicContact CZ-OD2 3.88Å; R383-D405 IonicContact NE-OD1 4Å; R383-D405 PolarHBondContact NE-OD1 3.29Å; R383-D405 IonicContact NE-OD2 3.92Å; R383-D405 PolarHBondContact NE-OD2 2.91Å; R383-D405 IonicContact NH2-OD1 3.68Å; R383-D405 PolarHBondContact NH2-OD1 3.07Å; R383-D405 IonicContact NH2-OD2 3.4Å; R383-G407 VanDerWaalsContact CA-O 3.27Å; R383-G407 WeakPolarHBondContact CA-O 3.22Å; R383-N408 HydrophobicContact CG-CB 4.33Å; R383-D431 IonicContact CZ-OD1 3.7Å; R383-D431 IonicContact CZ-OD2 2.74Å; R383-D431 IonicContact NH1-OD1 2.69Å; R383-D431 PolarHBondContact NH1-OD1 3.02Å; R383-D431 IonicContact NH1-OD2 3.97Å; R383-D431 PolarHBondContact NH1-OD2 3.01Å; R383-D431 IonicContact NH2-OD1 3.23Å; R383-D431 PolarHBondContact NH2-OD1 2.74Å; R383-D431 IonicContact NH2-OD2 2.87Å
384	D	80.8	Confident	87.7	Confident	13 Å²	13	36.5 Å²	36.5	7%	0.07	19%	0.185	C	C	.	.	S	Bend	trans	58.5	36.7	179.6	-50.5	-42.5	0	0	0	114	N114 N361 G407 N408	N114-D384 PolarHBondContact ND2-OD1 2.92Å; N114-D384 PolarHBondContact ND2-OD2 2.76Å; N361-D384 WeakPolarHBondContact CA-O 3.23Å; N361-D384 HydrophobicContact CB-CB 3.88Å; D384-G407 PolarHBondContact N-O 2.93Å; D384-N408 VanDerWaalsContact CA-O 3.26Å; D384-N408 WeakPolarHBondContact CA-O 3.15Å; D384-N408 PolarHBondContact N-O 2.87Å; D384-N408 WeakPolarHBondContact OD1-CB 3.48Å; D384-N408 PolarHBondContact OD1-ND2 3.34Å
385	N	87.9	Confident	88.2	Confident	5 Å²	5	36 Å²	36	3%	0.027	18%	0.182	C	C	.	.			trans	-111.3	-178.1	177	-77.4	-70.5	0	0	0	110.9	C359 R362 N363 V364 L382 R383 I387 N408 N409	C359-N385 PolarHBondContact O-ND2 3.44Å; R362-N385 WeakPolarHBondContact CA-OD1 3.49Å; R362-N385 PolarHBondContact N-OD1 3.28Å; N363-N385 PolarHBondContact N-OD1 3.32Å; V364-N385 HydrophobicContact CB-CB 4.18Å; V364-N385 WeakPolarHBondContact CB-OD1 3.39Å; V364-N385 PolarHBondContact N-OD1 3.49Å; L382-N385 VanDerWaalsContact C-ND2 3.33Å; L382-N385 WeakPolarHBondContact O-CB 3.12Å; L382-N385 PolarHBondContact O-ND2 3.26Å; R383-N385 VanDerWaalsContact C-N 3.31Å; R383-N385 PolarHBondContact O-N 3Å; R383-N385 PolarHBondContact O-ND2 3.49Å; R383-N385 VanDerWaalsContact O-ND2 3.08Å; N385-I387 HydrophobicContact CB-CD1 4.09Å; N385-I387 HydrophobicContact CB-CG1 4.15Å; N385-N408 PolarHBondContact N-O 3.38Å; N385-N409 WeakPolarHBondContact CA-OD1 3.32Å; N385-N409 VanDerWaalsContact CB-OD1 3.27Å; N385-N409 WeakPolarHBondContact CB-OD1 3.15Å; N385-N409 PolarHBondContact N-ND2 2.99Å; N385-N409 PolarHBondContact O-OD1 2.79Å; N385-N409 VanDerWaalsContact O-OD1 3.1Å
386	K	89.9	Confident	88.9	Confident	67 Å²	67	35 Å²	35	29%	0.291	17%	0.173	S	C	.	.			trans	-114.2	37.4	-176.6	-63.6	-175.2	-175.8	-79.9	0	111	E43 N363 V364 H388 N410	E43-K386 IonicContact OE1-NZ 3.02Å; E43-K386 PolarHBondContact OE1-NZ 3.3Å; E43-K386 IonicContact OE2-NZ 3.93Å; N363-K386 WeakPolarHBondContact OD1-CE 3.36Å; V364-K386 CarbonylContact O-C 3.57Å; V364-K386 PolarHBondContact O-N 3.24Å; K386-H388 PolarHBondContact O-N 3.47Å; K386-N410 WeakPolarHBondContact CA-OD1 3.26Å
387	I	93.8	Very high	89.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.166	C	C	.	.			trans	-74.2	114	-176.6	-59.4	160.2	0	0	0	109	V364 L367 L382 N385 I390 L406 N409 N410 I411	V364-I387 HydrophobicContact CG1-CG1 4.34Å; V364-I387 PolarHBondContact O-N 3.25Å; L367-I387 HydrophobicContact CD1-CD1 3.72Å; L367-I387 HydrophobicContact CD1-CG1 4.11Å; L367-I387 HydrophobicContact CD1-CG2 3.63Å; L382-I387 HydrophobicContact CB-CD1 4.05Å; L382-I387 HydrophobicContact CD1-CD1 4.37Å; L382-I387 HydrophobicContact CD2-CD1 4.41Å; N385-I387 HydrophobicContact CB-CD1 4.09Å; N385-I387 HydrophobicContact CB-CG1 4.15Å; I387-I390 HydrophobicContact CG2-CG2 4.06Å; I387-L406 HydrophobicContact CD1-CD2 4.17Å; I387-N409 VanDerWaalsContact CB-OD1 3.27Å; I387-N409 WeakPolarHBondContact CB-OD1 3.35Å; I387-N409 WeakPolarHBondContact CD1-OD1 3.15Å; I387-N409 WeakPolarHBondContact CG1-OD1 3.49Å; I387-N409 PolarHBondContact N-OD1 3.06Å; I387-N410 CarbonylContact O-C 3.37Å; I387-N410 WeakPolarHBondContact O-CA 3.35Å; I387-N410 PolarHBondContact O-N 2.83Å; I387-I411 HydrophobicContact CB-CG1 4.32Å; I387-I411 HydrophobicContact CG2-CD1 4.39Å; I387-I411 HydrophobicContact CG2-CG1 4.12Å; I387-I411 WeakPolarHBondContact O-CG1 3.4Å; I387-I411 PolarHBondContact O-N 3.1Å; I387-I411 VanDerWaalsContact O-N 3.08Å
388	H	91.1	Very high	89.2	Confident	114 Å²	114	33.7 Å²	33.7	53%	0.528	17%	0.166	S	C	.	.			trans	-89.4	-29.3	-177.6	-175.3	-78.6	0	0	0	114.6	K386 N410 A412 T413	K386-H388 PolarHBondContact O-N 3.47Å; H388-N410 WeakPolarHBondContact CA-O 3.41Å; H388-A412 PolarHBondContact O-N 2.88Å; H388-T413 PolarHBondContact O-OG1 3.42Å
389	S	92.3	Very high	89.3	Confident	23 Å²	23	37.1 Å²	37.1	16%	0.161	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	137.3	-176.3	74.9	0	0	0	0	112.3	H394 T413	S389-H394 PolarHBondContact O-CE1 2.84Å; S389-T413 VanDerWaalsContact CA-O 3.31Å; S389-T413 WeakPolarHBondContact CA-O 3.47Å; S389-T413 WeakPolarHBondContact CB-OG1 3.38Å
390	I	94.7	Very high	89.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	141.1	172.1	61.5	174.2	0	0	0	111.3	L367 I387 F395 L406 I411 T413 V414 E415 T418 F419 M430	L367-I390 HydrophobicContact CD1-CG2 4.12Å; I387-I390 HydrophobicContact CG2-CG2 4.06Å; I390-F395 HydrophobicContact CB-CE2 4.22Å; I390-L406 HydrophobicContact CD1-CD1 4.16Å; I390-L406 HydrophobicContact CG2-CD1 4.44Å; I390-I411 HydrophobicContact CG1-CG2 4.41Å; I390-I411 HydrophobicContact CG2-CD1 4.05Å; I390-T413 PolarHBondContact N-O 2.84Å; I390-V414 HydrophobicContact CD1-CB 4.44Å; I390-V414 HydrophobicContact CD1-CG1 4.02Å; I390-V414 HydrophobicContact CD1-CG2 3.9Å; I390-V414 HydrophobicContact CG1-CB 4.14Å; I390-V414 HydrophobicContact CG1-CG1 3.99Å; I390-V414 HydrophobicContact CG1-CG2 3.85Å; I390-E415 PolarHBondContact O-N 2.94Å; I390-T418 HydrophobicContact CB-CG2 4.38Å; I390-T418 HydrophobicContact CD1-CG2 4.26Å; I390-T418 HydrophobicContact CG1-CG2 4.23Å; I390-F419 HydrophobicContact CD1-CE1 3.92Å; I390-F419 HydrophobicContact CD1-CE2 4.35Å; I390-F419 HydrophobicContact CD1-CZ 3.45Å; I390-F419 VanDerWaalsContact CD1-CZ 3.45Å; I390-M430 HydrophobicContact CD1-SD 4.46Å
391	R	93.4	Very high	89.5	Confident	133 Å²	133	40.1 Å²	40.1	50%	0.502	20%	0.196	S	C	.	.			trans	-138	153.6	-170.1	-63.3	-174.3	-167.1	-177.2	3.5	110.7	S393 H394 E415	R391-S393 PolarHBondContact O-N 2.84Å; R391-S393 VanDerWaalsContact O-N 3.13Å; R391-H394 PolarHBondContact N-ND1 3.42Å; R391-H394 VanDerWaalsContact O-CB 3.31Å; R391-H394 WeakPolarHBondContact O-CB 3.09Å; R391-H394 PolarHBondContact O-N 2.86Å; R391-E415 VanDerWaalsContact CA-OE2 3.26Å; R391-E415 WeakPolarHBondContact CA-OE2 3.29Å; R391-E415 HydrophobicContact CB-CB 4.48Å; R391-E415 VanDerWaalsContact CB-OE2 3.26Å; R391-E415 WeakPolarHBondContact CB-OE2 3.37Å; R391-E415 HydrophobicContact CG-CB 4.33Å
392	K	90.4	Very high	89.4	Confident	89 Å²	89	41.2 Å²	41.2	39%	0.387	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-32	179.8	-173.8	-176.2	174.1	-166.8	0	112.9	H394 F395 V396 E415	K392-H394 PolarHBondContact O-N 3.47Å; K392-F395 PolarHBondContact O-N 3.26Å; K392-V396 WeakPolarHBondContact O-CG2 3.22Å; K392-E415 PolarHBondContact N-OE2 3.29Å
393	S	89.8	Confident	89.2	Confident	72 Å²	72	41.2 Å²	41.2	50%	0.503	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.6	177.2	57.2	0	0	0	0	114.3	K373 R391	K373-S393 PolarHBondContact NZ-O 3.2Å; R391-S393 PolarHBondContact O-N 2.84Å; R391-S393 VanDerWaalsContact O-N 3.13Å
394	H	90.3	Very high	89.5	Confident	10 Å²	10	41 Å²	41	5%	0.046	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-45.5	178.6	-58.5	174.5	0	0	0	110.3	L367 K373 S389 R391 K392	L367-H394 HydrophobicContact CB-CB 3.82Å; L367-H394 HydrophobicContact CD2-CB 4.02Å; K373-H394 PolarHBondContact NZ-O 3.4Å; S389-H394 PolarHBondContact O-CE1 2.84Å; R391-H394 PolarHBondContact N-ND1 3.42Å; R391-H394 VanDerWaalsContact O-CB 3.31Å; R391-H394 WeakPolarHBondContact O-CB 3.09Å; R391-H394 PolarHBondContact O-N 2.86Å; K392-H394 PolarHBondContact O-N 3.47Å
395	F	91.1	Very high	89.9	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.009	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	8.4	-171.1	-57.5	-73	0	0	0	115.9	L367 I390 K392 D397 Y398 L401 L404 L406 T418 F419 L422	L367-F395 HydrophobicContact CD2-CD1 4.43Å; L367-F395 HydrophobicContact CD2-CE1 3.57Å; L367-F395 HydrophobicContact CD2-CE2 4.31Å; L367-F395 HydrophobicContact CD2-CZ 3.51Å; I390-F395 HydrophobicContact CB-CE2 4.22Å; K392-F395 PolarHBondContact O-N 3.26Å; F395-D397 PolarHBondContact O-N 3.49Å; F395-D397 VanDerWaalsContact O-N 3.17Å; F395-Y398 HydrophobicContact CD1-CD2 4.35Å; F395-Y398 PolarHBondContact O-N 3.36Å; F395-L401 HydrophobicContact CD1-CD1 4.29Å; F395-L404 HydrophobicContact CD1-CD2 4.39Å; F395-L404 HydrophobicContact CE1-CD1 4.1Å; F395-L404 HydrophobicContact CE1-CD2 3.57Å; F395-L404 HydrophobicContact CZ-CD2 3.79Å; F395-L406 HydrophobicContact CZ-CD1 4.48Å; F395-T418 HydrophobicContact CD2-CG2 3.54Å; F395-T418 HydrophobicContact CE2-CG2 3.52Å; F395-F419 HydrophobicContact CD2-CD1 4.43Å; F395-F419 HydrophobicContact CE2-CD1 4.31Å; F395-F419 HydrophobicContact CE2-CE1 4Å; F395-F419 HydrophobicContact CZ-CE1 4.26Å; F395-L422 HydrophobicContact CB-CD1 4.43Å; F395-L422 HydrophobicContact CB-CD2 4.2Å; F395-L422 HydrophobicContact CB-CG 4.44Å; F395-L422 HydrophobicContact CD1-CD1 4.2Å; F395-L422 HydrophobicContact CG-CD1 4.27Å
396	V	87.6	Confident	90.3	Very high	61 Å²	61	40.1 Å²	40.1	37%	0.37	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-36	-179.7	177.5	0	0	0	0	112.9	K392 K399	K392-V396 WeakPolarHBondContact O-CG2 3.22Å; V396-K399 WeakPolarHBondContact O-CE 3.47Å; V396-K399 WeakPolarHBondContact O-CG 3.33Å
397	D	85.1	Confident	90.2	Very high	70 Å²	70	37 Å²	37	37%	0.374	18%	0.183	S	C	.	.	S	Bend	trans	-99.1	-15.9	-170.4	-46.4	-83	0	0	0	112.8	K373 F395 K399	K373-D397 HydrophobicContact CD-CB 4.06Å; K373-D397 WeakPolarHBondContact CD-OD2 3.38Å; K373-D397 WeakPolarHBondContact CE-OD2 3.47Å; K373-D397 IonicContact NZ-OD2 2.65Å; K373-D397 PolarHBondContact NZ-OD2 2.92Å; F395-D397 PolarHBondContact O-N 3.49Å; F395-D397 VanDerWaalsContact O-N 3.17Å; D397-K399 PolarHBondContact O-N 2.94Å
398	Y	89	Confident	89.7	Confident	1 Å²	1	38.4 Å²	38.4	0%	0.004	19%	0.191	C	C	.	.			trans	-98.3	40.7	-175.2	-59.3	-58	0	0	0	112.2	M357 L374 V377 L380 F395 N400 L401 L422	M357-Y398 HydrophobicContact CE-CE1 4.08Å; L374-Y398 WeakPolarHBondContact O-CD1 3.44Å; L374-Y398 WeakPolarHBondContact O-CE1 3.37Å; V377-Y398 HydrophobicContact CB-CD1 4.08Å; V377-Y398 HydrophobicContact CB-CE1 4.44Å; V377-Y398 HydrophobicContact CG2-CD1 4.15Å; V377-Y398 HydrophobicContact CG2-CE1 4.05Å; L380-Y398 HydrophobicContact CD2-CD2 4.42Å; L380-Y398 HydrophobicContact CD2-CE2 4.47Å; F395-Y398 HydrophobicContact CD1-CD2 4.35Å; F395-Y398 PolarHBondContact O-N 3.36Å; Y398-N400 VanDerWaalsContact C-N 3.26Å; Y398-N400 PolarHBondContact O-N 2.58Å; Y398-L401 VanDerWaalsContact O-CG 3.29Å; Y398-L401 WeakPolarHBondContact O-CG 3.3Å; Y398-L401 PolarHBondContact O-N 2.8Å; Y398-L422 WeakPolarHBondContact O-CD2 3.24Å
399	K	88.3	Confident	89.6	Confident	110 Å²	110	33.3 Å²	33.3	48%	0.478	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-28.8	-170.1	-59	178.2	-172.1	170.9	0	114.3	V396 D397 L401	V396-K399 WeakPolarHBondContact O-CE 3.47Å; V396-K399 WeakPolarHBondContact O-CG 3.33Å; D397-K399 PolarHBondContact O-N 2.94Å; K399-L401 VanDerWaalsContact C-N 3.31Å; K399-L401 PolarHBondContact O-N 3.41Å
400	N	88.1	Confident	89.6	Confident	66 Å²	66	34.9 Å²	34.9	35%	0.353	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	13.5	-172.8	-48.9	8.3	0	0	0	112.3	V377 Y398 I402	V377-N400 CarbonylContact O-C 3.57Å; Y398-N400 VanDerWaalsContact C-N 3.26Å; Y398-N400 PolarHBondContact O-N 2.58Å; N400-I402 PolarHBondContact O-N 3.01Å
401	L	91.4	Very high	89.7	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.174	C	C	.	.			trans	-62.3	128.2	177.3	-73.6	173	0	0	0	110.1	V377 Q378 L380 F395 Y398 K399 L422 D424 L425	V377-L401 HydrophobicContact CB-CD2 4.38Å; V377-L401 HydrophobicContact CG1-CD2 3.83Å; Q378-L401 CarbonylContact O-C 3.57Å; Q378-L401 WeakPolarHBondContact O-CA 3.07Å; L380-L401 HydrophobicContact CB-CD1 4.45Å; L380-L401 HydrophobicContact CB-CD2 3.58Å; L380-L401 HydrophobicContact CD2-CD1 4.33Å; F395-L401 HydrophobicContact CD1-CD1 4.29Å; Y398-L401 VanDerWaalsContact O-CG 3.29Å; Y398-L401 WeakPolarHBondContact O-CG 3.3Å; Y398-L401 PolarHBondContact O-N 2.8Å; K399-L401 VanDerWaalsContact C-N 3.31Å; K399-L401 PolarHBondContact O-N 3.41Å; L401-L422 HydrophobicContact CB-CD2 4.46Å; L401-L422 HydrophobicContact CD1-CD1 4.26Å; L401-L422 HydrophobicContact CD1-CD2 4.24Å; L401-D424 CarbonylContact O-C 3.1Å; L401-D424 VanDerWaalsContact O-C 3.3Å; L401-L425 HydrophobicContact CB-CD1 3.71Å; L401-L425 WeakPolarHBondContact O-CA 3.36Å; L401-L425 PolarHBondContact O-N 3.01Å
402	I	84.8	Confident	89.6	Confident	23 Å²	23	30 Å²	30	12%	0.118	16%	0.162	C	C	.	.	S	Bend	trans	-100.8	-34.5	169.1	-40.1	-177.4	0	0	0	109.4	Q378 N400 R426 W427	Q378-I402 HydrophobicContact CB-CD1 4.4Å; Q378-I402 HydrophobicContact CB-CG1 4.24Å; Q378-I402 HydrophobicContact CG-CD1 4.41Å; Q378-I402 HydrophobicContact CG-CG1 4.48Å; Q378-I402 PolarHBondContact O-N 3.21Å; N400-I402 PolarHBondContact O-N 3.01Å; I402-R426 HydrophobicContact CG2-CB 4.14Å; I402-R426 HydrophobicContact CG2-CG 3.86Å; I402-R426 PolarHBondContact O-N 3.15Å; I402-W427 HydrophobicContact CB-CZ3 4.35Å; I402-W427 HydrophobicContact CG2-CE3 3.87Å; I402-W427 HydrophobicContact CG2-CZ3 3.48Å; I402-W427 VanDerWaalsContact CG2-CZ3 3.48Å; I402-W427 PolarHBondContact O-N 2.86Å; I402-W427 VanDerWaalsContact O-N 3.14Å
403	L	86.8	Confident	89.6	Confident	1 Å²	1	29 Å²	29	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.2	176.7	-167.7	139.7	0	0	0	112.6	Q378 E379 L380 F381 D405 W427 Y429	Q378-L403 PolarHBondContact O-N 3.45Å; Q378-L403 VanDerWaalsContact O-N 3.15Å; E379-L403 HydrophobicContact CB-CB 4.32Å; E379-L403 HydrophobicContact CG-CB 4.11Å; L380-L403 PolarHBondContact N-O 3.03Å; F381-L403 HydrophobicContact CE1-CD2 4.05Å; F381-L403 HydrophobicContact CE2-CD2 4.31Å; F381-L403 HydrophobicContact CZ-CD2 3.93Å; L403-D405 HydrophobicContact CD2-CB 4.36Å; L403-W427 HydrophobicContact CB-CB 4.23Å; L403-W427 HydrophobicContact CB-CE3 4.06Å; L403-W427 HydrophobicContact CD1-CB 3.74Å; L403-W427 HydrophobicContact CD1-CD2 4.02Å; L403-W427 HydrophobicContact CD1-CE3 4.06Å; L403-W427 HydrophobicContact CD1-CG 3.89Å; L403-W427 HydrophobicContact CG-CB 3.78Å; L403-W427 HydrophobicContact CG-CG 4.41Å; L403-Y429 HydrophobicContact CD1-CE2 3.99Å; L403-Y429 HydrophobicContact CD2-CE2 4.36Å; L403-Y429 HydrophobicContact CG-CE2 4.1Å
404	L	93.9	Very high	89.9	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	115.2	174.4	176.2	57.5	0	0	0	109.8	L380 F395 L406 F419 L422 L425 W427 L428 Y429	L380-L404 HydrophobicContact CB-CD1 4.11Å; L380-L404 HydrophobicContact CD2-CD1 3.98Å; L380-L404 HydrophobicContact CG-CD1 3.91Å; F395-L404 HydrophobicContact CD1-CD2 4.39Å; F395-L404 HydrophobicContact CE1-CD1 4.1Å; F395-L404 HydrophobicContact CE1-CD2 3.57Å; F395-L404 HydrophobicContact CZ-CD2 3.79Å; L404-L406 HydrophobicContact CD1-CD1 4.28Å; L404-L406 HydrophobicContact CD1-CD2 4.35Å; L404-L406 HydrophobicContact CD1-CG 4Å; L404-L406 HydrophobicContact CD2-CD1 3.98Å; L404-L406 HydrophobicContact CG-CD1 4.01Å; L404-L406 HydrophobicContact CG-CG 4.08Å; L404-F419 HydrophobicContact CD2-CE1 4.02Å; L404-L422 HydrophobicContact CD2-CD1 4.29Å; L404-L425 HydrophobicContact CB-CD1 3.79Å; L404-L425 HydrophobicContact CB-CD2 4.3Å; L404-W427 PolarHBondContact N-O 2.9Å; L404-L428 HydrophobicContact CB-CD1 4.19Å; L404-L428 HydrophobicContact CD2-CD1 3.99Å; L404-L428 HydrophobicContact CG-CD1 4.01Å; L404-L428 WeakPolarHBondContact O-CA 3.35Å; L404-Y429 PolarHBondContact O-N 2.82Å
405	D	89.1	Confident	90.1	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	117.5	174.9	179.4	15.4	0	0	0	110.5	L380 F381 L382 R383 L403 G407 Y429	L380-D405 PolarHBondContact O-N 3.27Å; F381-D405 HydrophobicContact CD1-CB 4.3Å; L382-D405 WeakPolarHBondContact CA-O 3.33Å; L382-D405 WeakPolarHBondContact CB-O 3.31Å; L382-D405 PolarHBondContact N-O 2.93Å; R383-D405 IonicContact CZ-OD1 3.61Å; R383-D405 IonicContact CZ-OD2 3.88Å; R383-D405 IonicContact NE-OD1 4Å; R383-D405 PolarHBondContact NE-OD1 3.29Å; R383-D405 IonicContact NE-OD2 3.92Å; R383-D405 PolarHBondContact NE-OD2 2.91Å; R383-D405 IonicContact NH2-OD1 3.68Å; R383-D405 PolarHBondContact NH2-OD1 3.07Å; R383-D405 IonicContact NH2-OD2 3.4Å; L403-D405 HydrophobicContact CD2-CB 4.36Å; D405-G407 PolarHBondContact OD1-N 3.02Å; D405-Y429 HydrophobicContact CB-CD2 4.11Å
406	L	94.9	Very high	90.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.184	C	C	.	.			trans	-124.6	18	177.8	-67.5	166.3	0	0	0	111.3	L382 I387 I390 F395 L404 N409 I411 Y429 M430 N433	L382-L406 HydrophobicContact CB-CD2 3.98Å; L382-L406 HydrophobicContact CD1-CD2 3.91Å; I387-L406 HydrophobicContact CD1-CD2 4.17Å; I390-L406 HydrophobicContact CD1-CD1 4.16Å; I390-L406 HydrophobicContact CG2-CD1 4.44Å; F395-L406 HydrophobicContact CZ-CD1 4.48Å; L404-L406 HydrophobicContact CD1-CD1 4.28Å; L404-L406 HydrophobicContact CD1-CD2 4.35Å; L404-L406 HydrophobicContact CD1-CG 4Å; L404-L406 HydrophobicContact CD2-CD1 3.98Å; L404-L406 HydrophobicContact CG-CD1 4.01Å; L404-L406 HydrophobicContact CG-CG 4.08Å; L406-N409 PolarHBondContact O-ND2 3.45Å; L406-I411 HydrophobicContact CB-CD1 3.88Å; L406-I411 HydrophobicContact CD1-CD1 4.22Å; L406-I411 HydrophobicContact CD2-CD1 4.31Å; L406-I411 HydrophobicContact CG-CD1 4.38Å; L406-Y429 WeakPolarHBondContact CA-O 3.4Å; L406-Y429 WeakPolarHBondContact CB-O 3.42Å; L406-Y429 PolarHBondContact N-O 2.86Å; L406-M430 HydrophobicContact CB-CG 4.33Å; L406-M430 HydrophobicContact CD1-CG 4.46Å; L406-N433 PolarHBondContact O-ND2 2.9Å
407	G	87.8	Confident	90.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.			trans	-64	163.3	-178.8	0	0	0	0	0	113.6	R383 D384 D405 N409 D431	R383-G407 VanDerWaalsContact CA-O 3.27Å; R383-G407 WeakPolarHBondContact CA-O 3.22Å; D384-G407 PolarHBondContact N-O 2.93Å; D405-G407 PolarHBondContact OD1-N 3.02Å; G407-N409 PolarHBondContact O-N 2.76Å; G407-N409 PolarHBondContact O-ND2 3.47Å; G407-D431 CarbonylContact C-O 3.13Å; G407-D431 VanDerWaalsContact CA-O 3.23Å; G407-D431 WeakPolarHBondContact CA-O 3.4Å; G407-D431 WeakPolarHBondContact CA-OD1 3.4Å
408	N	83.6	Confident	91	Very high	30 Å²	30	30.4 Å²	30.4	16%	0.16	16%	0.161	C	C	.	.	S	Bend	trans	44.7	64.1	-179.1	-156.5	22.7	0	0	0	112.8	E90 R383 D384 N385 D431 S432	E90-N408 PolarHBondContact OE1-ND2 2.86Å; R383-N408 HydrophobicContact CG-CB 4.33Å; D384-N408 VanDerWaalsContact CA-O 3.26Å; D384-N408 WeakPolarHBondContact CA-O 3.15Å; D384-N408 PolarHBondContact N-O 2.87Å; D384-N408 WeakPolarHBondContact OD1-CB 3.48Å; D384-N408 PolarHBondContact OD1-ND2 3.34Å; N385-N408 PolarHBondContact N-O 3.38Å; N408-D431 PolarHBondContact N-O 3.13Å; N408-S432 VanDerWaalsContact CA-O 3.24Å; N408-S432 WeakPolarHBondContact CA-O 3.44Å; N408-S432 PolarHBondContact N-O 3.46Å
409	N	90.3	Very high	91.3	Very high	7 Å²	7	30.4 Å²	30.4	4%	0.037	16%	0.161	C	C	.	.	S	Bend	trans	-141.1	175	-176.3	-96	-93.3	0	0	0	110.7	L382 N385 I387 L406 G407 I411 S432 N433	L382-N409 PolarHBondContact O-ND2 3.36Å; N385-N409 WeakPolarHBondContact CA-OD1 3.32Å; N385-N409 VanDerWaalsContact CB-OD1 3.27Å; N385-N409 WeakPolarHBondContact CB-OD1 3.15Å; N385-N409 PolarHBondContact N-ND2 2.99Å; N385-N409 PolarHBondContact O-OD1 2.79Å; N385-N409 VanDerWaalsContact O-OD1 3.1Å; I387-N409 VanDerWaalsContact CB-OD1 3.27Å; I387-N409 WeakPolarHBondContact CB-OD1 3.35Å; I387-N409 WeakPolarHBondContact CD1-OD1 3.15Å; I387-N409 WeakPolarHBondContact CG1-OD1 3.49Å; I387-N409 PolarHBondContact N-OD1 3.06Å; L406-N409 PolarHBondContact O-ND2 3.45Å; G407-N409 PolarHBondContact O-N 2.76Å; G407-N409 PolarHBondContact O-ND2 3.47Å; N409-I411 VanDerWaalsContact C-N 3.35Å; N409-I411 HydrophobicContact CB-CD1 4.38Å; N409-I411 HydrophobicContact CB-CG1 4.14Å; N409-I411 PolarHBondContact O-N 3.42Å; N409-S432 PolarHBondContact N-O 3.09Å; N409-N433 VanDerWaalsContact CB-OD1 3.23Å; N409-N433 WeakPolarHBondContact CB-OD1 3.5Å; N409-N433 PolarHBondContact O-OD1 2.92Å
410	N	92	Very high	91.4	Very high	57 Å²	57	30.2 Å²	30.2	31%	0.305	16%	0.16	S	C	.	.			trans	-91.6	23.7	-179.4	-67.2	92.9	0	0	0	113.9	K386 I387 H388 A412 Y434	K386-N410 WeakPolarHBondContact CA-OD1 3.26Å; I387-N410 CarbonylContact O-C 3.37Å; I387-N410 WeakPolarHBondContact O-CA 3.35Å; I387-N410 PolarHBondContact O-N 2.83Å; H388-N410 WeakPolarHBondContact CA-O 3.41Å; N410-A412 PolarHBondContact O-N 3.04Å; N410-Y434 HydrophobicContact CB-CE2 4.45Å
411	I	95.8	Very high	91.4	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.159	C	C	.	.			trans	-73.9	99.4	-168.9	-54.1	170.3	0	0	0	110.5	I387 I390 L406 N409 V414 N433 Y434 L435	I387-I411 HydrophobicContact CB-CG1 4.32Å; I387-I411 HydrophobicContact CG2-CD1 4.39Å; I387-I411 HydrophobicContact CG2-CG1 4.12Å; I387-I411 WeakPolarHBondContact O-CG1 3.4Å; I387-I411 PolarHBondContact O-N 3.1Å; I387-I411 VanDerWaalsContact O-N 3.08Å; I390-I411 HydrophobicContact CG1-CG2 4.41Å; I390-I411 HydrophobicContact CG2-CD1 4.05Å; L406-I411 HydrophobicContact CB-CD1 3.88Å; L406-I411 HydrophobicContact CD1-CD1 4.22Å; L406-I411 HydrophobicContact CD2-CD1 4.31Å; L406-I411 HydrophobicContact CG-CD1 4.38Å; N409-I411 VanDerWaalsContact C-N 3.35Å; N409-I411 HydrophobicContact CB-CD1 4.38Å; N409-I411 HydrophobicContact CB-CG1 4.14Å; N409-I411 PolarHBondContact O-N 3.42Å; I411-V414 HydrophobicContact CG2-CG2 4.29Å; I411-N433 WeakPolarHBondContact CA-OD1 3.38Å; I411-N433 WeakPolarHBondContact CB-OD1 3.26Å; I411-N433 VanDerWaalsContact CG1-OD1 3.27Å; I411-N433 WeakPolarHBondContact CG1-OD1 3.39Å; I411-N433 PolarHBondContact N-OD1 3.5Å; I411-Y434 CarbonylContact O-C 3.57Å; I411-Y434 PolarHBondContact O-N 3.32Å; I411-Y434 VanDerWaalsContact O-N 3.12Å; I411-L435 HydrophobicContact CG2-CD2 4.1Å; I411-L435 PolarHBondContact O-N 2.93Å
412	A	91.5	Very high	91.6	Very high	30 Å²	30	29.9 Å²	29.9	25%	0.248	16%	0.159	C	C	.	.			trans	-91.7	-18.1	168.2	0	0	0	0	0	112.8	H388 N410 Y434	H388-A412 PolarHBondContact O-N 2.88Å; N410-A412 PolarHBondContact O-N 3.04Å; A412-Y434 WeakPolarHBondContact CA-O 3.25Å
413	T	90.8	Very high	91.9	Very high	68 Å²	68	32.6 Å²	32.6	42%	0.417	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	125.2	-169.1	48.7	0	0	0	0	114.4	H388 S389 I390	H388-T413 PolarHBondContact O-OG1 3.42Å; S389-T413 VanDerWaalsContact CA-O 3.31Å; S389-T413 WeakPolarHBondContact CA-O 3.47Å; S389-T413 WeakPolarHBondContact CB-OG1 3.38Å; I390-T413 PolarHBondContact N-O 2.84Å
414	V	95.7	Very high	92.1	Very high	14 Å²	14	36.4 Å²	36.4	9%	0.085	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.5	173.9	-177.8	0	0	0	0	108.4	I390 I411 F419 L435 K442	I390-V414 HydrophobicContact CD1-CB 4.44Å; I390-V414 HydrophobicContact CD1-CG1 4.02Å; I390-V414 HydrophobicContact CD1-CG2 3.9Å; I390-V414 HydrophobicContact CG1-CB 4.14Å; I390-V414 HydrophobicContact CG1-CG1 3.99Å; I390-V414 HydrophobicContact CG1-CG2 3.85Å; I411-V414 HydrophobicContact CG2-CG2 4.29Å; V414-F419 HydrophobicContact CG1-CE2 4.21Å; V414-L435 HydrophobicContact CG2-CD2 3.72Å; V414-K442 HydrophobicContact CB-CB 4.37Å; V414-K442 HydrophobicContact CB-CD 4.22Å; V414-K442 HydrophobicContact CB-CG 4.26Å; V414-K442 HydrophobicContact CG1-CB 4Å; V414-K442 HydrophobicContact CG1-CG 4.37Å
415	E	94.2	Very high	92.1	Very high	94 Å²	94	36.4 Å²	36.4	44%	0.439	19%	0.194	S	C	.	.			trans	-69.5	139.2	175.9	-175.2	-169.8	-162.3	0	0	111	I390 R391 K392 N417 T418	I390-E415 PolarHBondContact O-N 2.94Å; R391-E415 VanDerWaalsContact CA-OE2 3.26Å; R391-E415 WeakPolarHBondContact CA-OE2 3.29Å; R391-E415 HydrophobicContact CB-CB 4.48Å; R391-E415 VanDerWaalsContact CB-OE2 3.26Å; R391-E415 WeakPolarHBondContact CB-OE2 3.37Å; R391-E415 HydrophobicContact CG-CB 4.33Å; K392-E415 PolarHBondContact N-OE2 3.29Å; E415-N417 PolarHBondContact O-N 2.97Å; E415-T418 WeakPolarHBondContact CB-OG1 3.37Å; E415-T418 PolarHBondContact N-OG1 2.99Å; E415-T418 VanDerWaalsContact O-CB 3.24Å; E415-T418 WeakPolarHBondContact O-CB 3.28Å; E415-T418 PolarHBondContact O-N 2.9Å; E415-T418 PolarHBondContact O-OG1 3.4Å
416	N	94.2	Very high	91.9	Very high	85 Å²	85	41.2 Å²	41.2	46%	0.455	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	133.4	175.9	-72.3	-1.4	0	0	0	111.5	T418 E441	N416-T418 VanDerWaalsContact C-N 3.31Å; N416-E441 HydrophobicContact CB-CB 3.88Å; N416-E441 VanDerWaalsContact CG-CB 3.47Å
417	N	93.9	Very high	91.3	Very high	48 Å²	48	41.9 Å²	41.9	26%	0.257	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	22.2	-174.3	-53.3	-111.3	0	0	0	114.3	E415 F419 K420 E441	E415-N417 PolarHBondContact O-N 2.97Å; N417-F419 VanDerWaalsContact C-N 3.33Å; N417-F419 PolarHBondContact O-N 2.92Å; N417-K420 HydrophobicContact CB-CB 4.06Å; N417-K420 HydrophobicContact CB-CD 3.9Å; N417-K420 VanDerWaalsContact O-CB 3.27Å; N417-K420 WeakPolarHBondContact O-CB 3.27Å; N417-K420 PolarHBondContact O-N 2.94Å; N417-K420 WeakPolarHBondContact OD1-CD 3.27Å; N417-K420 PolarHBondContact OD1-NZ 2.85Å; N417-E441 PolarHBondContact N-O 3.01Å
418	T	94.6	Very high	91.7	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.018	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-48.6	175.6	-76	0	0	0	0	112.1	I390 F395 E415 N416 K420	I390-T418 HydrophobicContact CB-CG2 4.38Å; I390-T418 HydrophobicContact CD1-CG2 4.26Å; I390-T418 HydrophobicContact CG1-CG2 4.23Å; F395-T418 HydrophobicContact CD2-CG2 3.54Å; F395-T418 HydrophobicContact CE2-CG2 3.52Å; E415-T418 WeakPolarHBondContact CB-OG1 3.37Å; E415-T418 PolarHBondContact N-OG1 2.99Å; E415-T418 VanDerWaalsContact O-CB 3.24Å; E415-T418 WeakPolarHBondContact O-CB 3.28Å; E415-T418 PolarHBondContact O-N 2.9Å; E415-T418 PolarHBondContact O-OG1 3.4Å; N416-T418 VanDerWaalsContact C-N 3.31Å; T418-K420 VanDerWaalsContact C-N 3.32Å; T418-K420 PolarHBondContact O-N 2.98Å
419	F	95.3	Very high	91.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	12.2	-175.3	-51.9	-62.3	0	0	0	114.4	I390 F395 L404 V414 N417 N421 L422 L428 M430 K442 F443 L446	I390-F419 HydrophobicContact CD1-CE1 3.92Å; I390-F419 HydrophobicContact CD1-CE2 4.35Å; I390-F419 HydrophobicContact CD1-CZ 3.45Å; I390-F419 VanDerWaalsContact CD1-CZ 3.45Å; F395-F419 HydrophobicContact CD2-CD1 4.43Å; F395-F419 HydrophobicContact CE2-CD1 4.31Å; F395-F419 HydrophobicContact CE2-CE1 4Å; F395-F419 HydrophobicContact CZ-CE1 4.26Å; L404-F419 HydrophobicContact CD2-CE1 4.02Å; V414-F419 HydrophobicContact CG1-CE2 4.21Å; N417-F419 VanDerWaalsContact C-N 3.33Å; N417-F419 PolarHBondContact O-N 2.92Å; F419-N421 PolarHBondContact O-N 2.87Å; F419-L422 HydrophobicContact CB-CD1 4.41Å; F419-L422 HydrophobicContact CD1-CD1 3.82Å; F419-L422 PolarHBondContact O-N 3.31Å; F419-L428 HydrophobicContact CE2-CD2 4.08Å; F419-L428 HydrophobicContact CZ-CD1 4.5Å; F419-L428 HydrophobicContact CZ-CD2 4.02Å; F419-M430 HydrophobicContact CZ-SD 4.09Å; F419-K442 WeakPolarHBondContact CD2-O 3.43Å; F419-F443 HydrophobicContact CE2-CD1 4.36Å; F419-L446 HydrophobicContact CB-CD1 4.07Å; F419-L446 HydrophobicContact CB-CD2 3.72Å; F419-L446 HydrophobicContact CB-CG 3.74Å; F419-L446 HydrophobicContact CD2-CD1 3.83Å; F419-L446 HydrophobicContact CD2-CG 4.44Å; F419-L446 HydrophobicContact CG-CD1 4.09Å; F419-L446 HydrophobicContact CG-CD2 4.28Å; F419-L446 HydrophobicContact CG-CG 4.3Å
420	K	91.1	Very high	92.1	Very high	106 Å²	106	40.8 Å²	40.8	46%	0.461	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-19.9	-169.2	-173.6	156.9	-171.5	161.8	0	116.4	N417 T418 A444	N417-K420 HydrophobicContact CB-CB 4.06Å; N417-K420 HydrophobicContact CB-CD 3.9Å; N417-K420 VanDerWaalsContact O-CB 3.27Å; N417-K420 WeakPolarHBondContact O-CB 3.27Å; N417-K420 PolarHBondContact O-N 2.94Å; N417-K420 WeakPolarHBondContact OD1-CD 3.27Å; N417-K420 PolarHBondContact OD1-NZ 2.85Å; T418-K420 VanDerWaalsContact C-N 3.32Å; T418-K420 PolarHBondContact O-N 2.98Å; K420-A444 WeakPolarHBondContact CA-O 3.13Å; K420-A444 PolarHBondContact N-O 2.88Å
421	N	88.9	Confident	91.9	Very high	59 Å²	59	38.1 Å²	38.1	32%	0.316	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-3.7	179.9	-60.9	-8.4	0	0	0	113.2	F419 L423	F419-N421 PolarHBondContact O-N 2.87Å; N421-L423 VanDerWaalsContact C-N 3.29Å; N421-L423 PolarHBondContact O-N 2.88Å; N421-L423 VanDerWaalsContact O-N 3.15Å
422	L	94	Very high	91.4	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.198	C	C	.	.			trans	-89.9	65	-177	-57.7	-168.5	0	0	0	110	F395 Y398 L401 L404 F419 D424 L425 L446	F395-L422 HydrophobicContact CB-CD1 4.43Å; F395-L422 HydrophobicContact CB-CD2 4.2Å; F395-L422 HydrophobicContact CB-CG 4.44Å; F395-L422 HydrophobicContact CD1-CD1 4.2Å; F395-L422 HydrophobicContact CG-CD1 4.27Å; Y398-L422 WeakPolarHBondContact O-CD2 3.24Å; L401-L422 HydrophobicContact CB-CD2 4.46Å; L401-L422 HydrophobicContact CD1-CD1 4.26Å; L401-L422 HydrophobicContact CD1-CD2 4.24Å; L404-L422 HydrophobicContact CD2-CD1 4.29Å; F419-L422 HydrophobicContact CB-CD1 4.41Å; F419-L422 HydrophobicContact CD1-CD1 3.82Å; F419-L422 PolarHBondContact O-N 3.31Å; L422-D424 VanDerWaalsContact C-N 3.32Å; L422-D424 PolarHBondContact O-N 2.71Å; L422-L425 HydrophobicContact CB-CB 4.11Å; L422-L425 HydrophobicContact CD1-CD2 4.24Å; L422-L446 HydrophobicContact CB-CD2 4.13Å
423	L	92.1	Very high	91.5	Very high	79 Å²	79	37.6 Å²	37.6	41%	0.414	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-30.7	-173.9	-59.3	-178.4	0	0	0	112.3	N421 G445 N448	N421-L423 VanDerWaalsContact C-N 3.29Å; N421-L423 PolarHBondContact O-N 2.88Å; N421-L423 VanDerWaalsContact O-N 3.15Å; L423-G445 WeakPolarHBondContact CD2-O 3.44Å; L423-N448 WeakPolarHBondContact O-CB 3.36Å; L423-N448 PolarHBondContact O-ND2 3.24Å
424	D	90.1	Very high	91.6	Very high	82 Å²	82	39.2 Å²	39.2	44%	0.439	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-0.7	-174.9	-58.2	-46.5	0	0	0	113.7	L401 L422 R426	L401-D424 CarbonylContact O-C 3.1Å; L401-D424 VanDerWaalsContact O-C 3.3Å; L422-D424 VanDerWaalsContact C-N 3.32Å; L422-D424 PolarHBondContact O-N 2.71Å; D424-R426 PolarHBondContact O-N 2.87Å
425	L	93.9	Very high	91.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.183	C	C	.	.			trans	-68.7	124.1	-177.5	-163.8	79.8	0	0	0	110.6	L401 L404 L422 L428 L446 N448 L449	L401-L425 HydrophobicContact CB-CD1 3.71Å; L401-L425 WeakPolarHBondContact O-CA 3.36Å; L401-L425 PolarHBondContact O-N 3.01Å; L404-L425 HydrophobicContact CB-CD1 3.79Å; L404-L425 HydrophobicContact CB-CD2 4.3Å; L422-L425 HydrophobicContact CB-CB 4.11Å; L422-L425 HydrophobicContact CD1-CD2 4.24Å; L425-L428 HydrophobicContact CD2-CB 4.16Å; L425-L446 HydrophobicContact CB-CD2 3.97Å; L425-L446 HydrophobicContact CD2-CD2 3.54Å; L425-L446 HydrophobicContact CG-CD2 4.34Å; L425-N448 CarbonylContact O-C 3.3Å; L425-L449 HydrophobicContact CB-CD1 4.47Å; L425-L449 HydrophobicContact CD2-CD1 3.95Å; L425-L449 HydrophobicContact CG-CD1 4.03Å; L425-L449 VanDerWaalsContact O-CA 3.22Å; L425-L449 WeakPolarHBondContact O-CA 3.49Å; L425-L449 PolarHBondContact O-N 2.94Å
426	R	85.7	Confident	91.5	Very high	102 Å²	102	37.7 Å²	37.7	39%	0.385	18%	0.181	S	C	.	.			trans	-106.6	-34.9	177.9	-64.2	-179.8	-169.8	-113.5	9.9	112.8	I402 D424 L449 E450 Y451	I402-R426 HydrophobicContact CG2-CB 4.14Å; I402-R426 HydrophobicContact CG2-CG 3.86Å; I402-R426 PolarHBondContact O-N 3.15Å; D424-R426 PolarHBondContact O-N 2.87Å; R426-L449 VanDerWaalsContact C-CD1 3.49Å; R426-L449 WeakPolarHBondContact O-CD1 3.12Å; R426-E450 IonicContact CZ-OE1 3.68Å; R426-E450 IonicContact NE-OE1 3.15Å; R426-E450 IonicContact NH1-OE1 2.93Å; R426-E450 PolarHBondContact NH1-OE1 2.9Å; R426-E450 PolarHBondContact O-N 3.45Å; R426-Y451 PolarHBondContact O-N 3.18Å
427	W	83.1	Confident	91.5	Very high	14 Å²	14	35.1 Å²	35.1	5%	0.053	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	124.9	-175.2	-61.1	-85.3	0	0	0	111.4	I402 L403 L404 Y429	I402-W427 HydrophobicContact CB-CZ3 4.35Å; I402-W427 HydrophobicContact CG2-CE3 3.87Å; I402-W427 HydrophobicContact CG2-CZ3 3.48Å; I402-W427 VanDerWaalsContact CG2-CZ3 3.48Å; I402-W427 PolarHBondContact O-N 2.86Å; I402-W427 VanDerWaalsContact O-N 3.14Å; L403-W427 HydrophobicContact CB-CB 4.23Å; L403-W427 HydrophobicContact CB-CE3 4.06Å; L403-W427 HydrophobicContact CD1-CB 3.74Å; L403-W427 HydrophobicContact CD1-CD2 4.02Å; L403-W427 HydrophobicContact CD1-CE3 4.06Å; L403-W427 HydrophobicContact CD1-CG 3.89Å; L403-W427 HydrophobicContact CG-CB 3.78Å; L403-W427 HydrophobicContact CG-CG 4.41Å; L404-W427 PolarHBondContact N-O 2.9Å; W427-Y429 HydrophobicContact CB-CE2 3.86Å
428	L	94.8	Very high	91.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	112.9	173.8	178.9	55.4	0	0	0	110.5	L404 F419 L425 M430 F443 L446 L449 Y451 L452 N453	L404-L428 HydrophobicContact CB-CD1 4.19Å; L404-L428 HydrophobicContact CD2-CD1 3.99Å; L404-L428 HydrophobicContact CG-CD1 4.01Å; L404-L428 WeakPolarHBondContact O-CA 3.35Å; F419-L428 HydrophobicContact CE2-CD2 4.08Å; F419-L428 HydrophobicContact CZ-CD1 4.5Å; F419-L428 HydrophobicContact CZ-CD2 4.02Å; L425-L428 HydrophobicContact CD2-CB 4.16Å; L428-M430 HydrophobicContact CD1-CG 3.83Å; L428-M430 HydrophobicContact CD1-SD 4.15Å; L428-M430 HydrophobicContact CD2-CE 4.25Å; L428-M430 HydrophobicContact CD2-SD 4.23Å; L428-M430 HydrophobicContact CG-CG 4.05Å; L428-M430 HydrophobicContact CG-SD 4.29Å; L428-F443 HydrophobicContact CD2-CD1 4.45Å; L428-F443 HydrophobicContact CD2-CE1 4.27Å; L428-L446 HydrophobicContact CD2-CD1 3.9Å; L428-L449 HydrophobicContact CB-CD1 3.77Å; L428-L449 HydrophobicContact CB-CD2 4.25Å; L428-Y451 PolarHBondContact N-O 3.11Å; L428-L452 HydrophobicContact CB-CD1 4.16Å; L428-L452 HydrophobicContact CD2-CD1 3.95Å; L428-L452 HydrophobicContact CG-CD1 3.97Å; L428-N453 PolarHBondContact O-N 3.31Å; L428-N453 VanDerWaalsContact O-N 3.07Å
429	Y	89	Confident	91.7	Very high	12 Å²	12	33.2 Å²	33.2	5%	0.047	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.3	173.5	-49.9	-97.3	0	0	0	108.8	E206 L208 L403 L404 D405 L406 W427 Y451 N453	E206-Y429 PolarHBondContact OE1-OH 3.29Å; L208-Y429 VanDerWaalsContact CD1-OH 3.32Å; L208-Y429 WeakPolarHBondContact CD1-OH 3.36Å; L403-Y429 HydrophobicContact CD1-CE2 3.99Å; L403-Y429 HydrophobicContact CD2-CE2 4.36Å; L403-Y429 HydrophobicContact CG-CE2 4.1Å; L404-Y429 PolarHBondContact O-N 2.82Å; D405-Y429 HydrophobicContact CB-CD2 4.11Å; L406-Y429 WeakPolarHBondContact CA-O 3.4Å; L406-Y429 WeakPolarHBondContact CB-O 3.42Å; L406-Y429 PolarHBondContact N-O 2.86Å; W427-Y429 HydrophobicContact CB-CE2 3.86Å; Y429-Y451 AromaticContact CD1-CE1 3.61Å; Y429-Y451 HydrophobicContact CD1-CE1 3.61Å; Y429-Y451 HydrophobicContact CE1-CD1 4.1Å; Y429-Y451 AromaticContact CE1-CE1 3.26Å; Y429-Y451 HydrophobicContact CE1-CE1 3.26Å; Y429-Y451 AromaticContact CE1-CZ 3.67Å; Y429-Y451 HydrophobicContact CG-CE1 4.42Å; Y429-Y451 AromaticContact CZ-CE1 3.84Å; Y429-N453 HydrophobicContact CD1-CB 4.36Å
430	M	94.5	Very high	91.6	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	18%	0.183	C	C	.	.			trans	-137.3	30.1	172.6	-57.1	-171.4	-54.1	0	0	110	I390 L406 F419 L428 L435 F443 L452 N453 V454 N457	I390-M430 HydrophobicContact CD1-SD 4.46Å; L406-M430 HydrophobicContact CB-CG 4.33Å; L406-M430 HydrophobicContact CD1-CG 4.46Å; F419-M430 HydrophobicContact CZ-SD 4.09Å; L428-M430 HydrophobicContact CD1-CG 3.83Å; L428-M430 HydrophobicContact CD1-SD 4.15Å; L428-M430 HydrophobicContact CD2-CE 4.25Å; L428-M430 HydrophobicContact CD2-SD 4.23Å; L428-M430 HydrophobicContact CG-CG 4.05Å; L428-M430 HydrophobicContact CG-SD 4.29Å; M430-L435 HydrophobicContact CB-CD1 4.39Å; M430-L435 HydrophobicContact CE-CD1 3.83Å; M430-F443 HydrophobicContact CE-CE1 3.57Å; M430-F443 HydrophobicContact CE-CZ 3.76Å; M430-L452 HydrophobicContact CE-CD1 4.33Å; M430-N453 CarbonylContact C-O 3.59Å; M430-N453 PolarHBondContact N-O 2.83Å; M430-V454 HydrophobicContact CB-CG1 4.23Å; M430-V454 HydrophobicContact CE-CG1 3.79Å; M430-N457 PolarHBondContact O-ND2 3.44Å
431	D	87.8	Confident	91.8	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.178	C	C	.	.			trans	-61.9	156.6	174.1	60.5	-72.6	0	0	0	111.8	Y134 R383 G407 N408 N433 E455	Y134-D431 PolarHBondContact OH-OD2 3.41Å; R383-D431 IonicContact CZ-OD1 3.7Å; R383-D431 IonicContact CZ-OD2 2.74Å; R383-D431 IonicContact NH1-OD1 2.69Å; R383-D431 PolarHBondContact NH1-OD1 3.02Å; R383-D431 IonicContact NH1-OD2 3.97Å; R383-D431 PolarHBondContact NH1-OD2 3.01Å; R383-D431 IonicContact NH2-OD1 3.23Å; R383-D431 PolarHBondContact NH2-OD1 2.74Å; R383-D431 IonicContact NH2-OD2 2.87Å; G407-D431 CarbonylContact C-O 3.13Å; G407-D431 VanDerWaalsContact CA-O 3.23Å; G407-D431 WeakPolarHBondContact CA-O 3.4Å; G407-D431 WeakPolarHBondContact CA-OD1 3.4Å; N408-D431 PolarHBondContact N-O 3.13Å; D431-N433 PolarHBondContact O-N 3.41Å; D431-N433 PolarHBondContact O-ND2 3.15Å; D431-E455 WeakPolarHBondContact CA-O 3.2Å; D431-E455 HydrophobicContact CB-CG 3.49Å; D431-E455 VanDerWaalsContact CB-CG 3.49Å
432	S	84.6	Confident	92.1	Very high	15 Å²	15	36.5 Å²	36.5	11%	0.105	17%	0.168	C	C	.	.	S	Bend	trans	56.3	55.8	171.8	-37.5	0	0	0	0	111.4	R110 N408 N409 E455 Y456	R110-S432 PolarHBondContact NH1-OG 2.93Å; N408-S432 VanDerWaalsContact CA-O 3.24Å; N408-S432 WeakPolarHBondContact CA-O 3.44Å; N408-S432 PolarHBondContact N-O 3.46Å; N409-S432 PolarHBondContact N-O 3.09Å; S432-E455 PolarHBondContact N-O 3.19Å; S432-Y456 VanDerWaalsContact CA-O 3.25Å; S432-Y456 WeakPolarHBondContact CA-O 3.42Å; S432-Y456 PolarHBondContact N-O 2.78Å
433	N	92.4	Very high	92.1	Very high	6 Å²	6	36.6 Å²	36.6	3%	0.032	17%	0.168	C	C	.	.	S	Bend	trans	-139.9	-171.4	-175.8	-90.1	-89.8	0	0	0	109.7	L406 N409 I411 D431 Y456 N457	L406-N433 PolarHBondContact O-ND2 2.9Å; N409-N433 VanDerWaalsContact CB-OD1 3.23Å; N409-N433 WeakPolarHBondContact CB-OD1 3.5Å; N409-N433 PolarHBondContact O-OD1 2.92Å; I411-N433 WeakPolarHBondContact CA-OD1 3.38Å; I411-N433 WeakPolarHBondContact CB-OD1 3.26Å; I411-N433 VanDerWaalsContact CG1-OD1 3.27Å; I411-N433 WeakPolarHBondContact CG1-OD1 3.39Å; I411-N433 PolarHBondContact N-OD1 3.5Å; D431-N433 PolarHBondContact O-N 3.41Å; D431-N433 PolarHBondContact O-ND2 3.15Å; N433-Y456 PolarHBondContact N-O 3.42Å; N433-N457 WeakPolarHBondContact CB-OD1 3.34Å; N433-N457 WeakPolarHBondContact O-CA 3.36Å; N433-N457 PolarHBondContact O-OD1 3.42Å
434	Y	92.9	Very high	92.2	Very high	102 Å²	102	34 Å²	34	40%	0.4	16%	0.158	S	C	.	.			trans	-117.5	34.8	-174	-59.2	-79.1	0	0	0	113.4	N410 I411 A412 D436 N457	N410-Y434 HydrophobicContact CB-CE2 4.45Å; I411-Y434 CarbonylContact O-C 3.57Å; I411-Y434 PolarHBondContact O-N 3.32Å; I411-Y434 VanDerWaalsContact O-N 3.12Å; A412-Y434 WeakPolarHBondContact CA-O 3.25Å; Y434-D436 PolarHBondContact O-N 3.48Å; Y434-N457 PolarHBondContact N-OD1 2.88Å
435	L	95.5	Very high	92.1	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.01	14%	0.143	C	C	.	.			trans	-71	126	179.8	-60.9	175.1	0	0	0	111.4	I411 V414 M430 V454 N457 A458 I459	I411-L435 HydrophobicContact CG2-CD2 4.1Å; I411-L435 PolarHBondContact O-N 2.93Å; V414-L435 HydrophobicContact CG2-CD2 3.72Å; M430-L435 HydrophobicContact CB-CD1 4.39Å; M430-L435 HydrophobicContact CE-CD1 3.83Å; L435-V454 HydrophobicContact CD1-CG1 4.38Å; L435-N457 HydrophobicContact CB-CB 4.26Å; L435-N457 VanDerWaalsContact CB-OD1 3.25Å; L435-N457 WeakPolarHBondContact CB-OD1 3.4Å; L435-N457 VanDerWaalsContact CG-OD1 3.25Å; L435-N457 WeakPolarHBondContact CG-OD1 3.32Å; L435-N457 PolarHBondContact N-OD1 2.97Å; L435-A458 CarbonylContact O-C 3.17Å; L435-A458 WeakPolarHBondContact O-CA 3.08Å; L435-A458 PolarHBondContact O-N 2.89Å; L435-A458 VanDerWaalsContact O-N 3.07Å; L435-I459 HydrophobicContact CB-CG1 4.24Å; L435-I459 WeakPolarHBondContact O-CA 3.09Å; L435-I459 VanDerWaalsContact O-CG1 3.23Å; L435-I459 WeakPolarHBondContact O-CG1 3.47Å; L435-I459 PolarHBondContact O-N 3.05Å; L435-I459 VanDerWaalsContact O-N 3.1Å
436	D	92.6	Very high	92.2	Very high	74 Å²	74	30.7 Å²	30.7	40%	0.396	14%	0.143	S	C	.	.			trans	-86.2	-35.2	-177.1	66.8	-27.8	0	0	0	113.8	Y434 K442 I459 Q460	Y434-D436 PolarHBondContact O-N 3.48Å; D436-K442 IonicContact OD1-NZ 3.65Å; D436-K442 PolarHBondContact OD1-NZ 2.86Å; D436-I459 WeakPolarHBondContact O-CA 3.19Å; D436-Q460 PolarHBondContact O-N 3.27Å
437	T	94.9	Very high	92.6	Very high	30 Å²	30	31.4 Å²	31.4	18%	0.184	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	141.9	-164.4	56	0	0	0	0	111.4	K442 L461	T437-K442 PolarHBondContact O-NZ 2.93Å; T437-K442 PolarHBondContact OG1-NZ 2.8Å; T437-L461 VanDerWaalsContact CA-O 3.26Å; T437-L461 WeakPolarHBondContact CA-O 3.46Å; T437-L461 HydrophobicContact CG2-CB 4.32Å
438	L	96.4	Very high	93	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	126.8	171.5	-53.8	-173.4	0	0	0	110.4	F443 V454 I459 L461 I462 F463 T466 F467 L478	L438-F443 HydrophobicContact CB-CE2 4.21Å; L438-F443 HydrophobicContact CD2-CE2 3.9Å; L438-F443 HydrophobicContact CD2-CZ 3.98Å; L438-F443 HydrophobicContact CG-CE2 4.49Å; L438-V454 HydrophobicContact CD1-CG2 4.31Å; L438-I459 HydrophobicContact CD1-CD1 4.03Å; L438-I459 HydrophobicContact CD2-CD1 3.76Å; L438-I459 HydrophobicContact CD2-CG1 4.34Å; L438-I459 HydrophobicContact CG-CD1 3.92Å; L438-I459 HydrophobicContact CG-CG1 4.47Å; L438-I459 HydrophobicContact CG-CG2 3.99Å; L438-L461 PolarHBondContact N-O 2.87Å; L438-I462 HydrophobicContact CB-CG1 4.3Å; L438-I462 HydrophobicContact CB-CG2 4.35Å; L438-I462 HydrophobicContact CD1-CD1 4.4Å; L438-I462 HydrophobicContact CD1-CG1 4.21Å; L438-I462 HydrophobicContact CG-CG1 4.39Å; L438-F463 WeakPolarHBondContact O-CD2 3.46Å; L438-F463 PolarHBondContact O-N 3.24Å; L438-T466 HydrophobicContact CB-CG2 3.95Å; L438-T466 PolarHBondContact O-OG1 2.98Å; L438-F467 HydrophobicContact CD1-CE1 4.28Å; L438-F467 HydrophobicContact CD1-CZ 4.09Å; L438-L478 HydrophobicContact CD1-CD2 3.84Å
439	S	95.4	Very high	93.1	Very high	10 Å²	10	32.5 Å²	32.5	7%	0.07	16%	0.158	C	C	.	.			trans	-132.7	151.9	175.3	101.4	0	0	0	0	111.7	E441 K442 F443 T466	S439-E441 WeakPolarHBondContact CB-OE2 3.39Å; S439-E441 PolarHBondContact O-N 2.82Å; S439-E441 VanDerWaalsContact O-N 3.13Å; S439-E441 PolarHBondContact OG-N 3.46Å; S439-E441 PolarHBondContact OG-OE2 3.01Å; S439-K442 PolarHBondContact O-N 3.32Å; S439-K442 VanDerWaalsContact O-N 3.11Å; S439-F443 WeakPolarHBondContact O-CD2 3.45Å; S439-T466 WeakPolarHBondContact CA-OG1 3.45Å
440	R	94.7	Very high	92.9	Very high	134 Å²	134	33.5 Å²	33.5	51%	0.506	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-32.8	179.3	-172.1	176.4	171	-111.4	1.9	113.1	A444 G465 T466 A469	R440-A444 WeakPolarHBondContact O-CB 3.49Å; R440-A444 PolarHBondContact O-N 3.27Å; R440-A444 VanDerWaalsContact O-N 3.08Å; R440-G465 WeakPolarHBondContact CD-O 3.38Å; R440-T466 PolarHBondContact N-OG1 2.85Å; R440-A469 HydrophobicContact CG-CB 4.29Å
441	E	94.5	Very high	92.3	Very high	78 Å²	78	33.7 Å²	33.7	36%	0.364	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-35.1	-178.2	-60.8	64.4	-138	0	0	112.2	N416 N417 S439 F443	N416-E441 HydrophobicContact CB-CB 3.88Å; N416-E441 VanDerWaalsContact CG-CB 3.47Å; N417-E441 PolarHBondContact N-O 3.01Å; S439-E441 WeakPolarHBondContact CB-OE2 3.39Å; S439-E441 PolarHBondContact O-N 2.82Å; S439-E441 VanDerWaalsContact O-N 3.13Å; S439-E441 PolarHBondContact OG-N 3.46Å; S439-E441 PolarHBondContact OG-OE2 3.01Å; E441-F443 VanDerWaalsContact C-N 3.32Å; E441-F443 PolarHBondContact O-N 3.39Å
442	K	94.5	Very high	92.6	Very high	23 Å²	23	33.6 Å²	33.6	10%	0.1	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-42.7	176.3	-65.4	-177.7	179.8	-177.5	0	110.3	V414 F419 D436 T437 S439	V414-K442 HydrophobicContact CB-CB 4.37Å; V414-K442 HydrophobicContact CB-CD 4.22Å; V414-K442 HydrophobicContact CB-CG 4.26Å; V414-K442 HydrophobicContact CG1-CB 4Å; V414-K442 HydrophobicContact CG1-CG 4.37Å; F419-K442 WeakPolarHBondContact CD2-O 3.43Å; D436-K442 IonicContact OD1-NZ 3.65Å; D436-K442 PolarHBondContact OD1-NZ 2.86Å; T437-K442 PolarHBondContact O-NZ 2.93Å; T437-K442 PolarHBondContact OG1-NZ 2.8Å; S439-K442 PolarHBondContact O-N 3.32Å; S439-K442 VanDerWaalsContact O-N 3.11Å
443	F	95.1	Very high	92.7	Very high	3 Å²	3	33.3 Å²	33.3	1%	0.013	16%	0.16	C	C	.	.	S	Bend	trans	-93.8	0.8	-176.8	-61.7	-79.7	0	0	0	115.6	F419 L428 M430 L438 S439 E441 G445 L446 L452 T466 A469 M470	F419-F443 HydrophobicContact CE2-CD1 4.36Å; L428-F443 HydrophobicContact CD2-CD1 4.45Å; L428-F443 HydrophobicContact CD2-CE1 4.27Å; M430-F443 HydrophobicContact CE-CE1 3.57Å; M430-F443 HydrophobicContact CE-CZ 3.76Å; L438-F443 HydrophobicContact CB-CE2 4.21Å; L438-F443 HydrophobicContact CD2-CE2 3.9Å; L438-F443 HydrophobicContact CD2-CZ 3.98Å; L438-F443 HydrophobicContact CG-CE2 4.49Å; S439-F443 WeakPolarHBondContact O-CD2 3.45Å; E441-F443 VanDerWaalsContact C-N 3.32Å; E441-F443 PolarHBondContact O-N 3.39Å; F443-G445 PolarHBondContact O-N 2.99Å; F443-L446 HydrophobicContact CB-CD1 4.28Å; F443-L446 HydrophobicContact CD1-CD1 3.92Å; F443-L446 PolarHBondContact O-N 2.93Å; F443-L452 HydrophobicContact CD1-CD2 4.45Å; F443-L452 HydrophobicContact CE1-CD1 4Å; F443-L452 HydrophobicContact CE1-CD2 3.99Å; F443-L452 HydrophobicContact CZ-CD2 4.26Å; F443-T466 HydrophobicContact CD2-CG2 4.26Å; F443-A469 HydrophobicContact CB-CB 4.12Å; F443-M470 HydrophobicContact CB-CE 3.71Å; F443-M470 HydrophobicContact CB-SD 3.94Å; F443-M470 HydrophobicContact CD1-CE 4.12Å; F443-M470 HydrophobicContact CD1-SD 3.96Å; F443-M470 HydrophobicContact CD2-CE 4.34Å; F443-M470 HydrophobicContact CG-CE 3.79Å; F443-M470 HydrophobicContact CG-SD 4.12Å
444	A	94	Very high	92.8	Very high	24 Å²	24	33 Å²	33	20%	0.198	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	110.3	-174.5	0	0	0	0	0	113	K420 R440	K420-A444 WeakPolarHBondContact CA-O 3.13Å; K420-A444 PolarHBondContact N-O 2.88Å; R440-A444 WeakPolarHBondContact O-CB 3.49Å; R440-A444 PolarHBondContact O-N 3.27Å; R440-A444 VanDerWaalsContact O-N 3.08Å
445	G	88.5	Confident	92.4	Very high	13 Å²	13	28.3 Å²	28.3	13%	0.134	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	138.3	-24.4	178.7	0	0	0	0	0	114.6	L423 F443 Q447	L423-G445 WeakPolarHBondContact CD2-O 3.44Å; F443-G445 PolarHBondContact O-N 2.99Å; G445-Q447 PolarHBondContact O-N 3.12Å
446	L	95.7	Very high	91.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.146	C	C	.	.			trans	-77.9	55.9	-168.5	-67.8	178.2	0	0	0	113.6	F419 L422 L425 L428 F443 N448 L449 M470	F419-L446 HydrophobicContact CB-CD1 4.07Å; F419-L446 HydrophobicContact CB-CD2 3.72Å; F419-L446 HydrophobicContact CB-CG 3.74Å; F419-L446 HydrophobicContact CD2-CD1 3.83Å; F419-L446 HydrophobicContact CD2-CG 4.44Å; F419-L446 HydrophobicContact CG-CD1 4.09Å; F419-L446 HydrophobicContact CG-CD2 4.28Å; F419-L446 HydrophobicContact CG-CG 4.3Å; L422-L446 HydrophobicContact CB-CD2 4.13Å; L425-L446 HydrophobicContact CB-CD2 3.97Å; L425-L446 HydrophobicContact CD2-CD2 3.54Å; L425-L446 HydrophobicContact CG-CD2 4.34Å; L428-L446 HydrophobicContact CD2-CD1 3.9Å; F443-L446 HydrophobicContact CB-CD1 4.28Å; F443-L446 HydrophobicContact CD1-CD1 3.92Å; F443-L446 PolarHBondContact O-N 2.93Å; L446-N448 VanDerWaalsContact C-N 3.3Å; L446-N448 PolarHBondContact O-N 3.01Å; L446-L449 HydrophobicContact CB-CB 4.05Å; L446-L449 HydrophobicContact CD1-CD2 4.3Å; L446-L449 PolarHBondContact O-N 3.04Å; L446-M470 HydrophobicContact CB-CG 3.57Å; L446-M470 HydrophobicContact CB-SD 4.23Å; L446-M470 HydrophobicContact CD1-CG 4.45Å; L446-M470 HydrophobicContact CD1-SD 4.02Å; L446-M470 WeakPolarHBondContact O-CA 3.28Å
447	Q	92.9	Very high	91.5	Very high	117 Å²	117	26.8 Å²	26.8	55%	0.547	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.6	-170.5	-65.8	-173.1	9.1	0	0	114.5	G445	G445-Q447 PolarHBondContact O-N 3.12Å
448	N	93.1	Very high	91.4	Very high	36 Å²	36	26.4 Å²	26.4	19%	0.193	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	11.8	177.4	-68.8	-63.9	0	0	0	113.9	L423 L425 L446 E450 K472	L423-N448 WeakPolarHBondContact O-CB 3.36Å; L423-N448 PolarHBondContact O-ND2 3.24Å; L425-N448 CarbonylContact O-C 3.3Å; L446-N448 VanDerWaalsContact C-N 3.3Å; L446-N448 PolarHBondContact O-N 3.01Å; N448-E450 PolarHBondContact O-N 3.04Å; N448-K472 WeakPolarHBondContact OD1-CE 3.47Å; N448-K472 PolarHBondContact OD1-NZ 2.91Å
449	L	95.3	Very high	91.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.			trans	-68.2	125.6	179.8	-160	83.8	0	0	0	110.4	L425 R426 L428 L446 Y451 L452 M470 K472 L473	L425-L449 HydrophobicContact CB-CD1 4.47Å; L425-L449 HydrophobicContact CD2-CD1 3.95Å; L425-L449 HydrophobicContact CG-CD1 4.03Å; L425-L449 VanDerWaalsContact O-CA 3.22Å; L425-L449 WeakPolarHBondContact O-CA 3.49Å; L425-L449 PolarHBondContact O-N 2.94Å; R426-L449 VanDerWaalsContact C-CD1 3.49Å; R426-L449 WeakPolarHBondContact O-CD1 3.12Å; L428-L449 HydrophobicContact CB-CD1 3.77Å; L428-L449 HydrophobicContact CB-CD2 4.25Å; L446-L449 HydrophobicContact CB-CB 4.05Å; L446-L449 HydrophobicContact CD1-CD2 4.3Å; L446-L449 PolarHBondContact O-N 3.04Å; L449-Y451 WeakPolarHBondContact CD2-O 3.38Å; L449-Y451 WeakPolarHBondContact CG-O 3.44Å; L449-L452 HydrophobicContact CD2-CB 3.96Å; L449-L452 HydrophobicContact CD2-CD1 4.45Å; L449-M470 HydrophobicContact CB-CB 4.37Å; L449-M470 HydrophobicContact CB-CG 4.12Å; L449-M470 HydrophobicContact CB-SD 4.48Å; L449-M470 HydrophobicContact CD2-CG 4.17Å; L449-M470 HydrophobicContact CD2-SD 3.43Å; L449-M470 WeakPolarHBondContact CD2-SD 3.48Å; L449-K472 CarbonylContact O-C 3.25Å; L449-L473 HydrophobicContact CD2-CD1 4.26Å; L449-L473 VanDerWaalsContact O-CA 3.31Å; L449-L473 WeakPolarHBondContact O-CA 3.36Å; L449-L473 PolarHBondContact O-N 2.81Å
450	E	85.1	Confident	91.4	Very high	34 Å²	34	30.3 Å²	30.3	16%	0.159	15%	0.147	C	C	.	.			trans	-107.2	-26.1	-179.8	-68.5	178.7	-122	0	0	111.3	R426 N448 K472 R474 I475	R426-E450 IonicContact CZ-OE1 3.68Å; R426-E450 IonicContact NE-OE1 3.15Å; R426-E450 IonicContact NH1-OE1 2.93Å; R426-E450 PolarHBondContact NH1-OE1 2.9Å; R426-E450 PolarHBondContact O-N 3.45Å; N448-E450 PolarHBondContact O-N 3.04Å; E450-K472 HydrophobicContact CG-CB 4.42Å; E450-R474 HydrophobicContact CB-CG 4.14Å; E450-R474 HydrophobicContact CG-CG 4.38Å; E450-R474 WeakPolarHBondContact O-CB 3.29Å; E450-R474 PolarHBondContact O-N 3.02Å; E450-I475 PolarHBondContact O-N 3.44Å
451	Y	82.5	Confident	91.4	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.2	-178	178.6	-82.1	0	0	0	112.1	E206 L235 R426 L428 Y429 L449 N453 I475 I477	E206-Y451 VanDerWaalsContact OE1-CE2 3.24Å; E206-Y451 WeakPolarHBondContact OE1-CE2 3.4Å; E206-Y451 WeakPolarHBondContact OE2-CE2 3.04Å; E206-Y451 PolarHBondContact OE2-OH 3.19Å; L235-Y451 HydrophobicContact CD2-CD2 3.47Å; L235-Y451 VanDerWaalsContact CD2-CD2 3.47Å; L235-Y451 HydrophobicContact CD2-CE2 4.2Å; L235-Y451 HydrophobicContact CD2-CG 3.74Å; R426-Y451 PolarHBondContact O-N 3.18Å; L428-Y451 PolarHBondContact N-O 3.11Å; Y429-Y451 AromaticContact CD1-CE1 3.61Å; Y429-Y451 HydrophobicContact CD1-CE1 3.61Å; Y429-Y451 HydrophobicContact CE1-CD1 4.1Å; Y429-Y451 AromaticContact CE1-CE1 3.26Å; Y429-Y451 HydrophobicContact CE1-CE1 3.26Å; Y429-Y451 AromaticContact CE1-CZ 3.67Å; Y429-Y451 HydrophobicContact CG-CE1 4.42Å; Y429-Y451 AromaticContact CZ-CE1 3.84Å; L449-Y451 WeakPolarHBondContact CD2-O 3.38Å; L449-Y451 WeakPolarHBondContact CG-O 3.44Å; Y451-N453 HydrophobicContact CD1-CB 4.49Å; Y451-N453 HydrophobicContact CE1-CB 3.49Å; Y451-N453 VanDerWaalsContact CE1-CB 3.49Å; Y451-I475 HydrophobicContact CD2-CB 3.7Å; Y451-I475 HydrophobicContact CD2-CD1 4.29Å; Y451-I475 HydrophobicContact CD2-CG1 4.5Å; Y451-I475 HydrophobicContact CD2-CG2 3.56Å; Y451-I475 HydrophobicContact CE2-CB 4.41Å; Y451-I475 HydrophobicContact CE2-CG2 3.76Å; Y451-I477 HydrophobicContact CE2-CG1 4.42Å
452	L	94.3	Very high	91.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	117.6	171.3	178.8	59.9	0	0	0	110	L428 M430 F443 L449 V454 F467 M470 L473 I475 L476 I477	L428-L452 HydrophobicContact CB-CD1 4.16Å; L428-L452 HydrophobicContact CD2-CD1 3.95Å; L428-L452 HydrophobicContact CG-CD1 3.97Å; M430-L452 HydrophobicContact CE-CD1 4.33Å; F443-L452 HydrophobicContact CD1-CD2 4.45Å; F443-L452 HydrophobicContact CE1-CD1 4Å; F443-L452 HydrophobicContact CE1-CD2 3.99Å; F443-L452 HydrophobicContact CZ-CD2 4.26Å; L449-L452 HydrophobicContact CD2-CB 3.96Å; L449-L452 HydrophobicContact CD2-CD1 4.45Å; L452-V454 HydrophobicContact CD1-CG1 3.99Å; L452-V454 HydrophobicContact CG-CG1 4.23Å; L452-F467 HydrophobicContact CD2-CE1 4.2Å; L452-M470 HydrophobicContact CD2-CE 4.14Å; L452-M470 HydrophobicContact CD2-SD 4.27Å; L452-L473 HydrophobicContact CB-CD1 3.81Å; L452-I475 PolarHBondContact N-O 3.34Å; L452-I475 VanDerWaalsContact N-O 3.08Å; L452-L476 HydrophobicContact CB-CD1 4.28Å; L452-L476 HydrophobicContact CD2-CD1 4.07Å; L452-L476 HydrophobicContact CG-CD1 4.29Å; L452-I477 PolarHBondContact O-N 3.24Å
453	N	86.4	Confident	91.6	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.043	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.2	168.8	-171.6	-4.9	0	0	0	111.1	L428 Y429 M430 Y451 E455 I477	L428-N453 PolarHBondContact O-N 3.31Å; L428-N453 VanDerWaalsContact O-N 3.07Å; Y429-N453 HydrophobicContact CD1-CB 4.36Å; M430-N453 CarbonylContact C-O 3.59Å; M430-N453 PolarHBondContact N-O 2.83Å; Y451-N453 HydrophobicContact CD1-CB 4.49Å; Y451-N453 HydrophobicContact CE1-CB 3.49Å; Y451-N453 VanDerWaalsContact CE1-CB 3.49Å; N453-E455 PolarHBondContact ND2-OE1 2.78Å; N453-E455 WeakPolarHBondContact OD1-CB 3.45Å; N453-E455 VanDerWaalsContact OD1-CG 3.26Å; N453-E455 WeakPolarHBondContact OD1-CG 3.31Å; N453-E455 PolarHBondContact OD1-N 2.88Å; N453-I477 HydrophobicContact CB-CB 4.16Å; N453-I477 WeakPolarHBondContact OD1-CG2 3.38Å
454	V	94.6	Very high	91.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.			trans	-138.2	28.8	177.3	-72.1	0	0	0	0	110.7	M430 L435 L438 L452 N457 I459 I477 L478 N481	M430-V454 HydrophobicContact CB-CG1 4.23Å; M430-V454 HydrophobicContact CE-CG1 3.79Å; L435-V454 HydrophobicContact CD1-CG1 4.38Å; L438-V454 HydrophobicContact CD1-CG2 4.31Å; L452-V454 HydrophobicContact CD1-CG1 3.99Å; L452-V454 HydrophobicContact CG-CG1 4.23Å; V454-N457 PolarHBondContact O-ND2 3.33Å; V454-I459 HydrophobicContact CB-CD1 3.98Å; V454-I459 HydrophobicContact CG2-CD1 4.04Å; V454-I477 VanDerWaalsContact CG2-O 3.26Å; V454-I477 WeakPolarHBondContact CG2-O 3.3Å; V454-I477 PolarHBondContact N-O 3.44Å; V454-L478 HydrophobicContact CG2-CD2 3.5Å; V454-L478 HydrophobicContact CG2-CG 4.11Å; V454-N481 PolarHBondContact O-ND2 2.83Å
455	E	83.6	Confident	91.1	Very high	3 Å²	3	30.7 Å²	30.7	1%	0.014	16%	0.162	C	C	.	.			trans	-58.8	157.7	172.9	72.6	-178.8	118.5	0	0	112.1	R110 Y134 D431 S432 N453 N457 I477 N479	R110-E455 IonicContact CZ-OE2 3.53Å; R110-E455 VanDerWaalsContact CZ-OE2 3.31Å; R110-E455 VanDerWaalsContact NH1-CD 3.29Å; R110-E455 IonicContact NH1-OE1 3.57Å; R110-E455 IonicContact NH1-OE2 3.37Å; R110-E455 PolarHBondContact NH1-OE2 2.79Å; R110-E455 IonicContact NH2-OE2 2.71Å; R110-E455 PolarHBondContact NH2-OE2 3.01Å; Y134-E455 WeakPolarHBondContact CD2-OE2 3.49Å; Y134-E455 WeakPolarHBondContact CE2-OE1 3.49Å; D431-E455 WeakPolarHBondContact CA-O 3.2Å; D431-E455 HydrophobicContact CB-CG 3.49Å; D431-E455 VanDerWaalsContact CB-CG 3.49Å; S432-E455 PolarHBondContact N-O 3.19Å; N453-E455 PolarHBondContact ND2-OE1 2.78Å; N453-E455 WeakPolarHBondContact OD1-CB 3.45Å; N453-E455 VanDerWaalsContact OD1-CG 3.26Å; N453-E455 WeakPolarHBondContact OD1-CG 3.31Å; N453-E455 PolarHBondContact OD1-N 2.88Å; E455-N457 VanDerWaalsContact C-N 3.3Å; E455-N457 PolarHBondContact O-N 3.32Å; E455-N457 PolarHBondContact O-ND2 3.36Å; E455-I477 HydrophobicContact CB-CG2 4.14Å; E455-N479 WeakPolarHBondContact CA-O 3.18Å; E455-N479 WeakPolarHBondContact CB-OD1 3.3Å
456	Y	80.9	Confident	91.4	Very high	34 Å²	34	30 Å²	30	13%	0.133	16%	0.156	C	C	.	.	S	Bend	trans	48.5	54.8	175	-70.3	-97.3	0	0	0	111.9	R110 E133 S432 N433 N479 N480	R110-Y456 HydrophobicContact CG-CE1 4.34Å; R110-Y456 HydrophobicContact CG-CE2 4.46Å; R110-Y456 VanDerWaalsContact CZ-CE2 3.48Å; E133-Y456 PolarHBondContact OE2-OH 2.94Å; S432-Y456 VanDerWaalsContact CA-O 3.25Å; S432-Y456 WeakPolarHBondContact CA-O 3.42Å; S432-Y456 PolarHBondContact N-O 2.78Å; N433-Y456 PolarHBondContact N-O 3.42Å; Y456-N479 PolarHBondContact N-O 3.03Å; Y456-N480 WeakPolarHBondContact CA-O 3.48Å; Y456-N480 HydrophobicContact CD1-CB 3.68Å; Y456-N480 HydrophobicContact CD2-CB 3.39Å; Y456-N480 HydrophobicContact CE1-CB 3.57Å; Y456-N480 HydrophobicContact CE2-CB 3.27Å; Y456-N480 WeakPolarHBondContact CE2-ND2 3.48Å; Y456-N480 HydrophobicContact CG-CB 3.64Å; Y456-N480 VanDerWaalsContact CZ-CB 3.41Å; Y456-N480 VanDerWaalsContact CZ-OD1 3.25Å; Y456-N480 PolarHBondContact N-O 3.3Å; Y456-N480 VanDerWaalsContact OH-CG 3.29Å; Y456-N480 PolarHBondContact OH-ND2 3.18Å; Y456-N480 PolarHBondContact OH-OD1 2.86Å
457	N	89.8	Confident	91.4	Very high	11 Å²	11	30 Å²	30	6%	0.059	16%	0.156	C	C	.	.	S	Bend	trans	-123.9	173.9	170.5	-84.4	-102	0	0	0	109	M430 N433 Y434 L435 V454 E455 I459 N481	M430-N457 PolarHBondContact O-ND2 3.44Å; N433-N457 WeakPolarHBondContact CB-OD1 3.34Å; N433-N457 WeakPolarHBondContact O-CA 3.36Å; N433-N457 PolarHBondContact O-OD1 3.42Å; Y434-N457 PolarHBondContact N-OD1 2.88Å; L435-N457 HydrophobicContact CB-CB 4.26Å; L435-N457 VanDerWaalsContact CB-OD1 3.25Å; L435-N457 WeakPolarHBondContact CB-OD1 3.4Å; L435-N457 VanDerWaalsContact CG-OD1 3.25Å; L435-N457 WeakPolarHBondContact CG-OD1 3.32Å; L435-N457 PolarHBondContact N-OD1 2.97Å; V454-N457 PolarHBondContact O-ND2 3.33Å; E455-N457 VanDerWaalsContact C-N 3.3Å; E455-N457 PolarHBondContact O-N 3.32Å; E455-N457 PolarHBondContact O-ND2 3.36Å; N457-I459 HydrophobicContact CB-CD1 4.02Å; N457-I459 HydrophobicContact CB-CG1 3.85Å; N457-I459 PolarHBondContact O-N 3.34Å; N457-N481 WeakPolarHBondContact CA-OD1 3.33Å; N457-N481 VanDerWaalsContact CB-OD1 3.31Å; N457-N481 WeakPolarHBondContact CB-OD1 3.28Å; N457-N481 PolarHBondContact O-OD1 2.86Å
458	A	93	Very high	91.4	Very high	21 Å²	21	27.5 Å²	27.5	17%	0.174	15%	0.146	C	C	.	.			trans	-86.3	26.7	179.5	0	0	0	0	0	113.1	L435 Q460	L435-A458 CarbonylContact O-C 3.17Å; L435-A458 WeakPolarHBondContact O-CA 3.08Å; L435-A458 PolarHBondContact O-N 2.89Å; L435-A458 VanDerWaalsContact O-N 3.07Å; A458-Q460 PolarHBondContact O-N 2.94Å
459	I	97.3	Very high	91.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.142	C	C	.	.			trans	-73.4	107.4	-164.2	-54.8	165.5	0	0	0	110.3	L435 D436 L438 V454 N457 I462 L478 N481 L482 L483	L435-I459 HydrophobicContact CB-CG1 4.24Å; L435-I459 WeakPolarHBondContact O-CA 3.09Å; L435-I459 VanDerWaalsContact O-CG1 3.23Å; L435-I459 WeakPolarHBondContact O-CG1 3.47Å; L435-I459 PolarHBondContact O-N 3.05Å; L435-I459 VanDerWaalsContact O-N 3.1Å; D436-I459 WeakPolarHBondContact O-CA 3.19Å; L438-I459 HydrophobicContact CD1-CD1 4.03Å; L438-I459 HydrophobicContact CD2-CD1 3.76Å; L438-I459 HydrophobicContact CD2-CG1 4.34Å; L438-I459 HydrophobicContact CG-CD1 3.92Å; L438-I459 HydrophobicContact CG-CG1 4.47Å; L438-I459 HydrophobicContact CG-CG2 3.99Å; V454-I459 HydrophobicContact CB-CD1 3.98Å; V454-I459 HydrophobicContact CG2-CD1 4.04Å; N457-I459 HydrophobicContact CB-CD1 4.02Å; N457-I459 HydrophobicContact CB-CG1 3.85Å; N457-I459 PolarHBondContact O-N 3.34Å; I459-I462 HydrophobicContact CG2-CG1 4.33Å; I459-L478 HydrophobicContact CD1-CD2 4.23Å; I459-N481 HydrophobicContact CB-CB 4.32Å; I459-N481 WeakPolarHBondContact CB-OD1 3.16Å; I459-N481 VanDerWaalsContact CD1-OD1 3.32Å; I459-N481 WeakPolarHBondContact CD1-OD1 3.41Å; I459-N481 WeakPolarHBondContact CG1-OD1 3.42Å; I459-N481 PolarHBondContact N-OD1 3.34Å; I459-N481 VanDerWaalsContact N-OD1 3.1Å; I459-L482 CarbonylContact O-C 3.48Å; I459-L482 VanDerWaalsContact O-C 3.23Å; I459-L482 WeakPolarHBondContact O-CA 3.26Å; I459-L482 PolarHBondContact O-N 3.43Å; I459-L483 HydrophobicContact CB-CD2 4.44Å; I459-L483 HydrophobicContact CG2-CD2 3.81Å; I459-L483 WeakPolarHBondContact O-CD2 3.29Å; I459-L483 PolarHBondContact O-N 3.38Å
460	Q	94.7	Very high	91.4	Very high	93 Å²	93	26.5 Å²	26.5	44%	0.435	14%	0.142	S	C	.	.			trans	-93.5	-27.4	177.5	-69.2	168.1	47.7	0	0	112.4	E35 D436 A458 L482	E35-Q460 VanDerWaalsContact CD-NE2 3.28Å; E35-Q460 PolarHBondContact OE1-NE2 3.46Å; E35-Q460 PolarHBondContact OE2-NE2 2.99Å; D436-Q460 PolarHBondContact O-N 3.27Å; A458-Q460 PolarHBondContact O-N 2.94Å; Q460-L482 HydrophobicContact CB-CB 4.47Å; Q460-L482 HydrophobicContact CG-CB 3.55Å; Q460-L482 HydrophobicContact CG-CD1 3.87Å; Q460-L482 HydrophobicContact CG-CG 4.34Å
461	L	94.4	Very high	91.8	Very high	77 Å²	77	28.2 Å²	28.2	40%	0.403	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	130.1	-173.6	-178.3	65.5	0	0	0	112.9	T437 L438 F463	T437-L461 VanDerWaalsContact CA-O 3.26Å; T437-L461 WeakPolarHBondContact CA-O 3.46Å; T437-L461 HydrophobicContact CG2-CB 4.32Å; L438-L461 PolarHBondContact N-O 2.87Å; L461-F463 HydrophobicContact CD2-CD1 4.49Å; L461-F463 HydrophobicContact CD2-CE1 3.93Å; L461-F463 HydrophobicContact CD2-CE2 4.2Å; L461-F463 HydrophobicContact CD2-CZ 3.77Å
462	I	96.9	Very high	92.3	Very high	1 Å²	1	33 Å²	33	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	131.1	164.6	-56.4	174.8	0	0	0	107.2	L438 I459 T466 F467 L478 L483 L486 P487 V490	L438-I462 HydrophobicContact CB-CG1 4.3Å; L438-I462 HydrophobicContact CB-CG2 4.35Å; L438-I462 HydrophobicContact CD1-CD1 4.4Å; L438-I462 HydrophobicContact CD1-CG1 4.21Å; L438-I462 HydrophobicContact CG-CG1 4.39Å; I459-I462 HydrophobicContact CG2-CG1 4.33Å; I462-T466 HydrophobicContact CG2-CG2 4.33Å; I462-F467 HydrophobicContact CD1-CE2 4.28Å; I462-F467 HydrophobicContact CD1-CZ 4.17Å; I462-F467 HydrophobicContact CG2-CE2 3.99Å; I462-F467 HydrophobicContact CG2-CZ 4.21Å; I462-L478 HydrophobicContact CD1-CD1 3.84Å; I462-L478 HydrophobicContact CD1-CD2 4.13Å; I462-L483 HydrophobicContact CD1-CD1 4.06Å; I462-L483 HydrophobicContact CD1-CD2 4.07Å; I462-L483 HydrophobicContact CG1-CD2 3.89Å; I462-L486 HydrophobicContact CD1-CD2 4.04Å; I462-P487 WeakPolarHBondContact O-CG 3.37Å; I462-V490 HydrophobicContact CG2-CG2 3.78Å
463	F	94.5	Very high	92.3	Very high	95 Å²	95	33 Å²	33	42%	0.417	18%	0.178	S	C	.	.			trans	-79.7	149.7	175.7	-74.6	-80.2	0	0	0	111.7	L438 L461 G465 T466	L438-F463 WeakPolarHBondContact O-CD2 3.46Å; L438-F463 PolarHBondContact O-N 3.24Å; L461-F463 HydrophobicContact CD2-CD1 4.49Å; L461-F463 HydrophobicContact CD2-CE1 3.93Å; L461-F463 HydrophobicContact CD2-CE2 4.2Å; L461-F463 HydrophobicContact CD2-CZ 3.77Å; F463-G465 PolarHBondContact O-N 3.38Å; F463-T466 WeakPolarHBondContact O-CB 3.28Å; F463-T466 PolarHBondContact O-N 3.34Å; F463-T466 PolarHBondContact O-OG1 3.32Å
464	P	91.1	Very high	92.1	Very high	86 Å²	86	36.3 Å²	36.3	56%	0.558	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	139.2	177.1	-22.1	30.1	0	0	0	112.2	T466 P487	P464-T466 VanDerWaalsContact C-N 3.26Å; P464-T466 PolarHBondContact O-N 3.29Å; P464-P487 HydrophobicContact CB-CB 4.45Å; P464-P487 HydrophobicContact CG-CB 3.92Å; P464-P487 HydrophobicContact CG-CG 4.35Å
465	G	89.1	Confident	91.3	Very high	11 Å²	11	36.4 Å²	36.4	11%	0.113	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	20.8	178.7	0	0	0	0	0	115.9	R440 F463 N468 D489	R440-G465 WeakPolarHBondContact CD-O 3.38Å; F463-G465 PolarHBondContact O-N 3.38Å; G465-N468 WeakPolarHBondContact CA-OD1 3.48Å; G465-N468 WeakPolarHBondContact O-CB 3.47Å; G465-N468 VanDerWaalsContact O-CG 3.3Å; G465-N468 PolarHBondContact O-N 3.49Å; G465-N468 PolarHBondContact O-OD1 3.11Å; G465-N468 VanDerWaalsContact O-OD1 3.12Å; G465-D489 PolarHBondContact N-O 3.41Å
466	T	95.1	Very high	91.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.			trans	-61.1	-45.6	-179.7	-73.6	0	0	0	0	112.6	L438 S439 R440 F443 I462 F463 P464 N468	L438-T466 HydrophobicContact CB-CG2 3.95Å; L438-T466 PolarHBondContact O-OG1 2.98Å; S439-T466 WeakPolarHBondContact CA-OG1 3.45Å; R440-T466 PolarHBondContact N-OG1 2.85Å; F443-T466 HydrophobicContact CD2-CG2 4.26Å; I462-T466 HydrophobicContact CG2-CG2 4.33Å; F463-T466 WeakPolarHBondContact O-CB 3.28Å; F463-T466 PolarHBondContact O-N 3.34Å; F463-T466 PolarHBondContact O-OG1 3.32Å; P464-T466 VanDerWaalsContact C-N 3.26Å; P464-T466 PolarHBondContact O-N 3.29Å; T466-N468 PolarHBondContact O-N 3.27Å
467	F	95.8	Very high	91.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-75.1	-10.7	-175.8	-57.4	-61.2	0	0	0	113.2	L438 L452 I462 A469 M470 L473 L476 L478 V490 F491 V494	L438-F467 HydrophobicContact CD1-CE1 4.28Å; L438-F467 HydrophobicContact CD1-CZ 4.09Å; L452-F467 HydrophobicContact CD2-CE1 4.2Å; I462-F467 HydrophobicContact CD1-CE2 4.28Å; I462-F467 HydrophobicContact CD1-CZ 4.17Å; I462-F467 HydrophobicContact CG2-CE2 3.99Å; I462-F467 HydrophobicContact CG2-CZ 4.21Å; F467-A469 PolarHBondContact O-N 3.11Å; F467-M470 HydrophobicContact CD1-CE 3.76Å; F467-M470 CarbonylContact O-C 3.23Å; F467-M470 WeakPolarHBondContact O-CA 3.31Å; F467-M470 PolarHBondContact O-N 3.41Å; F467-L473 HydrophobicContact CB-CD2 4.37Å; F467-L473 HydrophobicContact CD1-CD2 3.91Å; F467-L473 HydrophobicContact CG-CD2 4.33Å; F467-L476 HydrophobicContact CD1-CD1 4.48Å; F467-L476 HydrophobicContact CD1-CD2 4.19Å; F467-L476 HydrophobicContact CD2-CD2 4.04Å; F467-L476 HydrophobicContact CE1-CD1 3.78Å; F467-L476 HydrophobicContact CE1-CD2 3.84Å; F467-L476 HydrophobicContact CE1-CG 4.5Å; F467-L476 HydrophobicContact CE2-CD2 3.66Å; F467-L476 HydrophobicContact CG-CD2 4.32Å; F467-L476 HydrophobicContact CZ-CD1 4.05Å; F467-L476 HydrophobicContact CZ-CD2 3.58Å; F467-L476 HydrophobicContact CZ-CG 4.44Å; F467-L478 HydrophobicContact CZ-CD1 4.14Å; F467-V490 HydrophobicContact CD2-CG2 3.96Å; F467-V490 WeakPolarHBondContact CD2-O 3.33Å; F467-V490 HydrophobicContact CE2-CG2 3.77Å; F467-F491 HydrophobicContact CD2-CD1 4.13Å; F467-F491 HydrophobicContact CD2-CE1 4.29Å; F467-F491 HydrophobicContact CE2-CE1 4.22Å; F467-V494 HydrophobicContact CB-CG1 3.88Å; F467-V494 HydrophobicContact CB-CG2 4.3Å; F467-V494 WeakPolarHBondContact O-CG1 3.48Å
468	N	92.6	Very high	91.9	Very high	64 Å²	64	34.3 Å²	34.3	34%	0.342	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-64.1	-6.8	174.9	-49.5	35.4	0	0	0	113.5	G465 T466 M470 A492	G465-N468 WeakPolarHBondContact CA-OD1 3.48Å; G465-N468 WeakPolarHBondContact O-CB 3.47Å; G465-N468 VanDerWaalsContact O-CG 3.3Å; G465-N468 PolarHBondContact O-N 3.49Å; G465-N468 PolarHBondContact O-OD1 3.11Å; G465-N468 VanDerWaalsContact O-OD1 3.12Å; T466-N468 PolarHBondContact O-N 3.27Å; N468-M470 VanDerWaalsContact C-N 3.3Å; N468-A492 PolarHBondContact ND2-O 3.42Å; N468-A492 PolarHBondContact OD1-O 3.5Å; N468-A492 VanDerWaalsContact OD1-O 3.06Å
469	A	92	Very high	91.4	Very high	14 Å²	14	33.6 Å²	33.6	12%	0.116	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-75.1	-18.7	167.5	0	0	0	0	0	113.3	R440 F443 F467	R440-A469 HydrophobicContact CG-CB 4.29Å; F443-A469 HydrophobicContact CB-CB 4.12Å; F467-A469 PolarHBondContact O-N 3.11Å
470	M	95.8	Very high	90.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.18	C	C	.	.			trans	-130.4	65.4	-168.3	-64.8	165.1	-67.1	0	0	110.3	F443 L446 L449 L452 F467 N468 K472 L473 V494	F443-M470 HydrophobicContact CB-CE 3.71Å; F443-M470 HydrophobicContact CB-SD 3.94Å; F443-M470 HydrophobicContact CD1-CE 4.12Å; F443-M470 HydrophobicContact CD1-SD 3.96Å; F443-M470 HydrophobicContact CD2-CE 4.34Å; F443-M470 HydrophobicContact CG-CE 3.79Å; F443-M470 HydrophobicContact CG-SD 4.12Å; L446-M470 HydrophobicContact CB-CG 3.57Å; L446-M470 HydrophobicContact CB-SD 4.23Å; L446-M470 HydrophobicContact CD1-CG 4.45Å; L446-M470 HydrophobicContact CD1-SD 4.02Å; L446-M470 WeakPolarHBondContact O-CA 3.28Å; L449-M470 HydrophobicContact CB-CB 4.37Å; L449-M470 HydrophobicContact CB-CG 4.12Å; L449-M470 HydrophobicContact CB-SD 4.48Å; L449-M470 HydrophobicContact CD2-CG 4.17Å; L449-M470 HydrophobicContact CD2-SD 3.43Å; L449-M470 WeakPolarHBondContact CD2-SD 3.48Å; L452-M470 HydrophobicContact CD2-CE 4.14Å; L452-M470 HydrophobicContact CD2-SD 4.27Å; F467-M470 HydrophobicContact CD1-CE 3.76Å; F467-M470 CarbonylContact O-C 3.23Å; F467-M470 WeakPolarHBondContact O-CA 3.31Å; F467-M470 PolarHBondContact O-N 3.41Å; N468-M470 VanDerWaalsContact C-N 3.3Å; M470-K472 PolarHBondContact O-N 3.03Å; M470-L473 HydrophobicContact CB-CB 4.14Å; M470-L473 WeakPolarHBondContact O-CB 3.43Å; M470-L473 PolarHBondContact O-N 3.48Å; M470-V494 WeakPolarHBondContact O-CG1 3.44Å
471	P	93.5	Very high	90.2	Very high	71 Å²	71	30.4 Å²	30.4	46%	0.461	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-9.1	-170.3	28.9	-37.5	0	0	0	114.9
472	K	92.6	Very high	90.1	Very high	104 Å²	104	27.9 Å²	27.9	45%	0.452	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	2.5	172.9	-67.7	-162.9	-174.9	173.2	0	114	N448 L449 E450 M470 R474	N448-K472 WeakPolarHBondContact OD1-CE 3.47Å; N448-K472 PolarHBondContact OD1-NZ 2.91Å; L449-K472 CarbonylContact O-C 3.25Å; E450-K472 HydrophobicContact CG-CB 4.42Å; M470-K472 PolarHBondContact O-N 3.03Å; K472-R474 WeakPolarHBondContact O-CG 3.26Å; K472-R474 PolarHBondContact O-N 3.33Å
473	L	93.9	Very high	90.1	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.147	C	C	.	.			trans	-61	124.7	-175.9	-171.5	66.5	0	0	0	110.6	L449 L452 F467 M470 I475 L476 V494 L496	L449-L473 HydrophobicContact CD2-CD1 4.26Å; L449-L473 VanDerWaalsContact O-CA 3.31Å; L449-L473 WeakPolarHBondContact O-CA 3.36Å; L449-L473 PolarHBondContact O-N 2.81Å; L452-L473 HydrophobicContact CB-CD1 3.81Å; F467-L473 HydrophobicContact CB-CD2 4.37Å; F467-L473 HydrophobicContact CD1-CD2 3.91Å; F467-L473 HydrophobicContact CG-CD2 4.33Å; M470-L473 HydrophobicContact CB-CB 4.14Å; M470-L473 WeakPolarHBondContact O-CB 3.43Å; M470-L473 PolarHBondContact O-N 3.48Å; L473-I475 WeakPolarHBondContact CD1-O 3.44Å; L473-L476 HydrophobicContact CD2-CB 4.31Å; L473-L476 HydrophobicContact CD2-CD1 4.38Å; L473-L476 HydrophobicContact CD2-CD2 4.44Å; L473-V494 HydrophobicContact CB-CG1 4.17Å; L473-L496 HydrophobicContact CB-CD2 4.4Å; L473-L496 HydrophobicContact CD2-CD2 4.07Å; L473-L496 HydrophobicContact CG-CD2 3.82Å
474	R	83.7	Confident	90.1	Very high	77 Å²	77	30.6 Å²	30.6	29%	0.291	15%	0.154	S	C	.	.			trans	-114.5	-40.1	-175.1	-42.6	-171.2	68.4	-156.6	-2	111.6	K232 E450 K472 L496 S497 K498	K232-R474 VanDerWaalsContact O-CZ 3.27Å; K232-R474 PolarHBondContact O-NH1 3.31Å; K232-R474 PolarHBondContact O-NH2 3.14Å; E450-R474 HydrophobicContact CB-CG 4.14Å; E450-R474 HydrophobicContact CG-CG 4.38Å; E450-R474 WeakPolarHBondContact O-CB 3.29Å; E450-R474 PolarHBondContact O-N 3.02Å; K472-R474 WeakPolarHBondContact O-CG 3.26Å; K472-R474 PolarHBondContact O-N 3.33Å; R474-L496 WeakPolarHBondContact O-CA 3.34Å; R474-S497 PolarHBondContact O-N 2.96Å; R474-S497 PolarHBondContact O-OG 3.15Å; R474-K498 PolarHBondContact O-N 2.81Å
475	I	78.2	Confident	90.3	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124.5	-178.9	-56.6	-169.3	0	0	0	108.5	A205 L235 E450 Y451 L452 L473 I477 K498	A205-I475 VanDerWaalsContact O-CD1 3.29Å; A205-I475 WeakPolarHBondContact O-CD1 3.35Å; L235-I475 HydrophobicContact CB-CD1 3.85Å; E450-I475 PolarHBondContact O-N 3.44Å; Y451-I475 HydrophobicContact CD2-CB 3.7Å; Y451-I475 HydrophobicContact CD2-CD1 4.29Å; Y451-I475 HydrophobicContact CD2-CG1 4.5Å; Y451-I475 HydrophobicContact CD2-CG2 3.56Å; Y451-I475 HydrophobicContact CE2-CB 4.41Å; Y451-I475 HydrophobicContact CE2-CG2 3.76Å; L452-I475 PolarHBondContact N-O 3.34Å; L452-I475 VanDerWaalsContact N-O 3.08Å; L473-I475 WeakPolarHBondContact CD1-O 3.44Å; I475-I477 HydrophobicContact CG2-CD1 3.72Å; I475-I477 HydrophobicContact CG2-CG1 3.91Å; I475-K498 WeakPolarHBondContact CA-O 3.47Å; I475-K498 HydrophobicContact CB-CB 4.44Å; I475-K498 HydrophobicContact CG1-CB 4.1Å; I475-K498 HydrophobicContact CG2-CB 4.14Å; I475-K498 HydrophobicContact CG2-CD 4.3Å; I475-K498 HydrophobicContact CG2-CG 4.36Å
476	L	91.4	Very high	90.6	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	116.2	178.3	175.3	58.5	0	0	0	109.6	L452 F467 L473 L478 F491 L496 K498 L499 S500	L452-L476 HydrophobicContact CB-CD1 4.28Å; L452-L476 HydrophobicContact CD2-CD1 4.07Å; L452-L476 HydrophobicContact CG-CD1 4.29Å; F467-L476 HydrophobicContact CD1-CD1 4.48Å; F467-L476 HydrophobicContact CD1-CD2 4.19Å; F467-L476 HydrophobicContact CD2-CD2 4.04Å; F467-L476 HydrophobicContact CE1-CD1 3.78Å; F467-L476 HydrophobicContact CE1-CD2 3.84Å; F467-L476 HydrophobicContact CE1-CG 4.5Å; F467-L476 HydrophobicContact CE2-CD2 3.66Å; F467-L476 HydrophobicContact CG-CD2 4.32Å; F467-L476 HydrophobicContact CZ-CD1 4.05Å; F467-L476 HydrophobicContact CZ-CD2 3.58Å; F467-L476 HydrophobicContact CZ-CG 4.44Å; L473-L476 HydrophobicContact CD2-CB 4.31Å; L473-L476 HydrophobicContact CD2-CD1 4.38Å; L473-L476 HydrophobicContact CD2-CD2 4.44Å; L476-L478 HydrophobicContact CD1-CD1 3.97Å; L476-L478 HydrophobicContact CD1-CG 3.95Å; L476-L478 HydrophobicContact CD2-CD1 3.71Å; L476-L478 HydrophobicContact CG-CD1 3.72Å; L476-L478 HydrophobicContact CG-CG 4.05Å; L476-F491 HydrophobicContact CD2-CE1 3.98Å; L476-L496 HydrophobicContact CB-CD1 4.19Å; L476-L496 HydrophobicContact CB-CD2 3.73Å; L476-L496 HydrophobicContact CD2-CD1 3.9Å; L476-K498 PolarHBondContact N-O 3.48Å; L476-K498 VanDerWaalsContact N-O 3.07Å; L476-L499 HydrophobicContact CB-CD1 4.26Å; L476-L499 HydrophobicContact CD2-CD1 4.06Å; L476-L499 HydrophobicContact CG-CD1 4.12Å; L476-L499 WeakPolarHBondContact O-CA 3.45Å; L476-S500 PolarHBondContact O-N 2.85Å
477	I	83.7	Confident	90.5	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	110	-175.7	-51.9	-58.8	0	0	0	108.4	Y451 L452 N453 V454 E455 I475 N479 K498	Y451-I477 HydrophobicContact CE2-CG1 4.42Å; L452-I477 PolarHBondContact O-N 3.24Å; N453-I477 HydrophobicContact CB-CB 4.16Å; N453-I477 WeakPolarHBondContact OD1-CG2 3.38Å; V454-I477 VanDerWaalsContact CG2-O 3.26Å; V454-I477 WeakPolarHBondContact CG2-O 3.3Å; V454-I477 PolarHBondContact N-O 3.44Å; E455-I477 HydrophobicContact CB-CG2 4.14Å; I475-I477 HydrophobicContact CG2-CD1 3.72Å; I475-I477 HydrophobicContact CG2-CG1 3.91Å; I477-N479 WeakPolarHBondContact CG2-OD1 3.5Å; I477-K498 HydrophobicContact CD1-CD 4.26Å; I477-K498 HydrophobicContact CD1-CG 4.42Å
478	L	91	Very high	90.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.			trans	-130.6	11.2	-171.5	-82.4	166.6	0	0	0	112.4	L438 V454 I459 I462 F467 L476 N481 L483 S500 L501 N504	L438-L478 HydrophobicContact CD1-CD2 3.84Å; V454-L478 HydrophobicContact CG2-CD2 3.5Å; V454-L478 HydrophobicContact CG2-CG 4.11Å; I459-L478 HydrophobicContact CD1-CD2 4.23Å; I462-L478 HydrophobicContact CD1-CD1 3.84Å; I462-L478 HydrophobicContact CD1-CD2 4.13Å; F467-L478 HydrophobicContact CZ-CD1 4.14Å; L476-L478 HydrophobicContact CD1-CD1 3.97Å; L476-L478 HydrophobicContact CD1-CG 3.95Å; L476-L478 HydrophobicContact CD2-CD1 3.71Å; L476-L478 HydrophobicContact CG-CD1 3.72Å; L476-L478 HydrophobicContact CG-CG 4.05Å; L478-N481 PolarHBondContact O-ND2 3.17Å; L478-L483 HydrophobicContact CB-CD1 4.39Å; L478-L483 HydrophobicContact CD2-CD1 4.36Å; L478-S500 CarbonylContact C-O 3.44Å; L478-S500 WeakPolarHBondContact CA-O 3.19Å; L478-S500 WeakPolarHBondContact CB-O 3.41Å; L478-S500 PolarHBondContact N-O 2.98Å; L478-L501 HydrophobicContact CB-CD2 3.64Å; L478-L501 HydrophobicContact CD1-CD2 3.97Å; L478-L501 HydrophobicContact CG-CD2 4.47Å; L478-N504 PolarHBondContact O-ND2 3.05Å
479	N	82.6	Confident	90.3	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.037	19%	0.188	C	C	.	.			trans	-62.8	160.3	177.7	59.4	-45.7	0	0	0	112.7	E455 Y456 I477 N481 S500 H502	E455-N479 WeakPolarHBondContact CA-O 3.18Å; E455-N479 WeakPolarHBondContact CB-OD1 3.3Å; Y456-N479 PolarHBondContact N-O 3.03Å; I477-N479 WeakPolarHBondContact CG2-OD1 3.5Å; N479-N481 PolarHBondContact O-N 3.1Å; N479-N481 PolarHBondContact O-ND2 3.06Å; N479-S500 WeakPolarHBondContact CB-OG 3.45Å; N479-S500 PolarHBondContact N-O 3.01Å; N479-H502 CarbonylContact C-O 3.4Å; N479-H502 WeakPolarHBondContact CA-O 3.45Å; N479-H502 WeakPolarHBondContact CB-CD2 3.34Å; N479-H502 VanDerWaalsContact CB-NE2 3.27Å; N479-H502 WeakPolarHBondContact CB-NE2 3.43Å; N479-H502 WeakPolarHBondContact CB-O 3.39Å; N479-H502 PolarHBondContact ND2-CE1 2.83Å; N479-H502 PolarHBondContact ND2-NE2 3.02Å
480	N	77.9	Confident	90.4	Very high	24 Å²	24	35.7 Å²	35.7	13%	0.128	18%	0.183	C	C	.	.	S	Bend	trans	51.3	54.8	177.2	-64.5	-86.9	0	0	0	111.6	Y456 H502 N503 N504	Y456-N480 WeakPolarHBondContact CA-O 3.48Å; Y456-N480 HydrophobicContact CD1-CB 3.68Å; Y456-N480 HydrophobicContact CD2-CB 3.39Å; Y456-N480 HydrophobicContact CE1-CB 3.57Å; Y456-N480 HydrophobicContact CE2-CB 3.27Å; Y456-N480 WeakPolarHBondContact CE2-ND2 3.48Å; Y456-N480 HydrophobicContact CG-CB 3.64Å; Y456-N480 VanDerWaalsContact CZ-CB 3.41Å; Y456-N480 VanDerWaalsContact CZ-OD1 3.25Å; Y456-N480 PolarHBondContact N-O 3.3Å; Y456-N480 VanDerWaalsContact OH-CG 3.29Å; Y456-N480 PolarHBondContact OH-ND2 3.18Å; Y456-N480 PolarHBondContact OH-OD1 2.86Å; N480-H502 PolarHBondContact N-O 3.48Å; N480-H502 PolarHBondContact ND2-CE1 3.46Å; N480-N503 VanDerWaalsContact CA-O 3.29Å; N480-N503 WeakPolarHBondContact CA-O 3.45Å; N480-N503 HydrophobicContact CB-CB 4.39Å; N480-N503 VanDerWaalsContact CG-CB 3.48Å; N480-N503 PolarHBondContact ND2-ND2 3.26Å; N480-N503 WeakPolarHBondContact OD1-CB 3.41Å; N480-N503 PolarHBondContact OD1-ND2 3.05Å; N480-N504 PolarHBondContact N-ND2 3.01Å
481	N	88.4	Confident	90.3	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.183	C	C	.	.	S	Bend	trans	-132.3	176.6	177.9	-89.1	-89.4	0	0	0	109	V454 N457 I459 L478 N479 L483 N504	V454-N481 PolarHBondContact O-ND2 2.83Å; N457-N481 WeakPolarHBondContact CA-OD1 3.33Å; N457-N481 VanDerWaalsContact CB-OD1 3.31Å; N457-N481 WeakPolarHBondContact CB-OD1 3.28Å; N457-N481 PolarHBondContact O-OD1 2.86Å; I459-N481 HydrophobicContact CB-CB 4.32Å; I459-N481 WeakPolarHBondContact CB-OD1 3.16Å; I459-N481 VanDerWaalsContact CD1-OD1 3.32Å; I459-N481 WeakPolarHBondContact CD1-OD1 3.41Å; I459-N481 WeakPolarHBondContact CG1-OD1 3.42Å; I459-N481 PolarHBondContact N-OD1 3.34Å; I459-N481 VanDerWaalsContact N-OD1 3.1Å; L478-N481 PolarHBondContact O-ND2 3.17Å; N479-N481 PolarHBondContact O-N 3.1Å; N479-N481 PolarHBondContact O-ND2 3.06Å; N481-L483 VanDerWaalsContact C-N 3.33Å; N481-L483 HydrophobicContact CB-CG 4.34Å; N481-L483 PolarHBondContact O-N 2.62Å; N481-N504 VanDerWaalsContact CB-OD1 3.29Å; N481-N504 WeakPolarHBondContact CB-OD1 3.44Å; N481-N504 PolarHBondContact O-OD1 2.96Å
482	L	93.3	Very high	90.2	Very high	25 Å²	25	33.7 Å²	33.7	13%	0.131	17%	0.172	C	C	.	.			trans	-94.2	21.5	-174.3	-55.3	-173.7	0	0	0	113.3	E35 I459 Q460 R484 Y505	E35-L482 HydrophobicContact CB-CD1 4.07Å; E35-L482 WeakPolarHBondContact OE2-CD1 3.31Å; I459-L482 CarbonylContact O-C 3.48Å; I459-L482 VanDerWaalsContact O-C 3.23Å; I459-L482 WeakPolarHBondContact O-CA 3.26Å; I459-L482 PolarHBondContact O-N 3.43Å; Q460-L482 HydrophobicContact CB-CB 4.47Å; Q460-L482 HydrophobicContact CG-CB 3.55Å; Q460-L482 HydrophobicContact CG-CD1 3.87Å; Q460-L482 HydrophobicContact CG-CG 4.34Å; L482-R484 PolarHBondContact O-N 3.33Å; L482-Y505 HydrophobicContact CD2-CD2 4.32Å; L482-Y505 HydrophobicContact CD2-CE2 3.62Å
483	L	96.8	Very high	90	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.18	C	C	.	.			trans	-70	129.3	-173.9	-58.1	170.9	0	0	0	111.3	I459 I462 L478 N481 L501 N504 Y505 F506	I459-L483 HydrophobicContact CB-CD2 4.44Å; I459-L483 HydrophobicContact CG2-CD2 3.81Å; I459-L483 WeakPolarHBondContact O-CD2 3.29Å; I459-L483 PolarHBondContact O-N 3.38Å; I462-L483 HydrophobicContact CD1-CD1 4.06Å; I462-L483 HydrophobicContact CD1-CD2 4.07Å; I462-L483 HydrophobicContact CG1-CD2 3.89Å; L478-L483 HydrophobicContact CB-CD1 4.39Å; L478-L483 HydrophobicContact CD2-CD1 4.36Å; N481-L483 VanDerWaalsContact C-N 3.33Å; N481-L483 HydrophobicContact CB-CG 4.34Å; N481-L483 PolarHBondContact O-N 2.62Å; L483-L501 HydrophobicContact CD1-CD2 4.05Å; L483-N504 HydrophobicContact CB-CB 4.43Å; L483-N504 WeakPolarHBondContact CB-OD1 3.15Å; L483-N504 WeakPolarHBondContact CG-OD1 3.24Å; L483-N504 PolarHBondContact N-OD1 3.22Å; L483-Y505 CarbonylContact O-C 3.57Å; L483-Y505 VanDerWaalsContact O-C 3.3Å; L483-Y505 VanDerWaalsContact O-CA 3.29Å; L483-Y505 WeakPolarHBondContact O-CA 3.36Å; L483-Y505 WeakPolarHBondContact O-CB 3.39Å; L483-Y505 PolarHBondContact O-N 3.42Å; L483-F506 HydrophobicContact CB-CE1 3.84Å; L483-F506 HydrophobicContact CB-CE2 4.11Å; L483-F506 HydrophobicContact CB-CZ 3.42Å; L483-F506 VanDerWaalsContact CB-CZ 3.42Å; L483-F506 HydrophobicContact CD1-CE2 4.49Å; L483-F506 HydrophobicContact CD1-CZ 3.92Å; L483-F506 HydrophobicContact CG-CZ 4.31Å
484	R	94.8	Very high	89.9	Confident	152 Å²	152	32 Å²	32	57%	0.574	18%	0.183	S	C	*	.			trans	-107.8	-23.8	177.7	-63	179	-174.8	-75	-6.7	113.3	L482	L482-R484 PolarHBondContact O-N 3.33Å
485	S	93.5	Very high	90.2	Very high	77 Å²	77	31.9 Å²	31.9	54%	0.538	19%	0.193	S	C	.	.			trans	-158.4	162.1	177.9	61.1	0	0	0	0	110.4
486	L	95.4	Very high	90.7	Very high	8 Å²	8	32 Å²	32	4%	0.042	19%	0.194	C	C	.	.			trans	-111.7	138.4	171.6	-64.3	178.6	0	0	0	108.7	I462 V490 F491 L501 F506 L509 V514	I462-L486 HydrophobicContact CD1-CD2 4.04Å; L486-V490 HydrophobicContact CB-CG1 4.21Å; L486-F491 HydrophobicContact CD1-CE2 3.94Å; L486-F491 HydrophobicContact CD1-CZ 3.87Å; L486-L501 HydrophobicContact CD1-CD1 4.08Å; L486-F506 HydrophobicContact CD2-CE1 4.23Å; L486-F506 HydrophobicContact CD2-CZ 4.02Å; L486-F506 HydrophobicContact CG-CE1 3.93Å; L486-F506 HydrophobicContact CG-CZ 4.04Å; L486-L509 HydrophobicContact CD1-CD2 4.1Å; L486-L509 HydrophobicContact CG-CD2 4.34Å; L486-V514 HydrophobicContact CB-CG1 4.05Å; L486-V514 HydrophobicContact CD1-CG1 3.94Å
487	P	94.9	Very high	90.2	Very high	29 Å²	29	32.2 Å²	32.2	19%	0.188	20%	0.196	C	C	.	.			trans	-73.3	155.9	176.2	31.8	-34.8	0	0	0	111.1	I462 P464 V490 V514	I462-P487 WeakPolarHBondContact O-CG 3.37Å; P464-P487 HydrophobicContact CB-CB 4.45Å; P464-P487 HydrophobicContact CG-CB 3.92Å; P464-P487 HydrophobicContact CG-CG 4.35Å; P487-V490 HydrophobicContact CG-CB 3.97Å; P487-V490 HydrophobicContact CG-CG2 4.24Å; P487-V490 WeakPolarHBondContact O-CB 3.44Å; P487-V490 WeakPolarHBondContact O-CG1 3.47Å; P487-V490 PolarHBondContact O-N 3.46Å; P487-V514 VanDerWaalsContact O-CG2 3.28Å; P487-V514 WeakPolarHBondContact O-CG2 3.21Å
488	V	91.6	Very high	89.6	Confident	87 Å²	87	32.2 Å²	32.2	53%	0.527	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	142	166.9	178.1	0	0	0	0	109.8	V490 G513	V488-V490 VanDerWaalsContact C-N 3.27Å; V488-V490 PolarHBondContact O-N 2.98Å; V488-G513 WeakPolarHBondContact CA-O 3.35Å
489	D	90.6	Very high	89.4	Confident	81 Å²	81	32.2 Å²	32.2	43%	0.433	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	28.3	-177.3	-60.1	-41.9	0	0	0	114.6	G465 A492 G513 Q517	G465-D489 PolarHBondContact N-O 3.41Å; D489-A492 HydrophobicContact CB-CB 3.83Å; D489-G513 PolarHBondContact N-O 2.92Å; D489-Q517 PolarHBondContact OD1-NE2 3.29Å
490	V	94.8	Very high	89.3	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-64.7	-39.3	172.9	67.3	0	0	0	0	112.6	I462 F467 L486 P487 V488 V514	I462-V490 HydrophobicContact CG2-CG2 3.78Å; F467-V490 HydrophobicContact CD2-CG2 3.96Å; F467-V490 WeakPolarHBondContact CD2-O 3.33Å; F467-V490 HydrophobicContact CE2-CG2 3.77Å; L486-V490 HydrophobicContact CB-CG1 4.21Å; P487-V490 HydrophobicContact CG-CB 3.97Å; P487-V490 HydrophobicContact CG-CG2 4.24Å; P487-V490 WeakPolarHBondContact O-CB 3.44Å; P487-V490 WeakPolarHBondContact O-CG1 3.47Å; P487-V490 PolarHBondContact O-N 3.46Å; V488-V490 VanDerWaalsContact C-N 3.27Å; V488-V490 PolarHBondContact O-N 2.98Å; V490-V514 HydrophobicContact CG1-CG1 3.96Å; V490-V514 HydrophobicContact CG1-CG2 4.43Å
491	F	94.4	Very high	89.8	Confident	3 Å²	3	30.8 Å²	30.8	1%	0.013	19%	0.188	C	C	.	.	S	Bend	trans	-101.5	10.7	-177.5	-55.5	-51.4	0	0	0	112.9	F467 L476 L486 G493 V494 L496 L499 V514 Q517 L518	F467-F491 HydrophobicContact CD2-CD1 4.13Å; F467-F491 HydrophobicContact CD2-CE1 4.29Å; F467-F491 HydrophobicContact CE2-CE1 4.22Å; L476-F491 HydrophobicContact CD2-CE1 3.98Å; L486-F491 HydrophobicContact CD1-CE2 3.94Å; L486-F491 HydrophobicContact CD1-CZ 3.87Å; F491-G493 PolarHBondContact O-N 3.16Å; F491-G493 VanDerWaalsContact O-N 3.1Å; F491-V494 HydrophobicContact CB-CG2 4.16Å; F491-V494 VanDerWaalsContact O-CG2 3.29Å; F491-V494 WeakPolarHBondContact O-CG2 3.47Å; F491-V494 PolarHBondContact O-N 3.23Å; F491-L496 HydrophobicContact CD1-CD1 3.55Å; F491-L496 HydrophobicContact CE1-CD1 3.74Å; F491-L496 HydrophobicContact CG-CD1 4.25Å; F491-L499 HydrophobicContact CE1-CD1 4.3Å; F491-L499 HydrophobicContact CE1-CD2 4.27Å; F491-L499 HydrophobicContact CE2-CD2 3.9Å; F491-L499 HydrophobicContact CZ-CD1 4.17Å; F491-L499 HydrophobicContact CZ-CD2 3.57Å; F491-V514 HydrophobicContact CD2-CG1 4.18Å; F491-V514 HydrophobicContact CE2-CG1 3.95Å; F491-Q517 HydrophobicContact CB-CB 4.22Å; F491-L518 HydrophobicContact CB-CD2 4.23Å; F491-L518 HydrophobicContact CD1-CD2 4.5Å; F491-L518 HydrophobicContact CD2-CD1 4.32Å; F491-L518 HydrophobicContact CD2-CD2 3.59Å; F491-L518 HydrophobicContact CD2-CG 3.95Å; F491-L518 HydrophobicContact CE2-CD1 4.19Å; F491-L518 HydrophobicContact CE2-CD2 4.04Å; F491-L518 HydrophobicContact CE2-CG 4.31Å; F491-L518 HydrophobicContact CG-CD2 3.86Å
492	A	90.8	Very high	89.5	Confident	27 Å²	27	30.9 Å²	30.9	22%	0.223	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	109.5	-174.4	0	0	0	0	0	112.1	N468 D489 Q517	N468-A492 PolarHBondContact ND2-O 3.42Å; N468-A492 PolarHBondContact OD1-O 3.5Å; N468-A492 VanDerWaalsContact OD1-O 3.06Å; D489-A492 HydrophobicContact CB-CB 3.83Å; A492-Q517 VanDerWaalsContact N-OE1 3.1Å
493	G	87.6	Confident	88.8	Confident	60 Å²	60	30.7 Å²	30.7	62%	0.619	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.3	15.7	178.6	0	0	0	0	0	115.1	F491	F491-G493 PolarHBondContact O-N 3.16Å; F491-G493 VanDerWaalsContact O-N 3.1Å
494	V	93.4	Very high	88.5	Confident	10 Å²	10	30.8 Å²	30.8	6%	0.061	19%	0.188	C	C	.	.			trans	-110.6	163.6	157.3	-64.9	0	0	0	0	110	F467 M470 L473 F491 L496	F467-V494 HydrophobicContact CB-CG1 3.88Å; F467-V494 HydrophobicContact CB-CG2 4.3Å; F467-V494 WeakPolarHBondContact O-CG1 3.48Å; M470-V494 WeakPolarHBondContact O-CG1 3.44Å; L473-V494 HydrophobicContact CB-CG1 4.17Å; F491-V494 HydrophobicContact CB-CG2 4.16Å; F491-V494 VanDerWaalsContact O-CG2 3.29Å; F491-V494 WeakPolarHBondContact O-CG2 3.47Å; F491-V494 PolarHBondContact O-N 3.23Å; V494-L496 HydrophobicContact CG2-CD1 4.37Å; V494-L496 HydrophobicContact CG2-CG 3.97Å
495	S	90.1	Very high	88.4	Confident	73 Å²	73	27.6 Å²	27.6	51%	0.51	18%	0.176	S	C	.	.			trans	-127.8	66.5	179	-59.4	0	0	0	0	109.5	S497	S495-S497 PolarHBondContact O-N 3.29Å
496	L	88.7	Confident	88.5	Confident	4 Å²	4	23.9 Å²	23.9	2%	0.021	15%	0.151	C	C	.	.			trans	-61.5	131.1	179.9	-64.8	177.5	0	0	0	110.8	L473 R474 L476 F491 V494 L499 L518 S520 I521	L473-L496 HydrophobicContact CB-CD2 4.4Å; L473-L496 HydrophobicContact CD2-CD2 4.07Å; L473-L496 HydrophobicContact CG-CD2 3.82Å; R474-L496 WeakPolarHBondContact O-CA 3.34Å; L476-L496 HydrophobicContact CB-CD1 4.19Å; L476-L496 HydrophobicContact CB-CD2 3.73Å; L476-L496 HydrophobicContact CD2-CD1 3.9Å; F491-L496 HydrophobicContact CD1-CD1 3.55Å; F491-L496 HydrophobicContact CE1-CD1 3.74Å; F491-L496 HydrophobicContact CG-CD1 4.25Å; V494-L496 HydrophobicContact CG2-CD1 4.37Å; V494-L496 HydrophobicContact CG2-CG 3.97Å; L496-L499 HydrophobicContact CD1-CD1 4.34Å; L496-L518 HydrophobicContact CB-CD2 4.24Å; L496-L518 HydrophobicContact CD1-CD2 4.11Å; L496-S520 CarbonylContact O-C 3.48Å; L496-S520 VanDerWaalsContact O-C 3.25Å; L496-I521 PolarHBondContact O-N 3.45Å
497	S	79.2	Confident	88.4	Confident	5 Å²	5	28.2 Å²	28.2	4%	0.035	17%	0.172	C	C	.	.	S	Bend	trans	-110.9	-23	173.3	53.2	0	0	0	0	112.9	N233 R474 S495 S520 I522 Q523	N233-S497 VanDerWaalsContact CB-CB 3.41Å; N233-S497 VanDerWaalsContact CB-OG 3.31Å; N233-S497 WeakPolarHBondContact CB-OG 3.37Å; R474-S497 PolarHBondContact O-N 2.96Å; R474-S497 PolarHBondContact O-OG 3.15Å; S495-S497 PolarHBondContact O-N 3.29Å; S497-S520 WeakPolarHBondContact CA-O 3.4Å; S497-I522 PolarHBondContact O-N 3.41Å; S497-Q523 PolarHBondContact O-N 2.83Å
498	K	72.9	Confident	88.2	Confident	3 Å²	3	32.2 Å²	32.2	1%	0.013	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	134.3	162.2	-178.9	171.3	-174.1	167.3	0	111.2	T180 H181 A205 R474 I475 L476 I477 Q523	T180-K498 VanDerWaalsContact CB-NZ 3.31Å; T180-K498 PolarHBondContact OG1-NZ 2.89Å; H181-K498 PolarHBondContact CE1-NZ 3.35Å; H181-K498 WeakPolarHBondContact NE2-CE 3.17Å; H181-K498 PolarHBondContact NE2-NZ 2.93Å; A205-K498 HydrophobicContact CB-CD 3.5Å; R474-K498 PolarHBondContact O-N 2.81Å; I475-K498 WeakPolarHBondContact CA-O 3.47Å; I475-K498 HydrophobicContact CB-CB 4.44Å; I475-K498 HydrophobicContact CG1-CB 4.1Å; I475-K498 HydrophobicContact CG2-CB 4.14Å; I475-K498 HydrophobicContact CG2-CD 4.3Å; I475-K498 HydrophobicContact CG2-CG 4.36Å; L476-K498 PolarHBondContact N-O 3.48Å; L476-K498 VanDerWaalsContact N-O 3.07Å; I477-K498 HydrophobicContact CD1-CD 4.26Å; I477-K498 HydrophobicContact CD1-CG 4.42Å; K498-Q523 VanDerWaalsContact CA-O 3.3Å; K498-Q523 WeakPolarHBondContact CA-O 3.38Å; K498-Q523 HydrophobicContact CB-CB 4.49Å; K498-Q523 HydrophobicContact CG-CB 4.23Å
499	L	85.1	Confident	88.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	118.1	173.7	175.3	59.4	0	0	0	109.2	L476 F491 L496 L501 L518 I521 Q523 I524 D525	L476-L499 HydrophobicContact CB-CD1 4.26Å; L476-L499 HydrophobicContact CD2-CD1 4.06Å; L476-L499 HydrophobicContact CG-CD1 4.12Å; L476-L499 WeakPolarHBondContact O-CA 3.45Å; F491-L499 HydrophobicContact CE1-CD1 4.3Å; F491-L499 HydrophobicContact CE1-CD2 4.27Å; F491-L499 HydrophobicContact CE2-CD2 3.9Å; F491-L499 HydrophobicContact CZ-CD1 4.17Å; F491-L499 HydrophobicContact CZ-CD2 3.57Å; L496-L499 HydrophobicContact CD1-CD1 4.34Å; L499-L501 HydrophobicContact CD1-CD1 4.01Å; L499-L501 HydrophobicContact CD1-CD2 4.42Å; L499-L501 HydrophobicContact CD1-CG 3.88Å; L499-L501 HydrophobicContact CD2-CD1 3.75Å; L499-L501 HydrophobicContact CD2-CG 4.47Å; L499-L501 HydrophobicContact CG-CD1 3.82Å; L499-L501 HydrophobicContact CG-CG 3.99Å; L499-L518 HydrophobicContact CD2-CD1 3.7Å; L499-L518 HydrophobicContact CD2-CD2 4.19Å; L499-I521 HydrophobicContact CB-CD1 3.79Å; L499-Q523 PolarHBondContact N-O 2.91Å; L499-Q523 VanDerWaalsContact N-O 3.12Å; L499-I524 HydrophobicContact CB-CG1 4.21Å; L499-I524 HydrophobicContact CD2-CD1 4.05Å; L499-I524 HydrophobicContact CG-CD1 4.47Å; L499-I524 HydrophobicContact CG-CG1 4.41Å; L499-I524 WeakPolarHBondContact O-CA 3.38Å; L499-I524 WeakPolarHBondContact O-CG1 3.23Å; L499-D525 PolarHBondContact O-N 2.93Å; L499-D525 VanDerWaalsContact O-N 3.09Å
500	S	81.8	Confident	88.4	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.014	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.4	175.2	178.6	0	0	0	0	110	L476 L478 N479 H502	L476-S500 PolarHBondContact O-N 2.85Å; L478-S500 CarbonylContact C-O 3.44Å; L478-S500 WeakPolarHBondContact CA-O 3.19Å; L478-S500 WeakPolarHBondContact CB-O 3.41Å; L478-S500 PolarHBondContact N-O 2.98Å; N479-S500 WeakPolarHBondContact CB-OG 3.45Å; N479-S500 PolarHBondContact N-O 3.01Å; S500-H502 PolarHBondContact OG-CD2 2.94Å; S500-H502 VanDerWaalsContact OG-CD2 3.23Å
501	L	88.5	Confident	88.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.16	C	C	.	.			trans	-136.8	14.2	-175.9	-75.6	172.1	0	0	0	111.9	L478 L483 L486 L499 N504 F506 D525 L526 N529	L478-L501 HydrophobicContact CB-CD2 3.64Å; L478-L501 HydrophobicContact CD1-CD2 3.97Å; L478-L501 HydrophobicContact CG-CD2 4.47Å; L483-L501 HydrophobicContact CD1-CD2 4.05Å; L486-L501 HydrophobicContact CD1-CD1 4.08Å; L499-L501 HydrophobicContact CD1-CD1 4.01Å; L499-L501 HydrophobicContact CD1-CD2 4.42Å; L499-L501 HydrophobicContact CD1-CG 3.88Å; L499-L501 HydrophobicContact CD2-CD1 3.75Å; L499-L501 HydrophobicContact CD2-CG 4.47Å; L499-L501 HydrophobicContact CG-CD1 3.82Å; L499-L501 HydrophobicContact CG-CG 3.99Å; L501-N504 PolarHBondContact O-ND2 3.07Å; L501-F506 HydrophobicContact CB-CE2 4.07Å; L501-F506 HydrophobicContact CD1-CE2 4.41Å; L501-F506 HydrophobicContact CD2-CE2 3.89Å; L501-F506 HydrophobicContact CD2-CZ 4.1Å; L501-F506 HydrophobicContact CG-CE2 4.35Å; L501-D525 PolarHBondContact N-O 3.16Å; L501-L526 HydrophobicContact CB-CD2 3.93Å; L501-L526 HydrophobicContact CD1-CD2 4.33Å; L501-N529 PolarHBondContact O-ND2 3.2Å
502	H	81.8	Confident	88.1	Confident	3 Å²	3	31.1 Å²	31.1	1%	0.014	19%	0.189	C	C	.	.			trans	-64.3	163.4	178.1	74.6	105.9	0	0	0	113	E133 N479 N480 S500 N504 D525 H527	E133-H502 IonicContact OE2-CE1 2.92Å; E133-H502 PolarHBondContact OE2-CE1 3.28Å; E133-H502 VanDerWaalsContact OE2-CE1 3.29Å; E133-H502 IonicContact OE2-ND1 3.17Å; N479-H502 CarbonylContact C-O 3.4Å; N479-H502 WeakPolarHBondContact CA-O 3.45Å; N479-H502 WeakPolarHBondContact CB-CD2 3.34Å; N479-H502 VanDerWaalsContact CB-NE2 3.27Å; N479-H502 WeakPolarHBondContact CB-NE2 3.43Å; N479-H502 WeakPolarHBondContact CB-O 3.39Å; N479-H502 PolarHBondContact ND2-CE1 2.83Å; N479-H502 PolarHBondContact ND2-NE2 3.02Å; N480-H502 PolarHBondContact N-O 3.48Å; N480-H502 PolarHBondContact ND2-CE1 3.46Å; S500-H502 PolarHBondContact OG-CD2 2.94Å; S500-H502 VanDerWaalsContact OG-CD2 3.23Å; H502-N504 PolarHBondContact O-N 3.16Å; H502-N504 VanDerWaalsContact O-N 3.14Å; H502-N504 PolarHBondContact O-ND2 2.99Å; H502-D525 WeakPolarHBondContact CB-OD2 3.16Å; H502-D525 IonicContact CD2-OD2 2.9Å; H502-D525 PolarHBondContact CD2-OD2 3.01Å; H502-D525 IonicContact CG-OD2 3.63Å; H502-D525 PolarHBondContact N-O 3.26Å; H502-D525 IonicContact NE2-OD2 2.65Å; H502-H527 CarbonylContact C-O 3.23Å; H502-H527 WeakPolarHBondContact CA-O 3.36Å; H502-H527 HydrophobicContact CB-CB 4.43Å; H502-H527 WeakPolarHBondContact CB-ND1 3.14Å; H502-H527 VanDerWaalsContact CB-O 3.22Å; H502-H527 WeakPolarHBondContact CB-O 3.45Å; H502-H527 AromaticContact CD2-CE1 3.92Å; H502-H527 AromaticContact CE1-CE1 3.56Å; H502-H527 AromaticContact CE1-NE2 3.7Å; H502-H527 AromaticContact CG-CE1 3.33Å; H502-H527 AromaticContact CG-ND1 3.7Å; H502-H527 AromaticContact CG-NE2 3.64Å; H502-H527 AromaticContact ND1-CD2 3.84Å; H502-H527 AromaticContact ND1-CE1 3.06Å; H502-H527 PolarHBondContact ND1-CE1 3.23Å; H502-H527 AromaticContact ND1-ND1 3.86Å; H502-H527 AromaticContact ND1-NE2 3Å; H502-H527 PolarHBondContact ND1-NE2 3.06Å
503	N	79.2	Confident	88	Confident	20 Å²	20	30.5 Å²	30.5	11%	0.107	19%	0.185	C	C	.	.	S	Bend	trans	48.8	41.5	179.8	-57.9	-9.3	0	0	0	112.9	K109 E133 N480 H527	K109-N503 PolarHBondContact NZ-ND2 2.97Å; K109-N503 PolarHBondContact NZ-OD1 2.6Å; E133-N503 PolarHBondContact OE1-ND2 3.22Å; E133-N503 PolarHBondContact OE2-ND2 3.48Å; N480-N503 VanDerWaalsContact CA-O 3.29Å; N480-N503 WeakPolarHBondContact CA-O 3.45Å; N480-N503 HydrophobicContact CB-CB 4.39Å; N480-N503 VanDerWaalsContact CG-CB 3.48Å; N480-N503 PolarHBondContact ND2-ND2 3.26Å; N480-N503 WeakPolarHBondContact OD1-CB 3.41Å; N480-N503 PolarHBondContact OD1-ND2 3.05Å; N503-H527 PolarHBondContact N-O 3.23Å; N503-H527 PolarHBondContact OD1-CD2 3.23Å
504	N	88.7	Confident	88.2	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.016	16%	0.156	C	C	.	.	S	Bend	trans	-108.2	-168.9	170.3	-86.4	-98	0	0	0	109.3	L478 N480 N481 L483 L501 H502 F506 N529 P530	L478-N504 PolarHBondContact O-ND2 3.05Å; N480-N504 PolarHBondContact N-ND2 3.01Å; N481-N504 VanDerWaalsContact CB-OD1 3.29Å; N481-N504 WeakPolarHBondContact CB-OD1 3.44Å; N481-N504 PolarHBondContact O-OD1 2.96Å; L483-N504 HydrophobicContact CB-CB 4.43Å; L483-N504 WeakPolarHBondContact CB-OD1 3.15Å; L483-N504 WeakPolarHBondContact CG-OD1 3.24Å; L483-N504 PolarHBondContact N-OD1 3.22Å; L501-N504 PolarHBondContact O-ND2 3.07Å; H502-N504 PolarHBondContact O-N 3.16Å; H502-N504 VanDerWaalsContact O-N 3.14Å; H502-N504 PolarHBondContact O-ND2 2.99Å; N504-F506 HydrophobicContact CB-CD2 3.74Å; N504-F506 HydrophobicContact CB-CE2 3.65Å; N504-N529 VanDerWaalsContact CA-OD1 3.31Å; N504-N529 WeakPolarHBondContact CA-OD1 3.43Å; N504-N529 VanDerWaalsContact CB-OD1 3.25Å; N504-N529 WeakPolarHBondContact CB-OD1 3.46Å; N504-N529 PolarHBondContact N-OD1 3.44Å; N504-N529 PolarHBondContact O-OD1 3.41Å; N504-P530 WeakPolarHBondContact O-CD 3.48Å
505	Y	94.3	Very high	88.2	Confident	84 Å²	84	27.2 Å²	27.2	33%	0.329	15%	0.153	S	C	.	.			trans	-110	30.9	-177.4	-65.5	-95.1	0	0	0	112.7	L482 L483 M507 N529	L482-Y505 HydrophobicContact CD2-CD2 4.32Å; L482-Y505 HydrophobicContact CD2-CE2 3.62Å; L483-Y505 CarbonylContact O-C 3.57Å; L483-Y505 VanDerWaalsContact O-C 3.3Å; L483-Y505 VanDerWaalsContact O-CA 3.29Å; L483-Y505 WeakPolarHBondContact O-CA 3.36Å; L483-Y505 WeakPolarHBondContact O-CB 3.39Å; L483-Y505 PolarHBondContact O-N 3.42Å; Y505-M507 PolarHBondContact O-N 3.24Å; Y505-N529 PolarHBondContact N-OD1 2.92Å
506	F	94.6	Very high	88.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.15	C	C	.	.			trans	-71.9	119.1	176.9	-61.4	-63	0	0	0	111.5	L483 L486 L501 N504 L509 N529 P530 W531	L483-F506 HydrophobicContact CB-CE1 3.84Å; L483-F506 HydrophobicContact CB-CE2 4.11Å; L483-F506 HydrophobicContact CB-CZ 3.42Å; L483-F506 VanDerWaalsContact CB-CZ 3.42Å; L483-F506 HydrophobicContact CD1-CE2 4.49Å; L483-F506 HydrophobicContact CD1-CZ 3.92Å; L483-F506 HydrophobicContact CG-CZ 4.31Å; L486-F506 HydrophobicContact CD2-CE1 4.23Å; L486-F506 HydrophobicContact CD2-CZ 4.02Å; L486-F506 HydrophobicContact CG-CE1 3.93Å; L486-F506 HydrophobicContact CG-CZ 4.04Å; L501-F506 HydrophobicContact CB-CE2 4.07Å; L501-F506 HydrophobicContact CD1-CE2 4.41Å; L501-F506 HydrophobicContact CD2-CE2 3.89Å; L501-F506 HydrophobicContact CD2-CZ 4.1Å; L501-F506 HydrophobicContact CG-CE2 4.35Å; N504-F506 HydrophobicContact CB-CD2 3.74Å; N504-F506 HydrophobicContact CB-CE2 3.65Å; F506-L509 HydrophobicContact CB-CD2 4.36Å; F506-L509 HydrophobicContact CD1-CD2 3.61Å; F506-L509 HydrophobicContact CD2-CD2 4.24Å; F506-L509 HydrophobicContact CE1-CD2 3.9Å; F506-L509 HydrophobicContact CG-CD2 3.81Å; F506-L509 HydrophobicContact CG-CG 4.44Å; F506-L509 HydrophobicContact CZ-CD2 4.34Å; F506-N529 HydrophobicContact CB-CB 4.41Å; F506-N529 WeakPolarHBondContact CB-OD1 3.38Å; F506-N529 WeakPolarHBondContact CD2-OD1 3.42Å; F506-N529 PolarHBondContact N-OD1 2.86Å; F506-N529 VanDerWaalsContact N-OD1 3.08Å; F506-P530 CarbonylContact O-C 3.55Å; F506-P530 WeakPolarHBondContact O-CD 3.49Å; F506-W531 HydrophobicContact CB-CH2 3.85Å; F506-W531 HydrophobicContact CB-CZ3 3.84Å
507	M	92.4	Very high	88.3	Confident	99 Å²	99	29.4 Å²	29.4	49%	0.488	16%	0.158	S	C	.	.	S	Bend	trans	-83.5	-33.4	169.8	-70.7	172.3	173.4	0	0	111.9	Y505 E532	Y505-M507 PolarHBondContact O-N 3.24Å; M507-E532 HydrophobicContact CB-CB 4.14Å; M507-E532 PolarHBondContact O-N 3.08Å
508	Y	91.6	Very high	88.8	Confident	112 Å²	112	29.7 Å²	29.7	44%	0.439	16%	0.159	S	C	.	.			trans	-154.9	161	169.6	66.2	-87.8	0	0	0	108.4
509	L	93.3	Very high	89.4	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.016	19%	0.193	C	C	.	.			trans	-112.1	131.1	170.5	-72.1	172.5	0	0	0	110.2	L486 F506 V511 L515 L526 W531 F540	L486-L509 HydrophobicContact CD1-CD2 4.1Å; L486-L509 HydrophobicContact CG-CD2 4.34Å; F506-L509 HydrophobicContact CB-CD2 4.36Å; F506-L509 HydrophobicContact CD1-CD2 3.61Å; F506-L509 HydrophobicContact CD2-CD2 4.24Å; F506-L509 HydrophobicContact CE1-CD2 3.9Å; F506-L509 HydrophobicContact CG-CD2 3.81Å; F506-L509 HydrophobicContact CG-CG 4.44Å; F506-L509 HydrophobicContact CZ-CD2 4.34Å; L509-V511 PolarHBondContact O-N 3.08Å; L509-L515 HydrophobicContact CB-CD1 3.68Å; L509-L515 HydrophobicContact CB-CG 4.33Å; L509-L515 HydrophobicContact CD1-CD1 4.37Å; L509-L515 HydrophobicContact CD1-CD2 4.35Å; L509-L526 HydrophobicContact CD1-CD1 4.46Å; L509-L526 HydrophobicContact CD1-CD2 3.66Å; L509-W531 HydrophobicContact CD1-CH2 3.81Å; L509-W531 HydrophobicContact CD1-CZ3 4.45Å; L509-W531 HydrophobicContact CG-CH2 3.88Å; L509-W531 HydrophobicContact CG-CZ3 4.06Å; L509-F540 HydrophobicContact CB-CD2 4.44Å; L509-F540 HydrophobicContact CB-CG 4.39Å; L509-F540 HydrophobicContact CD1-CE2 4.43Å; L509-F540 HydrophobicContact CD1-CZ 4.42Å
510	P	92.6	Very high	89.5	Confident	39 Å²	39	37.8 Å²	37.8	25%	0.253	21%	0.211	S	C	.	.			trans	-69.3	131.5	175.4	28.7	-33.3	0	0	0	109.9	V514 L515	P510-V514 HydrophobicContact CG-CB 4.16Å; P510-V514 HydrophobicContact CG-CG2 3.88Å; P510-V514 WeakPolarHBondContact O-CB 3.32Å; P510-L515 WeakPolarHBondContact O-CG 3.49Å
511	V	92.7	Very high	89.6	Confident	32 Å²	32	38.4 Å²	38.4	19%	0.194	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-48.4	175.4	178.9	0	0	0	0	111.4	L509 G513 V514 L515 D516 P539 F540 W543	L509-V511 PolarHBondContact O-N 3.08Å; V511-G513 PolarHBondContact O-N 3.13Å; V511-V514 PolarHBondContact O-N 3.12Å; V511-L515 HydrophobicContact CG2-CD1 4.29Å; V511-L515 PolarHBondContact O-N 3.2Å; V511-L515 VanDerWaalsContact O-N 3.12Å; V511-D516 HydrophobicContact CG1-CB 4.49Å; V511-D516 PolarHBondContact O-N 2.9Å; V511-P539 HydrophobicContact CG2-CB 4.13Å; V511-P539 WeakPolarHBondContact CG2-O 3.45Å; V511-F540 HydrophobicContact CG2-CB 4.31Å; V511-W543 HydrophobicContact CG1-CB 4.25Å; V511-W543 HydrophobicContact CG1-CG 4.26Å; V511-W543 HydrophobicContact CG2-CB 3.86Å; V511-W543 HydrophobicContact CG2-CG 4.32Å
512	A	90.9	Very high	88.7	Confident	75 Å²	75	42.3 Å²	42.3	62%	0.62	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	122.6	-175.3	0	0	0	0	0	112	V514 D516	A512-V514 VanDerWaalsContact C-N 3.31Å; A512-D516 WeakPolarHBondContact CA-OD2 3.34Å
513	G	87.6	Confident	87.9	Confident	14 Å²	14	43 Å²	43	14%	0.144	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	15.4	-178.8	0	0	0	0	0	115.2	V488 D489 V511 D516 Q517	V488-G513 WeakPolarHBondContact CA-O 3.35Å; D489-G513 PolarHBondContact N-O 2.92Å; V511-G513 PolarHBondContact O-N 3.13Å; G513-D516 VanDerWaalsContact CA-OD1 3.29Å; G513-D516 WeakPolarHBondContact CA-OD1 3.27Å; G513-D516 PolarHBondContact N-OD1 3.09Å; G513-D516 PolarHBondContact N-OD2 3.46Å; G513-Q517 PolarHBondContact O-NE2 3.22Å
514	V	93.6	Very high	87.9	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-143.9	-74.6	176.6	176.8	0	0	0	0	110.7	L486 P487 V490 F491 P510 V511 A512 D516 Q517	L486-V514 HydrophobicContact CB-CG1 4.05Å; L486-V514 HydrophobicContact CD1-CG1 3.94Å; P487-V514 VanDerWaalsContact O-CG2 3.28Å; P487-V514 WeakPolarHBondContact O-CG2 3.21Å; V490-V514 HydrophobicContact CG1-CG1 3.96Å; V490-V514 HydrophobicContact CG1-CG2 4.43Å; F491-V514 HydrophobicContact CD2-CG1 4.18Å; F491-V514 HydrophobicContact CE2-CG1 3.95Å; P510-V514 HydrophobicContact CG-CB 4.16Å; P510-V514 HydrophobicContact CG-CG2 3.88Å; P510-V514 WeakPolarHBondContact O-CB 3.32Å; V511-V514 PolarHBondContact O-N 3.12Å; A512-V514 VanDerWaalsContact C-N 3.31Å; V514-D516 PolarHBondContact N-OD1 2.88Å; V514-Q517 VanDerWaalsContact O-CB 3.31Å; V514-Q517 WeakPolarHBondContact O-CB 3.39Å; V514-Q517 WeakPolarHBondContact O-CG 3.43Å; V514-Q517 PolarHBondContact O-N 3.5Å
515	L	92.5	Very high	87.1	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-76.9	-23	-176.9	-59.5	177.9	0	0	0	113.1	L509 P510 V511 Q517 L518 F540 W543	L509-L515 HydrophobicContact CB-CD1 3.68Å; L509-L515 HydrophobicContact CB-CG 4.33Å; L509-L515 HydrophobicContact CD1-CD1 4.37Å; L509-L515 HydrophobicContact CD1-CD2 4.35Å; P510-L515 WeakPolarHBondContact O-CG 3.49Å; V511-L515 HydrophobicContact CG2-CD1 4.29Å; V511-L515 PolarHBondContact O-N 3.2Å; V511-L515 VanDerWaalsContact O-N 3.12Å; L515-Q517 PolarHBondContact O-N 3.15Å; L515-L518 HydrophobicContact CD2-CD1 3.7Å; L515-L518 PolarHBondContact O-N 3.29Å; L515-F540 HydrophobicContact CD1-CD2 3.71Å; L515-F540 HydrophobicContact CD1-CE2 4.27Å; L515-W543 HydrophobicContact CB-CD2 4Å; L515-W543 HydrophobicContact CB-CG 4.42Å; L515-W543 HydrophobicContact CB-CH2 4.29Å; L515-W543 HydrophobicContact CB-CZ2 3.74Å; L515-W543 HydrophobicContact CD1-CD2 4.06Å; L515-W543 HydrophobicContact CD1-CE3 3.86Å; L515-W543 HydrophobicContact CD1-CH2 4.32Å; L515-W543 HydrophobicContact CD1-CZ3 4Å; L515-W543 HydrophobicContact CD2-CH2 4.01Å; L515-W543 HydrophobicContact CD2-CZ2 4.2Å; L515-W543 HydrophobicContact CD2-CZ3 4.42Å; L515-W543 HydrophobicContact CG-CH2 4.45Å; L515-W543 HydrophobicContact CG-CZ2 4.38Å; L515-W543 PolarHBondContact O-NE1 3.24Å
516	D	90.2	Very high	86.7	Confident	82 Å²	82	38 Å²	38	44%	0.439	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-66.4	-16.4	168.7	61.6	-2.5	0	0	0	113.6	V511 A512 G513 V514	V511-D516 HydrophobicContact CG1-CB 4.49Å; V511-D516 PolarHBondContact O-N 2.9Å; A512-D516 WeakPolarHBondContact CA-OD2 3.34Å; G513-D516 VanDerWaalsContact CA-OD1 3.29Å; G513-D516 WeakPolarHBondContact CA-OD1 3.27Å; G513-D516 PolarHBondContact N-OD1 3.09Å; G513-D516 PolarHBondContact N-OD2 3.46Å; V514-D516 PolarHBondContact N-OD1 2.88Å
517	Q	90.8	Very high	85.9	Confident	41 Å²	41	39.5 Å²	39.5	19%	0.192	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-80.3	-20.6	176.4	-47.8	-166.1	-29.4	0	0	112.4	D489 F491 A492 G513 V514 L515 T519	D489-Q517 PolarHBondContact OD1-NE2 3.29Å; F491-Q517 HydrophobicContact CB-CB 4.22Å; A492-Q517 VanDerWaalsContact N-OE1 3.1Å; G513-Q517 PolarHBondContact O-NE2 3.22Å; V514-Q517 VanDerWaalsContact O-CB 3.31Å; V514-Q517 WeakPolarHBondContact O-CB 3.39Å; V514-Q517 WeakPolarHBondContact O-CG 3.43Å; V514-Q517 PolarHBondContact O-N 3.5Å; L515-Q517 PolarHBondContact O-N 3.15Å; Q517-T519 PolarHBondContact O-N 3.27Å
518	L	90	Very high	85.2	Confident	11 Å²	11	37.3 Å²	37.3	6%	0.058	23%	0.226	C	C	.	.			trans	-77.6	48.3	-175.8	-63.2	178.1	0	0	0	113.2	F491 L496 L499 L515 S520 I521 I524 W543	F491-L518 HydrophobicContact CB-CD2 4.23Å; F491-L518 HydrophobicContact CD1-CD2 4.5Å; F491-L518 HydrophobicContact CD2-CD1 4.32Å; F491-L518 HydrophobicContact CD2-CD2 3.59Å; F491-L518 HydrophobicContact CD2-CG 3.95Å; F491-L518 HydrophobicContact CE2-CD1 4.19Å; F491-L518 HydrophobicContact CE2-CD2 4.04Å; F491-L518 HydrophobicContact CE2-CG 4.31Å; F491-L518 HydrophobicContact CG-CD2 3.86Å; L496-L518 HydrophobicContact CB-CD2 4.24Å; L496-L518 HydrophobicContact CD1-CD2 4.11Å; L499-L518 HydrophobicContact CD2-CD1 3.7Å; L499-L518 HydrophobicContact CD2-CD2 4.19Å; L515-L518 HydrophobicContact CD2-CD1 3.7Å; L515-L518 PolarHBondContact O-N 3.29Å; L518-S520 PolarHBondContact O-N 2.76Å; L518-S520 VanDerWaalsContact O-N 3.11Å; L518-I521 HydrophobicContact CB-CB 4.2Å; L518-I521 HydrophobicContact CB-CG2 4.32Å; L518-I521 WeakPolarHBondContact O-CG2 3.49Å; L518-I521 PolarHBondContact O-N 3.44Å; L518-I524 HydrophobicContact CD1-CD1 4.22Å; L518-W543 HydrophobicContact CB-CZ2 4.41Å; L518-W543 HydrophobicContact CD1-CH2 4.32Å; L518-W543 HydrophobicContact CD1-CZ2 4.14Å
519	T	85.7	Confident	85	Confident	119 Å²	119	32.3 Å²	32.3	73%	0.73	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.2	-174.3	56	0	0	0	0	115.7	Q517	Q517-T519 PolarHBondContact O-N 3.27Å
520	S	86	Confident	84.9	Confident	54 Å²	54	33.7 Å²	33.7	38%	0.378	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	13	-178.2	-58.3	0	0	0	0	113.2	L496 S497 L518	L496-S520 CarbonylContact O-C 3.48Å; L496-S520 VanDerWaalsContact O-C 3.25Å; S497-S520 WeakPolarHBondContact CA-O 3.4Å; L518-S520 PolarHBondContact O-N 2.76Å; L518-S520 VanDerWaalsContact O-N 3.11Å
521	I	83.9	Confident	84.9	Confident	16 Å²	16	31.9 Å²	31.9	8%	0.082	20%	0.204	C	C	.	.			trans	-69.6	132.9	-176.2	-159.3	69.8	0	0	0	111	L496 L499 L518 Q523 I524 L547 V551	L496-I521 PolarHBondContact O-N 3.45Å; L499-I521 HydrophobicContact CB-CD1 3.79Å; L518-I521 HydrophobicContact CB-CB 4.2Å; L518-I521 HydrophobicContact CB-CG2 4.32Å; L518-I521 WeakPolarHBondContact O-CG2 3.49Å; L518-I521 PolarHBondContact O-N 3.44Å; I521-Q523 WeakPolarHBondContact CD1-O 3.19Å; I521-I524 HydrophobicContact CG1-CB 4.06Å; I521-L547 HydrophobicContact CG2-CD1 4.28Å; I521-L547 HydrophobicContact CG2-CD2 3.92Å; I521-V551 HydrophobicContact CG2-CG1 4.34Å
522	I	70.2	Confident	84.9	Confident	81 Å²	81	33.2 Å²	33.2	42%	0.415	21%	0.208	S	C	.	.	S	Bend	trans	-123.9	-28.4	-179	-67.5	167	0	0	0	110.6	N233 S497 V551	N233-I522 HydrophobicContact CB-CD1 3.94Å; N233-I522 WeakPolarHBondContact ND2-CG2 3.26Å; N233-I522 WeakPolarHBondContact OD1-CD1 3.33Å; S497-I522 PolarHBondContact O-N 3.41Å; I522-V551 WeakPolarHBondContact O-CA 3.4Å
523	Q	64.5	Low	85	Confident	17 Å²	17	29.7 Å²	29.7	8%	0.079	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	126.9	166.8	-172.4	179.9	18.7	0	0	109.6	S497 K498 L499 I521 V551 M553	S497-Q523 PolarHBondContact O-N 2.83Å; K498-Q523 VanDerWaalsContact CA-O 3.3Å; K498-Q523 WeakPolarHBondContact CA-O 3.38Å; K498-Q523 HydrophobicContact CB-CB 4.49Å; K498-Q523 HydrophobicContact CG-CB 4.23Å; L499-Q523 PolarHBondContact N-O 2.91Å; L499-Q523 VanDerWaalsContact N-O 3.12Å; I521-Q523 WeakPolarHBondContact CD1-O 3.19Å; Q523-V551 WeakPolarHBondContact CA-O 3.05Å; Q523-M553 HydrophobicContact CG-CG 4.04Å
524	I	80.5	Confident	85.2	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.6	166.1	-162.7	172.3	0	0	0	110	L499 L518 I521 L526 W543 L547 V551 L552 M553	L499-I524 HydrophobicContact CB-CG1 4.21Å; L499-I524 HydrophobicContact CD2-CD1 4.05Å; L499-I524 HydrophobicContact CG-CD1 4.47Å; L499-I524 HydrophobicContact CG-CG1 4.41Å; L499-I524 WeakPolarHBondContact O-CA 3.38Å; L499-I524 WeakPolarHBondContact O-CG1 3.23Å; L518-I524 HydrophobicContact CD1-CD1 4.22Å; I521-I524 HydrophobicContact CG1-CB 4.06Å; I524-L526 HydrophobicContact CD1-CD1 4.03Å; I524-L526 HydrophobicContact CD1-CD2 4.26Å; I524-L526 HydrophobicContact CD1-CG 4.23Å; I524-L526 HydrophobicContact CG1-CD1 4.25Å; I524-L526 HydrophobicContact CG1-CD2 4.36Å; I524-L526 HydrophobicContact CG1-CG 4.06Å; I524-L526 HydrophobicContact CG2-CD1 4.43Å; I524-W543 HydrophobicContact CD1-CH2 3.73Å; I524-W543 HydrophobicContact CD1-CZ3 4.3Å; I524-L547 HydrophobicContact CG2-CD1 4.25Å; I524-V551 PolarHBondContact N-O 3.46Å; I524-L552 HydrophobicContact CG2-CD1 4.09Å; I524-M553 PolarHBondContact O-N 2.82Å; I524-M553 VanDerWaalsContact O-N 3.1Å
525	D	71.1	Confident	85	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137.1	172.8	180	37	0	0	0	112.1	L499 L501 H502 H527 S554	L499-D525 PolarHBondContact O-N 2.93Å; L499-D525 VanDerWaalsContact O-N 3.09Å; L501-D525 PolarHBondContact N-O 3.16Å; H502-D525 WeakPolarHBondContact CB-OD2 3.16Å; H502-D525 IonicContact CD2-OD2 2.9Å; H502-D525 PolarHBondContact CD2-OD2 3.01Å; H502-D525 IonicContact CG-OD2 3.63Å; H502-D525 PolarHBondContact N-O 3.26Å; H502-D525 IonicContact NE2-OD2 2.65Å; D525-H527 VanDerWaalsContact CG-ND1 3.26Å; D525-H527 IonicContact OD1-CE1 3.48Å; D525-H527 IonicContact OD1-CG 3.25Å; D525-H527 PolarHBondContact OD1-N 3.06Å; D525-H527 IonicContact OD1-ND1 2.65Å; D525-H527 PolarHBondContact OD1-ND1 3Å; D525-H527 IonicContact OD2-CE1 2.79Å; D525-H527 PolarHBondContact OD2-CE1 3.14Å; D525-H527 VanDerWaalsContact OD2-CE1 3.24Å; D525-H527 IonicContact OD2-ND1 2.59Å; D525-H527 PolarHBondContact OD2-ND1 2.99Å; D525-S554 WeakPolarHBondContact CA-OG 3.27Å; D525-S554 PolarHBondContact OD1-OG 3.13Å
526	L	85.4	Confident	84.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.218	C	C	.	.			trans	-147.8	4.4	-158.3	-69.1	177.8	0	0	0	111.8	L501 L509 I524 N529 W531 F540 L552 S554 L556	L501-L526 HydrophobicContact CB-CD2 3.93Å; L501-L526 HydrophobicContact CD1-CD2 4.33Å; L509-L526 HydrophobicContact CD1-CD1 4.46Å; L509-L526 HydrophobicContact CD1-CD2 3.66Å; I524-L526 HydrophobicContact CD1-CD1 4.03Å; I524-L526 HydrophobicContact CD1-CD2 4.26Å; I524-L526 HydrophobicContact CD1-CG 4.23Å; I524-L526 HydrophobicContact CG1-CD1 4.25Å; I524-L526 HydrophobicContact CG1-CD2 4.36Å; I524-L526 HydrophobicContact CG1-CG 4.06Å; I524-L526 HydrophobicContact CG2-CD1 4.43Å; L526-N529 PolarHBondContact O-ND2 2.6Å; L526-N529 VanDerWaalsContact O-ND2 3.14Å; L526-W531 HydrophobicContact CB-CZ2 4.07Å; L526-W531 WeakPolarHBondContact O-CZ2 3.22Å; L526-W531 PolarHBondContact O-NE1 3.24Å; L526-F540 HydrophobicContact CD1-CE2 3.81Å; L526-F540 HydrophobicContact CD1-CZ 3.71Å; L526-L552 HydrophobicContact CD1-CD1 4.04Å; L526-S554 PolarHBondContact N-OG 3.29Å; L526-L556 HydrophobicContact CB-CD2 3.76Å
527	H	79.3	Confident	84.9	Confident	32 Å²	32	32.2 Å²	32.2	15%	0.148	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	168.7	-177.9	76.5	-102.9	0	0	0	112.7	E133 E157 H502 N503 D525 N529 S554	E133-H527 IonicContact OE1-NE2 3.12Å; E157-H527 IonicContact OE1-CE1 3.24Å; H502-H527 CarbonylContact C-O 3.23Å; H502-H527 WeakPolarHBondContact CA-O 3.36Å; H502-H527 HydrophobicContact CB-CB 4.43Å; H502-H527 WeakPolarHBondContact CB-ND1 3.14Å; H502-H527 VanDerWaalsContact CB-O 3.22Å; H502-H527 WeakPolarHBondContact CB-O 3.45Å; H502-H527 AromaticContact CD2-CE1 3.92Å; H502-H527 AromaticContact CE1-CE1 3.56Å; H502-H527 AromaticContact CE1-NE2 3.7Å; H502-H527 AromaticContact CG-CE1 3.33Å; H502-H527 AromaticContact CG-ND1 3.7Å; H502-H527 AromaticContact CG-NE2 3.64Å; H502-H527 AromaticContact ND1-CD2 3.84Å; H502-H527 AromaticContact ND1-CE1 3.06Å; H502-H527 PolarHBondContact ND1-CE1 3.23Å; H502-H527 AromaticContact ND1-ND1 3.86Å; H502-H527 AromaticContact ND1-NE2 3Å; H502-H527 PolarHBondContact ND1-NE2 3.06Å; N503-H527 PolarHBondContact N-O 3.23Å; N503-H527 PolarHBondContact OD1-CD2 3.23Å; D525-H527 VanDerWaalsContact CG-ND1 3.26Å; D525-H527 IonicContact OD1-CE1 3.48Å; D525-H527 IonicContact OD1-CG 3.25Å; D525-H527 PolarHBondContact OD1-N 3.06Å; D525-H527 IonicContact OD1-ND1 2.65Å; D525-H527 PolarHBondContact OD1-ND1 3Å; D525-H527 IonicContact OD2-CE1 2.79Å; D525-H527 PolarHBondContact OD2-CE1 3.14Å; D525-H527 VanDerWaalsContact OD2-CE1 3.24Å; D525-H527 IonicContact OD2-ND1 2.59Å; D525-H527 PolarHBondContact OD2-ND1 2.99Å; H527-N529 PolarHBondContact O-N 3.36Å; H527-N529 PolarHBondContact O-ND2 2.89Å; H527-S554 PolarHBondContact N-OG 2.92Å
528	G	77.6	Confident	84.9	Confident	52 Å²	52	30.7 Å²	30.7	54%	0.536	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	8.4	174.3	0	0	0	0	0	116.7
529	N	85.9	Confident	84.9	Confident	8 Å²	8	33.3 Å²	33.3	4%	0.043	21%	0.209	C	C	.	.			trans	-87.5	146.8	174.3	-82.7	-84.1	0	0	0	111.6	L501 N504 Y505 F506 L526 H527 W531	L501-N529 PolarHBondContact O-ND2 3.2Å; N504-N529 VanDerWaalsContact CA-OD1 3.31Å; N504-N529 WeakPolarHBondContact CA-OD1 3.43Å; N504-N529 VanDerWaalsContact CB-OD1 3.25Å; N504-N529 WeakPolarHBondContact CB-OD1 3.46Å; N504-N529 PolarHBondContact N-OD1 3.44Å; N504-N529 PolarHBondContact O-OD1 3.41Å; Y505-N529 PolarHBondContact N-OD1 2.92Å; F506-N529 HydrophobicContact CB-CB 4.41Å; F506-N529 WeakPolarHBondContact CB-OD1 3.38Å; F506-N529 WeakPolarHBondContact CD2-OD1 3.42Å; F506-N529 PolarHBondContact N-OD1 2.86Å; F506-N529 VanDerWaalsContact N-OD1 3.08Å; L526-N529 PolarHBondContact O-ND2 2.6Å; L526-N529 VanDerWaalsContact O-ND2 3.14Å; H527-N529 PolarHBondContact O-N 3.36Å; H527-N529 PolarHBondContact O-ND2 2.89Å; N529-W531 VanDerWaalsContact C-N 3.27Å; N529-W531 HydrophobicContact CB-CD2 4.15Å; N529-W531 HydrophobicContact CB-CH2 4.24Å; N529-W531 HydrophobicContact CB-CZ2 3.55Å; N529-W531 VanDerWaalsContact O-CD1 3.25Å; N529-W531 PolarHBondContact O-N 2.87Å
530	P	91.2	Very high	85.2	Confident	32 Å²	32	27.7 Å²	27.7	21%	0.208	17%	0.174	C	C	.	.			trans	-81.1	64.5	-175.9	35	-38.5	0	0	0	112.7	N504 F506 E532 E559	N504-P530 WeakPolarHBondContact O-CD 3.48Å; F506-P530 CarbonylContact O-C 3.55Å; F506-P530 WeakPolarHBondContact O-CD 3.49Å; P530-E532 PolarHBondContact O-N 3.09Å; P530-E559 HydrophobicContact CB-CB 4Å; P530-E559 HydrophobicContact CB-CG 4.04Å
531	W	93.4	Very high	85.4	Confident	1 Å²	1	25.5 Å²	25.5	0%	0.004	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	129.9	-172.8	-61.8	113.8	0	0	0	113.5	F506 L509 L526 N529 I537 F540 E559 T560 F569	F506-W531 HydrophobicContact CB-CH2 3.85Å; F506-W531 HydrophobicContact CB-CZ3 3.84Å; L509-W531 HydrophobicContact CD1-CH2 3.81Å; L509-W531 HydrophobicContact CD1-CZ3 4.45Å; L509-W531 HydrophobicContact CG-CH2 3.88Å; L509-W531 HydrophobicContact CG-CZ3 4.06Å; L526-W531 HydrophobicContact CB-CZ2 4.07Å; L526-W531 WeakPolarHBondContact O-CZ2 3.22Å; L526-W531 PolarHBondContact O-NE1 3.24Å; N529-W531 VanDerWaalsContact C-N 3.27Å; N529-W531 HydrophobicContact CB-CD2 4.15Å; N529-W531 HydrophobicContact CB-CH2 4.24Å; N529-W531 HydrophobicContact CB-CZ2 3.55Å; N529-W531 VanDerWaalsContact O-CD1 3.25Å; N529-W531 PolarHBondContact O-N 2.87Å; W531-I537 HydrophobicContact CB-CD1 3.9Å; W531-I537 HydrophobicContact CD2-CD1 4.44Å; W531-I537 HydrophobicContact CE3-CD1 4.13Å; W531-I537 HydrophobicContact CG-CD1 4.39Å; W531-F540 HydrophobicContact CD2-CE1 4.2Å; W531-F540 HydrophobicContact CE3-CD1 4.32Å; W531-F540 AromaticContact CE3-CE1 3.74Å; W531-F540 HydrophobicContact CE3-CE1 3.74Å; W531-F540 AromaticContact CH2-CE1 3.59Å; W531-F540 HydrophobicContact CH2-CE1 3.59Å; W531-F540 AromaticContact CH2-CZ 3.92Å; W531-F540 HydrophobicContact CH2-CZ 3.92Å; W531-F540 HydrophobicContact CZ2-CE1 4.02Å; W531-F540 HydrophobicContact CZ2-CZ 4.19Å; W531-F540 HydrophobicContact CZ3-CD1 4.03Å; W531-F540 AromaticContact CZ3-CE1 3.42Å; W531-F540 HydrophobicContact CZ3-CE1 3.42Å; W531-F540 VanDerWaalsContact CZ3-CE1 3.42Å; W531-F540 HydrophobicContact CZ3-CZ 4.22Å; W531-E559 PolarHBondContact O-N 3.37Å; W531-T560 PolarHBondContact O-N 2.84Å; W531-T560 VanDerWaalsContact O-N 3.16Å; W531-F569 HydrophobicContact CB-CD1 4.21Å; W531-F569 HydrophobicContact CB-CE1 4.02Å; W531-F569 AromaticContact CD1-CE1 3.96Å; W531-F569 HydrophobicContact CD2-CE1 4.05Å; W531-F569 HydrophobicContact CG-CD1 4.32Å; W531-F569 AromaticContact CG-CE1 3.72Å; W531-F569 HydrophobicContact CG-CE1 3.72Å
532	E	93.4	Very high	85.7	Confident	59 Å²	59	28.1 Å²	28.1	28%	0.276	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	100.5	171.9	-174.5	-160.3	-109.2	0	0	109.7	M507 P530 S534 T536 I537 T560	M507-E532 HydrophobicContact CB-CB 4.14Å; M507-E532 PolarHBondContact O-N 3.08Å; P530-E532 PolarHBondContact O-N 3.09Å; E532-S534 PolarHBondContact O-N 3.5Å; E532-S534 WeakPolarHBondContact OE2-CB 3.47Å; E532-S534 PolarHBondContact OE2-OG 3.02Å; E532-T536 PolarHBondContact OE2-OG1 3.31Å; E532-I537 WeakPolarHBondContact O-CB 3.46Å; E532-T560 WeakPolarHBondContact CA-OG1 3.49Å
533	C	92.7	Very high	86.7	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.007	16%	0.156	C	C	.	.			trans	-78.6	63.8	178.1	-64	0	0	0	0	112.1	C558 T560 P561 F564 F569	C533-C558 HydrophobicContact CB-CB 3.88Å; C533-C558 WeakPolarHBondContact CB-SG 3.39Å; C533-C558 VanDerWaalsContact SG-CA 3.54Å; C533-C558 WeakPolarHBondContact SG-CB 3.17Å; C533-C558 CovalentContact SG-SG 2.02Å; C533-C558 PolarHBondContact SG-SG 3.18Å; C533-T560 WeakPolarHBondContact CB-O 3.49Å; C533-T560 PolarHBondContact N-O 2.96Å; C533-P561 WeakPolarHBondContact O-CD 3.29Å; C533-F564 HydrophobicContact CB-CB 4.31Å; C533-F564 HydrophobicContact CB-CD2 4.03Å; C533-F569 VanDerWaalsContact SG-CB 3.5Å
534	S	90.9	Very high	87.8	Confident	34 Å²	34	25 Å²	25	24%	0.238	15%	0.153	C	C	.	.	S	Bend	trans	-117.4	-175.8	172.4	94.9	0	0	0	0	111	E532 T536 I537 I577	E532-S534 PolarHBondContact O-N 3.5Å; E532-S534 WeakPolarHBondContact OE2-CB 3.47Å; E532-S534 PolarHBondContact OE2-OG 3.02Å; S534-T536 PolarHBondContact O-N 3.32Å; S534-T536 PolarHBondContact OG-N 3.37Å; S534-T536 PolarHBondContact OG-OG1 3.01Å; S534-I537 WeakPolarHBondContact O-CG2 3.19Å; S534-I537 PolarHBondContact O-N 3.34Å; S534-I577 WeakPolarHBondContact O-CG2 3.45Å
535	C	89.3	Confident	88.1	Confident	56 Å²	56	29.4 Å²	29.4	38%	0.378	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-21.7	173.1	-69.1	0	0	0	0	114.8	I537 C578	C535-I537 VanDerWaalsContact C-N 3.35Å; C535-C578 HydrophobicContact CB-CB 3.9Å; C535-C578 WeakPolarHBondContact CB-SG 3.29Å; C535-C578 WeakPolarHBondContact SG-CA 3.16Å; C535-C578 WeakPolarHBondContact SG-CB 3.43Å; C535-C578 CovalentContact SG-SG 2.04Å; C535-C578 PolarHBondContact SG-SG 2.87Å
536	T	89.1	Confident	88.8	Confident	59 Å²	59	38.9 Å²	38.9	36%	0.362	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.9	176.8	54.1	0	0	0	0	113.1	E532 S534 P539	E532-T536 PolarHBondContact OE2-OG1 3.31Å; S534-T536 PolarHBondContact O-N 3.32Å; S534-T536 PolarHBondContact OG-N 3.37Å; S534-T536 PolarHBondContact OG-OG1 3.01Å; T536-P539 WeakPolarHBondContact O-CD 3.5Å
537	I	91.4	Very high	88.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-19.6	-174.1	-142.9	166.5	0	0	0	113.6	W531 E532 S534 C535 P539 F540 K541 F569 I577	W531-I537 HydrophobicContact CB-CD1 3.9Å; W531-I537 HydrophobicContact CD2-CD1 4.44Å; W531-I537 HydrophobicContact CE3-CD1 4.13Å; W531-I537 HydrophobicContact CG-CD1 4.39Å; E532-I537 WeakPolarHBondContact O-CB 3.46Å; S534-I537 WeakPolarHBondContact O-CG2 3.19Å; S534-I537 PolarHBondContact O-N 3.34Å; C535-I537 VanDerWaalsContact C-N 3.35Å; I537-P539 VanDerWaalsContact C-CD 3.49Å; I537-F540 HydrophobicContact CD1-CD1 4.35Å; I537-F540 HydrophobicContact CG1-CD1 3.74Å; I537-F540 HydrophobicContact CG1-CE1 4.46Å; I537-F540 WeakPolarHBondContact O-CA 3.25Å; I537-F540 WeakPolarHBondContact O-CB 3.31Å; I537-F540 PolarHBondContact O-N 3.11Å; I537-K541 PolarHBondContact O-N 2.84Å; I537-F569 HydrophobicContact CD1-CD1 3.7Å; I537-F569 HydrophobicContact CD1-CD2 4.46Å; I537-F569 HydrophobicContact CD1-CE1 3.43Å; I537-F569 VanDerWaalsContact CD1-CE1 3.43Å; I537-F569 HydrophobicContact CD1-CE2 4.25Å; I537-F569 HydrophobicContact CD1-CG 4.22Å; I537-F569 HydrophobicContact CD1-CZ 3.74Å; I537-F569 HydrophobicContact CG1-CE1 4.37Å; I537-F569 HydrophobicContact CG1-CE2 4.44Å; I537-F569 HydrophobicContact CG1-CZ 4.19Å; I537-I577 HydrophobicContact CG2-CD1 4.5Å; I537-I577 HydrophobicContact CG2-CG2 4.01Å
538	V	90.7	Very high	88	Confident	9 Å²	9	41.3 Å²	41.3	6%	0.055	23%	0.231	C	C	.	.	H	α-helix	trans	-54.9	-41.6	-173.1	-179.7	0	0	0	0	113.5	K541 Q542 I577 C578 L581	V538-K541 PolarHBondContact O-N 3.41Å; V538-Q542 WeakPolarHBondContact O-CB 3.32Å; V538-Q542 WeakPolarHBondContact O-CG 3.41Å; V538-Q542 PolarHBondContact O-N 2.89Å; V538-I577 HydrophobicContact CG2-CB 4.4Å; V538-I577 HydrophobicContact CG2-CG2 3.67Å; V538-C578 HydrophobicContact CG2-CB 3.88Å; V538-L581 HydrophobicContact CG1-CD1 4.44Å
539	P	90.9	Very high	87.2	Confident	67 Å²	67	44.1 Å²	44.1	44%	0.435	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-40.6	174.7	-21.8	34.7	0	0	0	112.9	V511 T536 I537 Q542 W543	V511-P539 HydrophobicContact CG2-CB 4.13Å; V511-P539 WeakPolarHBondContact CG2-O 3.45Å; T536-P539 WeakPolarHBondContact O-CD 3.5Å; I537-P539 VanDerWaalsContact C-CD 3.49Å; P539-Q542 PolarHBondContact O-N 2.9Å; P539-W543 PolarHBondContact O-N 2.97Å
540	F	92	Very high	85.5	Confident	1 Å²	1	52.3 Å²	52.3	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-67.9	-42.8	178.4	165.2	-136.2	0	0	0	111.4	L509 V511 L515 L526 W531 I537 Q542 W543 A544 L556 F569	L509-F540 HydrophobicContact CB-CD2 4.44Å; L509-F540 HydrophobicContact CB-CG 4.39Å; L509-F540 HydrophobicContact CD1-CE2 4.43Å; L509-F540 HydrophobicContact CD1-CZ 4.42Å; V511-F540 HydrophobicContact CG2-CB 4.31Å; L515-F540 HydrophobicContact CD1-CD2 3.71Å; L515-F540 HydrophobicContact CD1-CE2 4.27Å; L526-F540 HydrophobicContact CD1-CE2 3.81Å; L526-F540 HydrophobicContact CD1-CZ 3.71Å; W531-F540 HydrophobicContact CD2-CE1 4.2Å; W531-F540 HydrophobicContact CE3-CD1 4.32Å; W531-F540 AromaticContact CE3-CE1 3.74Å; W531-F540 HydrophobicContact CE3-CE1 3.74Å; W531-F540 AromaticContact CH2-CE1 3.59Å; W531-F540 HydrophobicContact CH2-CE1 3.59Å; W531-F540 AromaticContact CH2-CZ 3.92Å; W531-F540 HydrophobicContact CH2-CZ 3.92Å; W531-F540 HydrophobicContact CZ2-CE1 4.02Å; W531-F540 HydrophobicContact CZ2-CZ 4.19Å; W531-F540 HydrophobicContact CZ3-CD1 4.03Å; W531-F540 AromaticContact CZ3-CE1 3.42Å; W531-F540 HydrophobicContact CZ3-CE1 3.42Å; W531-F540 VanDerWaalsContact CZ3-CE1 3.42Å; W531-F540 HydrophobicContact CZ3-CZ 4.22Å; I537-F540 HydrophobicContact CD1-CD1 4.35Å; I537-F540 HydrophobicContact CG1-CD1 3.74Å; I537-F540 HydrophobicContact CG1-CE1 4.46Å; I537-F540 WeakPolarHBondContact O-CA 3.25Å; I537-F540 WeakPolarHBondContact O-CB 3.31Å; I537-F540 PolarHBondContact O-N 3.11Å; F540-Q542 PolarHBondContact O-N 3.34Å; F540-W543 AromaticContact CD2-CE3 3.97Å; F540-W543 HydrophobicContact CD2-CE3 3.97Å; F540-W543 HydrophobicContact CD2-CZ3 4.41Å; F540-W543 HydrophobicContact CE2-CE3 4.07Å; F540-W543 HydrophobicContact CE2-CZ3 4.11Å; F540-W543 WeakPolarHBondContact O-CB 3.42Å; F540-W543 PolarHBondContact O-N 3.12Å; F540-W543 VanDerWaalsContact O-N 3.07Å; F540-A544 HydrophobicContact CE2-CB 4.49Å; F540-A544 PolarHBondContact O-N 3.21Å; F540-L556 HydrophobicContact CZ-CD1 4.23Å; F540-F569 HydrophobicContact CD1-CZ 4.02Å; F540-F569 HydrophobicContact CE1-CE1 4.25Å; F540-F569 HydrophobicContact CE1-CE2 4.47Å; F540-F569 AromaticContact CE1-CZ 3.53Å; F540-F569 HydrophobicContact CE1-CZ 3.53Å; F540-F569 HydrophobicContact CZ-CZ 4.12Å
541	K	90.3	Very high	84	Confident	7 Å²	7	52 Å²	52	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-54.7	-49.3	170	-176.7	175.4	-176.5	-78.4	0	111.5	I537 V538 W543 A544 E545 F569 M570 L572 N574 I577	I537-K541 PolarHBondContact O-N 2.84Å; V538-K541 PolarHBondContact O-N 3.41Å; K541-W543 PolarHBondContact O-N 3.04Å; K541-A544 PolarHBondContact O-N 3.42Å; K541-E545 HydrophobicContact CG-CG 4.42Å; K541-E545 IonicContact NZ-OE1 2.69Å; K541-E545 PolarHBondContact NZ-OE1 3.27Å; K541-E545 WeakPolarHBondContact O-CB 3.47Å; K541-E545 VanDerWaalsContact O-CG 3.25Å; K541-E545 WeakPolarHBondContact O-CG 3.29Å; K541-E545 PolarHBondContact O-N 3.31Å; K541-F569 HydrophobicContact CB-CD2 4.15Å; K541-F569 HydrophobicContact CB-CE2 3.97Å; K541-F569 HydrophobicContact CD-CD2 4.09Å; K541-F569 WeakPolarHBondContact CE-O 3.45Å; K541-F569 HydrophobicContact CG-CD2 4.08Å; K541-F569 HydrophobicContact CG-CE2 4.24Å; K541-M570 HydrophobicContact CG-SD 4.14Å; K541-L572 WeakPolarHBondContact CE-O 3.42Å; K541-L572 PolarHBondContact NZ-O 2.6Å; K541-N574 WeakPolarHBondContact CD-OD1 3.38Å; K541-N574 PolarHBondContact NZ-OD1 2.96Å; K541-I577 HydrophobicContact CD-CD1 3.85Å
542	Q	89.9	Confident	82.9	Confident	72 Å²	72	53 Å²	53	34%	0.336	28%	0.283	S	S	.	.	H	α-helix	trans	-66	-19.1	177.1	-72.3	179.3	8.7	0	0	114.7	V538 P539 F540 R546	V538-Q542 WeakPolarHBondContact O-CB 3.32Å; V538-Q542 WeakPolarHBondContact O-CG 3.41Å; V538-Q542 PolarHBondContact O-N 2.89Å; P539-Q542 PolarHBondContact O-N 2.9Å; F540-Q542 PolarHBondContact O-N 3.34Å; Q542-R546 VanDerWaalsContact O-CD 3.3Å; Q542-R546 WeakPolarHBondContact O-CD 3.35Å; Q542-R546 VanDerWaalsContact O-CG 3.3Å; Q542-R546 WeakPolarHBondContact O-CG 3.47Å; Q542-R546 PolarHBondContact O-NE 3Å; Q542-R546 VanDerWaalsContact O-NE 3.12Å
543	W	90.9	Very high	81.1	Confident	30 Å²	30	54.6 Å²	54.6	11%	0.114	29%	0.292	C	S	.	.	H	α-helix	trans	-82.6	-45.7	171.7	173.6	94	0	0	0	110.7	V511 L515 L518 I524 P539 F540 K541 E545 R546 L547	V511-W543 HydrophobicContact CG1-CB 4.25Å; V511-W543 HydrophobicContact CG1-CG 4.26Å; V511-W543 HydrophobicContact CG2-CB 3.86Å; V511-W543 HydrophobicContact CG2-CG 4.32Å; L515-W543 HydrophobicContact CB-CD2 4Å; L515-W543 HydrophobicContact CB-CG 4.42Å; L515-W543 HydrophobicContact CB-CH2 4.29Å; L515-W543 HydrophobicContact CB-CZ2 3.74Å; L515-W543 HydrophobicContact CD1-CD2 4.06Å; L515-W543 HydrophobicContact CD1-CE3 3.86Å; L515-W543 HydrophobicContact CD1-CH2 4.32Å; L515-W543 HydrophobicContact CD1-CZ3 4Å; L515-W543 HydrophobicContact CD2-CH2 4.01Å; L515-W543 HydrophobicContact CD2-CZ2 4.2Å; L515-W543 HydrophobicContact CD2-CZ3 4.42Å; L515-W543 HydrophobicContact CG-CH2 4.45Å; L515-W543 HydrophobicContact CG-CZ2 4.38Å; L515-W543 PolarHBondContact O-NE1 3.24Å; L518-W543 HydrophobicContact CB-CZ2 4.41Å; L518-W543 HydrophobicContact CD1-CH2 4.32Å; L518-W543 HydrophobicContact CD1-CZ2 4.14Å; I524-W543 HydrophobicContact CD1-CH2 3.73Å; I524-W543 HydrophobicContact CD1-CZ3 4.3Å; P539-W543 PolarHBondContact O-N 2.97Å; F540-W543 AromaticContact CD2-CE3 3.97Å; F540-W543 HydrophobicContact CD2-CE3 3.97Å; F540-W543 HydrophobicContact CD2-CZ3 4.41Å; F540-W543 HydrophobicContact CE2-CE3 4.07Å; F540-W543 HydrophobicContact CE2-CZ3 4.11Å; F540-W543 WeakPolarHBondContact O-CB 3.42Å; F540-W543 PolarHBondContact O-N 3.12Å; F540-W543 VanDerWaalsContact O-N 3.07Å; K541-W543 PolarHBondContact O-N 3.04Å; W543-E545 PolarHBondContact O-N 3.44Å; W543-R546 WeakPolarHBondContact O-CB 3.45Å; W543-R546 PolarHBondContact O-N 3.04Å; W543-R546 VanDerWaalsContact O-N 3.1Å; W543-L547 HydrophobicContact CD2-CD1 4.32Å; W543-L547 HydrophobicContact CE3-CD1 4.05Å; W543-L547 HydrophobicContact CH2-CD1 3.41Å; W543-L547 VanDerWaalsContact CH2-CD1 3.41Å; W543-L547 HydrophobicContact CZ2-CD1 3.69Å; W543-L547 HydrophobicContact CZ3-CD1 3.6Å; W543-L547 PolarHBondContact O-N 3.01Å
544	A	88	Confident	79.7	Confident	3 Å²	3	55.5 Å²	55.5	3%	0.025	30%	0.298	C	S	.	.	H	α-helix	trans	-61.4	-41.6	175.7	0	0	0	0	0	112.3	F540 K541 R546 L547 G548 L552 M570	F540-A544 HydrophobicContact CE2-CB 4.49Å; F540-A544 PolarHBondContact O-N 3.21Å; K541-A544 PolarHBondContact O-N 3.42Å; A544-R546 PolarHBondContact O-N 3.06Å; A544-L547 PolarHBondContact O-N 2.76Å; A544-L547 VanDerWaalsContact O-N 3.09Å; A544-G548 PolarHBondContact O-N 2.95Å; A544-L552 HydrophobicContact CB-CD2 4.32Å; A544-M570 HydrophobicContact CB-CE 3.73Å; A544-M570 HydrophobicContact CB-SD 3.94Å
545	E	87.1	Confident	78.6	Confident	91 Å²	91	58.6 Å²	58.6	43%	0.425	31%	0.312	S	S	.	.	H	α-helix	trans	-55.6	-23.7	174.1	-77.8	171.1	172.5	0	0	113.2	K541 W543 M570	K541-E545 HydrophobicContact CG-CG 4.42Å; K541-E545 IonicContact NZ-OE1 2.69Å; K541-E545 PolarHBondContact NZ-OE1 3.27Å; K541-E545 WeakPolarHBondContact O-CB 3.47Å; K541-E545 VanDerWaalsContact O-CG 3.25Å; K541-E545 WeakPolarHBondContact O-CG 3.29Å; K541-E545 PolarHBondContact O-N 3.31Å; W543-E545 PolarHBondContact O-N 3.44Å; E545-M570 HydrophobicContact CG-CE 3.82Å
546	R	86.1	Confident	78.3	Confident	203 Å²	203	56 Å²	56	77%	0.766	29%	0.294	S	S	*	.	H	α-helix	trans	-93	-17.8	-179.9	-64.9	171.1	-168.9	-173	3.5	114.3	Q542 W543 A544	Q542-R546 VanDerWaalsContact O-CD 3.3Å; Q542-R546 WeakPolarHBondContact O-CD 3.35Å; Q542-R546 VanDerWaalsContact O-CG 3.3Å; Q542-R546 WeakPolarHBondContact O-CG 3.47Å; Q542-R546 PolarHBondContact O-NE 3Å; Q542-R546 VanDerWaalsContact O-NE 3.12Å; W543-R546 WeakPolarHBondContact O-CB 3.45Å; W543-R546 PolarHBondContact O-N 3.04Å; W543-R546 VanDerWaalsContact O-N 3.1Å; A544-R546 PolarHBondContact O-N 3.06Å
547	L	79.1	Confident	78.2	Confident	47 Å²	47	57.6 Å²	57.6	25%	0.246	30%	0.297	C	S	.	.	H	α-helix	trans	-80.4	-31.7	176.4	-68.6	-179	0	0	0	112	I521 I524 W543 A544 V551	I521-L547 HydrophobicContact CG2-CD1 4.28Å; I521-L547 HydrophobicContact CG2-CD2 3.92Å; I524-L547 HydrophobicContact CG2-CD1 4.25Å; W543-L547 HydrophobicContact CD2-CD1 4.32Å; W543-L547 HydrophobicContact CE3-CD1 4.05Å; W543-L547 HydrophobicContact CH2-CD1 3.41Å; W543-L547 VanDerWaalsContact CH2-CD1 3.41Å; W543-L547 HydrophobicContact CZ2-CD1 3.69Å; W543-L547 HydrophobicContact CZ3-CD1 3.6Å; W543-L547 PolarHBondContact O-N 3.01Å; A544-L547 PolarHBondContact O-N 2.76Å; A544-L547 VanDerWaalsContact O-N 3.09Å; L547-V551 HydrophobicContact CB-CB 4.1Å; L547-V551 HydrophobicContact CB-CG1 4.06Å; L547-V551 HydrophobicContact CD1-CG1 4.09Å; L547-V551 HydrophobicContact CD2-CG1 4.39Å; L547-V551 HydrophobicContact CG-CG1 4.43Å
548	G	67.1	Low	78.1	Confident	36 Å²	36	57.7 Å²	57.7	37%	0.371	30%	0.297	S	S	.	.			trans	81.5	163.1	-176.4	0	0	0	0	0	113.6	A544 E550 V551 L552	A544-G548 PolarHBondContact O-N 2.95Å; G548-E550 PolarHBondContact O-N 3.45Å; G548-V551 PolarHBondContact O-N 3.04Å; G548-L552 PolarHBondContact O-N 2.99Å
549	S	62	Low	78.2	Confident	110 Å²	110	61.8 Å²	61.8	77%	0.769	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-8.8	-174.8	51.9	0	0	0	0	114.9
550	E	50.7	Low	78.1	Confident	180 Å²	180	61.4 Å²	61.4	84%	0.841	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-23	173.9	-64	178	174.8	0	0	112.1	G548	G548-E550 PolarHBondContact O-N 3.45Å
551	V	58.3	Low	78	Confident	26 Å²	26	63.6 Å²	63.6	16%	0.158	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-33.2	-179	175.3	0	0	0	0	111.7	I521 I522 Q523 I524 L547 G548	I521-V551 HydrophobicContact CG2-CG1 4.34Å; I522-V551 WeakPolarHBondContact O-CA 3.4Å; Q523-V551 WeakPolarHBondContact CA-O 3.05Å; I524-V551 PolarHBondContact N-O 3.46Å; L547-V551 HydrophobicContact CB-CB 4.1Å; L547-V551 HydrophobicContact CB-CG1 4.06Å; L547-V551 HydrophobicContact CD1-CG1 4.09Å; L547-V551 HydrophobicContact CD2-CG1 4.39Å; L547-V551 HydrophobicContact CG-CG1 4.43Å; G548-V551 PolarHBondContact O-N 3.04Å
552	L	69.9	Low	77.9	Confident	22 Å²	22	69.4 Å²	69.4	12%	0.115	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-95	104	179.2	176.4	66.6	0	0	0	111	I524 L526 A544 G548 S554 L556	I524-L552 HydrophobicContact CG2-CD1 4.09Å; L526-L552 HydrophobicContact CD1-CD1 4.04Å; A544-L552 HydrophobicContact CB-CD2 4.32Å; G548-L552 PolarHBondContact O-N 2.99Å; L552-S554 VanDerWaalsContact C-N 3.32Å; L552-S554 PolarHBondContact O-N 3Å; L552-L556 HydrophobicContact CD1-CD1 4.15Å; L552-L556 HydrophobicContact CD1-CG 4.49Å; L552-L556 HydrophobicContact CD2-CD1 3.64Å; L552-L556 HydrophobicContact CD2-CG 4.2Å; L552-L556 HydrophobicContact CG-CD1 4.46Å
553	M	56.8	Low	77.8	Confident	92 Å²	92	70.6 Å²	70.6	45%	0.453	37%	0.371	S	S	.	.			trans	-92.6	47.2	-177.8	-68.7	-69.8	-69.6	0	0	112.2	Q523 I524	Q523-M553 HydrophobicContact CG-CG 4.04Å; I524-M553 PolarHBondContact O-N 2.82Å; I524-M553 VanDerWaalsContact O-N 3.1Å
554	S	62.8	Low	77.7	Confident	20 Å²	20	70.1 Å²	70.1	14%	0.14	37%	0.37	C	S	.	.			trans	-145.6	131.2	-166.2	-47.3	0	0	0	0	116.1	D525 L526 H527 L552 L556	D525-S554 WeakPolarHBondContact CA-OG 3.27Å; D525-S554 PolarHBondContact OD1-OG 3.13Å; L526-S554 PolarHBondContact N-OG 3.29Å; H527-S554 PolarHBondContact N-OG 2.92Å; L552-S554 VanDerWaalsContact C-N 3.32Å; L552-S554 PolarHBondContact O-N 3Å; S554-L556 PolarHBondContact O-N 2.94Å
555	D	68.7	Low	77.8	Confident	100 Å²	100	74.1 Å²	74.1	54%	0.535	39%	0.387	S	S	.	.			trans	-72.8	94.7	162.1	-93.5	3.6	0	0	0	110.5	K557	D555-K557 HydrophobicContact CB-CD 4.34Å; D555-K557 PolarHBondContact O-N 2.94Å; D555-K557 VanDerWaalsContact OD2-CE 3.27Å; D555-K557 WeakPolarHBondContact OD2-CE 3.4Å; D555-K557 IonicContact OD2-NZ 3.32Å; D555-K557 PolarHBondContact OD2-NZ 2.9Å
556	L	82.5	Confident	77.7	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	40%	0.399	C	S	.	.			trans	-83.1	70.7	-173.9	-64.3	-169.2	0	0	0	113.7	L526 F540 L552 S554 D568 F569 M570	L526-L556 HydrophobicContact CB-CD2 3.76Å; F540-L556 HydrophobicContact CZ-CD1 4.23Å; L552-L556 HydrophobicContact CD1-CD1 4.15Å; L552-L556 HydrophobicContact CD1-CG 4.49Å; L552-L556 HydrophobicContact CD2-CD1 3.64Å; L552-L556 HydrophobicContact CD2-CG 4.2Å; L552-L556 HydrophobicContact CG-CD1 4.46Å; S554-L556 PolarHBondContact O-N 2.94Å; L556-D568 WeakPolarHBondContact O-CA 3.37Å; L556-F569 HydrophobicContact CB-CD1 4.05Å; L556-F569 HydrophobicContact CB-CE1 3.64Å; L556-F569 HydrophobicContact CB-CE2 4.49Å; L556-F569 HydrophobicContact CB-CZ 3.89Å; L556-F569 HydrophobicContact CD1-CE1 4.21Å; L556-F569 HydrophobicContact CD1-CE2 4.16Å; L556-F569 HydrophobicContact CD1-CZ 3.63Å; L556-F569 HydrophobicContact CG-CE1 4.44Å; L556-F569 HydrophobicContact CG-CZ 4.34Å; L556-F569 WeakPolarHBondContact O-CD1 3.38Å; L556-F569 PolarHBondContact O-N 3.33Å; L556-M570 HydrophobicContact CB-CG 4.31Å; L556-M570 HydrophobicContact CD1-CG 4.2Å; L556-M570 HydrophobicContact CD1-SD 4.14Å
557	K	85.9	Confident	77.7	Confident	94 Å²	94	73.7 Å²	73.7	41%	0.409	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-82.4	133.4	-174.7	-69.1	163.6	-174.6	152.7	0	113.4	D555 K567	D555-K557 HydrophobicContact CB-CD 4.34Å; D555-K557 PolarHBondContact O-N 2.94Å; D555-K557 VanDerWaalsContact OD2-CE 3.27Å; D555-K557 WeakPolarHBondContact OD2-CE 3.4Å; D555-K557 IonicContact OD2-NZ 3.32Å; D555-K557 PolarHBondContact OD2-NZ 2.9Å; K557-K567 CarbonylContact C-O 3.57Å; K557-K567 WeakPolarHBondContact CA-O 3.44Å
558	C	91.1	Very high	78.1	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.014	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	134.3	171.6	-56.1	0	0	0	0	112.1	C533 F564 F565 R566 K567	C533-C558 HydrophobicContact CB-CB 3.88Å; C533-C558 WeakPolarHBondContact CB-SG 3.39Å; C533-C558 VanDerWaalsContact SG-CA 3.54Å; C533-C558 WeakPolarHBondContact SG-CB 3.17Å; C533-C558 CovalentContact SG-SG 2.02Å; C533-C558 PolarHBondContact SG-SG 3.18Å; C558-F564 HydrophobicContact CB-CB 4.01Å; C558-F564 WeakPolarHBondContact CB-O 3.43Å; C558-F565 CarbonylContact O-C 3.59Å; C558-F565 WeakPolarHBondContact O-CA 3.25Å; C558-R566 PolarHBondContact O-N 3.12Å; C558-K567 PolarHBondContact N-O 2.95Å
559	E	91.9	Very high	79.1	Confident	95 Å²	95	71.7 Å²	71.7	44%	0.444	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-34.7	164.4	-173.5	59.9	-159.4	0	0	110.8	P530 W531 F565	P530-E559 HydrophobicContact CB-CB 4Å; P530-E559 HydrophobicContact CB-CG 4.04Å; W531-E559 PolarHBondContact O-N 3.37Å; E559-F565 WeakPolarHBondContact OE2-CE2 3.48Å
560	T	88.3	Confident	80.3	Confident	58 Å²	58	68.6 Å²	68.6	36%	0.356	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	160.7	175.4	59.9	0	0	0	0	111	W531 E532 C533	W531-T560 PolarHBondContact O-N 2.84Å; W531-T560 VanDerWaalsContact O-N 3.16Å; E532-T560 WeakPolarHBondContact CA-OG1 3.49Å; C533-T560 WeakPolarHBondContact CB-O 3.49Å; C533-T560 PolarHBondContact N-O 2.96Å
561	P	90.2	Very high	82	Confident	47 Å²	47	67 Å²	67	31%	0.305	34%	0.336	S	S	.	.	S	Bend	cis	-70.3	164.2	-17.4	32.8	-37.3	0	0	0	112.5	C533 N563 F564 F565	C533-P561 WeakPolarHBondContact O-CD 3.29Å; P561-N563 WeakPolarHBondContact CB-OD1 3.37Å; P561-N563 WeakPolarHBondContact CG-OD1 3.32Å; P561-N563 PolarHBondContact O-N 2.86Å; P561-F564 HydrophobicContact CG-CD2 3.9Å; P561-F564 HydrophobicContact CG-CE2 4.43Å; P561-F564 PolarHBondContact O-N 3.2Å; P561-F565 PolarHBondContact O-N 2.9Å
562	V	87.4	Confident	83.3	Confident	130 Å²	130	66.7 Å²	66.7	79%	0.788	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-56.7	-30.2	-168.9	-174	0	0	0	0	114	F564 F565	V562-F564 PolarHBondContact O-N 2.76Å; V562-F565 WeakPolarHBondContact O-CB 3.3Å; V562-F565 PolarHBondContact O-N 3.13Å
563	N	87.8	Confident	84.1	Confident	96 Å²	96	67.9 Å²	67.9	51%	0.513	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-66.4	-14.8	175.6	55.5	-77.4	0	0	0	114.6	P561 K567	P561-N563 WeakPolarHBondContact CB-OD1 3.37Å; P561-N563 WeakPolarHBondContact CG-OD1 3.32Å; P561-N563 PolarHBondContact O-N 2.86Å; N563-K567 PolarHBondContact O-NZ 3.32Å
564	F	88.9	Confident	85.6	Confident	20 Å²	20	65.3 Å²	65.3	9%	0.088	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-113.6	-3.1	174.1	-58.7	-46.4	0	0	0	113.7	C533 C558 P561 V562 R566 K567 L572 E576	C533-F564 HydrophobicContact CB-CB 4.31Å; C533-F564 HydrophobicContact CB-CD2 4.03Å; C558-F564 HydrophobicContact CB-CB 4.01Å; C558-F564 WeakPolarHBondContact CB-O 3.43Å; P561-F564 HydrophobicContact CG-CD2 3.9Å; P561-F564 HydrophobicContact CG-CE2 4.43Å; P561-F564 PolarHBondContact O-N 3.2Å; V562-F564 PolarHBondContact O-N 2.76Å; F564-R566 PolarHBondContact O-N 2.65Å; F564-K567 HydrophobicContact CD1-CD 4.36Å; F564-K567 VanDerWaalsContact O-CB 3.25Å; F564-K567 WeakPolarHBondContact O-CB 3.34Å; F564-K567 WeakPolarHBondContact O-CG 3.46Å; F564-K567 PolarHBondContact O-N 2.9Å; F564-L572 HydrophobicContact CB-CD1 4.04Å; F564-L572 HydrophobicContact CD1-CD1 3.7Å; F564-L572 HydrophobicContact CD1-CD2 4.11Å; F564-L572 HydrophobicContact CD2-CD1 4.32Å; F564-L572 HydrophobicContact CE1-CD1 4.21Å; F564-L572 HydrophobicContact CE1-CD2 4.3Å; F564-L572 HydrophobicContact CG-CD1 3.78Å; F564-E576 HydrophobicContact CE1-CB 4.46Å; F564-E576 HydrophobicContact CZ-CB 4.11Å; F564-E576 WeakPolarHBondContact CZ-O 3.39Å
565	F	90	Very high	86.6	Confident	87 Å²	87	67.8 Å²	67.8	38%	0.382	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44	128.3	-177.9	179	-110.4	0	0	0	113.5	C558 E559 P561 V562 K567	C558-F565 CarbonylContact O-C 3.59Å; C558-F565 WeakPolarHBondContact O-CA 3.25Å; E559-F565 WeakPolarHBondContact OE2-CE2 3.48Å; P561-F565 PolarHBondContact O-N 2.9Å; V562-F565 WeakPolarHBondContact O-CB 3.3Å; V562-F565 PolarHBondContact O-N 3.13Å; F565-K567 PolarHBondContact O-N 3.25Å; F565-K567 VanDerWaalsContact O-N 3.12Å
566	R	86.6	Confident	87.3	Confident	181 Å²	181	68.4 Å²	68.4	68%	0.683	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	4.3	-176.5	-64.7	-179.4	175.8	-162	-3.6	117.1	C558 F564	C558-R566 PolarHBondContact O-N 3.12Å; F564-R566 PolarHBondContact O-N 2.65Å
567	K	86	Confident	87.5	Confident	104 Å²	104	68.8 Å²	68.8	45%	0.452	35%	0.345	S	S	.	.	S	Bend	trans	-76	140.1	166.4	-58.8	179.2	-173.6	161.9	0	109.2	K557 C558 N563 F564 F565 F569 L572	K557-K567 CarbonylContact C-O 3.57Å; K557-K567 WeakPolarHBondContact CA-O 3.44Å; C558-K567 PolarHBondContact N-O 2.95Å; N563-K567 PolarHBondContact O-NZ 3.32Å; F564-K567 HydrophobicContact CD1-CD 4.36Å; F564-K567 VanDerWaalsContact O-CB 3.25Å; F564-K567 WeakPolarHBondContact O-CB 3.34Å; F564-K567 WeakPolarHBondContact O-CG 3.46Å; F564-K567 PolarHBondContact O-N 2.9Å; F565-K567 PolarHBondContact O-N 3.25Å; F565-K567 VanDerWaalsContact O-N 3.12Å; K567-F569 PolarHBondContact O-N 3.2Å; K567-L572 HydrophobicContact CD-CD2 4.03Å
568	D	87.9	Confident	87.6	Confident	42 Å²	42	64.7 Å²	64.7	23%	0.225	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-64.6	123.7	165.1	174.8	8.8	0	0	0	109.1	L556 M570 L571	L556-D568 WeakPolarHBondContact O-CA 3.37Å; D568-M570 VanDerWaalsContact C-N 3.29Å; D568-M570 PolarHBondContact O-N 3.47Å; D568-M570 VanDerWaalsContact OD1-CB 3.29Å; D568-M570 WeakPolarHBondContact OD1-CB 3.43Å; D568-M570 WeakPolarHBondContact OD1-CG 3.49Å; D568-M570 PolarHBondContact OD1-N 3.43Å; D568-L571 HydrophobicContact CB-CD1 4.2Å; D568-L571 HydrophobicContact CB-CG 4.26Å; D568-L571 PolarHBondContact O-N 3.2Å
569	F	88	Confident	86.9	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-74.8	-19.2	-179.2	71	-112.5	0	0	0	113.3	W531 C533 I537 F540 K541 L556 K567 L571 L572	W531-F569 HydrophobicContact CB-CD1 4.21Å; W531-F569 HydrophobicContact CB-CE1 4.02Å; W531-F569 AromaticContact CD1-CE1 3.96Å; W531-F569 HydrophobicContact CD2-CE1 4.05Å; W531-F569 HydrophobicContact CG-CD1 4.32Å; W531-F569 AromaticContact CG-CE1 3.72Å; W531-F569 HydrophobicContact CG-CE1 3.72Å; C533-F569 VanDerWaalsContact SG-CB 3.5Å; I537-F569 HydrophobicContact CD1-CD1 3.7Å; I537-F569 HydrophobicContact CD1-CD2 4.46Å; I537-F569 HydrophobicContact CD1-CE1 3.43Å; I537-F569 VanDerWaalsContact CD1-CE1 3.43Å; I537-F569 HydrophobicContact CD1-CE2 4.25Å; I537-F569 HydrophobicContact CD1-CG 4.22Å; I537-F569 HydrophobicContact CD1-CZ 3.74Å; I537-F569 HydrophobicContact CG1-CE1 4.37Å; I537-F569 HydrophobicContact CG1-CE2 4.44Å; I537-F569 HydrophobicContact CG1-CZ 4.19Å; F540-F569 HydrophobicContact CD1-CZ 4.02Å; F540-F569 HydrophobicContact CE1-CE1 4.25Å; F540-F569 HydrophobicContact CE1-CE2 4.47Å; F540-F569 AromaticContact CE1-CZ 3.53Å; F540-F569 HydrophobicContact CE1-CZ 3.53Å; F540-F569 HydrophobicContact CZ-CZ 4.12Å; K541-F569 HydrophobicContact CB-CD2 4.15Å; K541-F569 HydrophobicContact CB-CE2 3.97Å; K541-F569 HydrophobicContact CD-CD2 4.09Å; K541-F569 WeakPolarHBondContact CE-O 3.45Å; K541-F569 HydrophobicContact CG-CD2 4.08Å; K541-F569 HydrophobicContact CG-CE2 4.24Å; L556-F569 HydrophobicContact CB-CD1 4.05Å; L556-F569 HydrophobicContact CB-CE1 3.64Å; L556-F569 HydrophobicContact CB-CE2 4.49Å; L556-F569 HydrophobicContact CB-CZ 3.89Å; L556-F569 HydrophobicContact CD1-CE1 4.21Å; L556-F569 HydrophobicContact CD1-CE2 4.16Å; L556-F569 HydrophobicContact CD1-CZ 3.63Å; L556-F569 HydrophobicContact CG-CE1 4.44Å; L556-F569 HydrophobicContact CG-CZ 4.34Å; L556-F569 WeakPolarHBondContact O-CD1 3.38Å; L556-F569 PolarHBondContact O-N 3.33Å; K567-F569 PolarHBondContact O-N 3.2Å; F569-L571 PolarHBondContact O-N 3.14Å; F569-L572 HydrophobicContact CB-CD1 4.36Å; F569-L572 PolarHBondContact O-N 2.93Å
570	M	86.3	Confident	85.9	Confident	45 Å²	45	70.8 Å²	70.8	22%	0.222	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-62.3	-30.2	174.6	-60.5	-60.9	-69.5	0	0	111.3	K541 A544 E545 L556 D568	K541-M570 HydrophobicContact CG-SD 4.14Å; A544-M570 HydrophobicContact CB-CE 3.73Å; A544-M570 HydrophobicContact CB-SD 3.94Å; E545-M570 HydrophobicContact CG-CE 3.82Å; L556-M570 HydrophobicContact CB-CG 4.31Å; L556-M570 HydrophobicContact CD1-CG 4.2Å; L556-M570 HydrophobicContact CD1-SD 4.14Å; D568-M570 VanDerWaalsContact C-N 3.29Å; D568-M570 PolarHBondContact O-N 3.47Å; D568-M570 VanDerWaalsContact OD1-CB 3.29Å; D568-M570 WeakPolarHBondContact OD1-CB 3.43Å; D568-M570 WeakPolarHBondContact OD1-CG 3.49Å; D568-M570 PolarHBondContact OD1-N 3.43Å
571	L	85.8	Confident	84.5	Confident	147 Å²	147	72.3 Å²	72.3	77%	0.77	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-84.9	-11.2	177.9	-58	179.5	0	0	0	114.5	D568 F569	D568-L571 HydrophobicContact CB-CD1 4.2Å; D568-L571 HydrophobicContact CB-CG 4.26Å; D568-L571 PolarHBondContact O-N 3.2Å; F569-L571 PolarHBondContact O-N 3.14Å
572	L	87.4	Confident	82.7	Confident	18 Å²	18	76.3 Å²	76.3	9%	0.094	38%	0.379	C	S	.	.	S	Bend	trans	-83.4	148.1	179.7	-65.7	177.3	0	0	0	111.5	K541 F564 K567 F569 I577	K541-L572 WeakPolarHBondContact CE-O 3.42Å; K541-L572 PolarHBondContact NZ-O 2.6Å; F564-L572 HydrophobicContact CB-CD1 4.04Å; F564-L572 HydrophobicContact CD1-CD1 3.7Å; F564-L572 HydrophobicContact CD1-CD2 4.11Å; F564-L572 HydrophobicContact CD2-CD1 4.32Å; F564-L572 HydrophobicContact CE1-CD1 4.21Å; F564-L572 HydrophobicContact CE1-CD2 4.3Å; F564-L572 HydrophobicContact CG-CD1 3.78Å; K567-L572 HydrophobicContact CD-CD2 4.03Å; F569-L572 HydrophobicContact CB-CD1 4.36Å; F569-L572 PolarHBondContact O-N 2.93Å; L572-I577 HydrophobicContact CB-CD1 3.89Å; L572-I577 HydrophobicContact CB-CG1 4.04Å; L572-I577 HydrophobicContact CD1-CD1 4.49Å; L572-I577 HydrophobicContact CD1-CG1 4.27Å
573	S	86.5	Confident	81	Confident	48 Å²	48	73.2 Å²	73.2	34%	0.336	37%	0.366	S	S	.	.			trans	-71.2	143.1	172.7	-177	0	0	0	0	111.2	D575 E576 I577	S573-D575 PolarHBondContact O-N 3.25Å; S573-D575 VanDerWaalsContact O-N 3.17Å; S573-D575 PolarHBondContact OG-N 3.29Å; S573-E576 WeakPolarHBondContact CB-OE2 3.44Å; S573-E576 PolarHBondContact N-OE2 3.24Å; S573-E576 PolarHBondContact O-N 3.1Å; S573-E576 VanDerWaalsContact O-N 3.11Å; S573-I577 PolarHBondContact O-N 2.93Å; S573-I577 VanDerWaalsContact O-N 3.1Å
574	N	86.6	Confident	79.2	Confident	37 Å²	37	79.3 Å²	79.3	20%	0.198	38%	0.382	C	S	.	.	H	α-helix	trans	-59.4	-26.8	173	-63.2	-19.1	0	0	0	111.5	K541 C578	K541-N574 WeakPolarHBondContact CD-OD1 3.38Å; K541-N574 PolarHBondContact NZ-OD1 2.96Å; N574-C578 PolarHBondContact O-N 3.49Å
575	D	83.9	Confident	77.2	Confident	73 Å²	73	84.1 Å²	84.1	39%	0.39	41%	0.407	S	S	.	.	H	α-helix	trans	-74.7	-33.1	179.5	-51.9	-10.9	0	0	0	111.9	S573 C578 P579 Y582	S573-D575 PolarHBondContact O-N 3.25Å; S573-D575 VanDerWaalsContact O-N 3.17Å; S573-D575 PolarHBondContact OG-N 3.29Å; D575-C578 CarbonylContact O-C 3.58Å; D575-P579 WeakPolarHBondContact O-CA 3.49Å; D575-P579 WeakPolarHBondContact O-CD 3.22Å; D575-Y582 WeakPolarHBondContact OD1-CE2 3.3Å
576	E	84.4	Confident	74.4	Confident	112 Å²	112	84.5 Å²	84.5	52%	0.523	42%	0.421	S	S	.	.	H	α-helix	trans	-76	-41.4	176.3	-66	174.1	116.9	0	0	111	F564 S573	F564-E576 HydrophobicContact CE1-CB 4.46Å; F564-E576 HydrophobicContact CZ-CB 4.11Å; F564-E576 WeakPolarHBondContact CZ-O 3.39Å; S573-E576 WeakPolarHBondContact CB-OE2 3.44Å; S573-E576 PolarHBondContact N-OE2 3.24Å; S573-E576 PolarHBondContact O-N 3.1Å; S573-E576 VanDerWaalsContact O-N 3.11Å
577	I	86.6	Confident	72.5	Confident	9 Å²	9	81.6 Å²	81.6	5%	0.046	43%	0.426	C	S	.	.	H	α-helix	trans	-66.7	-39.3	175.2	-66.6	171.9	0	0	0	111	S534 I537 V538 K541 L572 S573	S534-I577 WeakPolarHBondContact O-CG2 3.45Å; I537-I577 HydrophobicContact CG2-CD1 4.5Å; I537-I577 HydrophobicContact CG2-CG2 4.01Å; V538-I577 HydrophobicContact CG2-CB 4.4Å; V538-I577 HydrophobicContact CG2-CG2 3.67Å; K541-I577 HydrophobicContact CD-CD1 3.85Å; L572-I577 HydrophobicContact CB-CD1 3.89Å; L572-I577 HydrophobicContact CB-CG1 4.04Å; L572-I577 HydrophobicContact CD1-CD1 4.49Å; L572-I577 HydrophobicContact CD1-CG1 4.27Å; S573-I577 PolarHBondContact O-N 2.93Å; S573-I577 VanDerWaalsContact O-N 3.1Å
578	C	87.7	Confident	70	Confident	8 Å²	8	82.9 Å²	82.9	5%	0.054	44%	0.442	C	S	.	.			trans	-141.3	72.2	-172.4	-168	0	0	0	0	113.9	C535 V538 N574 D575 Q580 L581	C535-C578 HydrophobicContact CB-CB 3.9Å; C535-C578 WeakPolarHBondContact CB-SG 3.29Å; C535-C578 WeakPolarHBondContact SG-CA 3.16Å; C535-C578 WeakPolarHBondContact SG-CB 3.43Å; C535-C578 CovalentContact SG-SG 2.04Å; C535-C578 PolarHBondContact SG-SG 2.87Å; V538-C578 HydrophobicContact CG2-CB 3.88Å; N574-C578 PolarHBondContact O-N 3.49Å; D575-C578 CarbonylContact O-C 3.58Å; C578-Q580 PolarHBondContact O-N 3.37Å; C578-L581 HydrophobicContact CB-CD1 3.95Å; C578-L581 HydrophobicContact CB-CG 4.37Å; C578-L581 PolarHBondContact O-N 3.09Å; C578-L581 VanDerWaalsContact O-N 3.09Å
579	P	77.1	Confident	67.5	Low	82 Å²	82	88.2 Å²	88.2	53%	0.532	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-60.9	-17.5	179.7	23.2	-34.5	0	0	0	114.1	D575 L581 Y582 A583	D575-P579 WeakPolarHBondContact O-CA 3.49Å; D575-P579 WeakPolarHBondContact O-CD 3.22Å; P579-L581 PolarHBondContact O-N 3.4Å; P579-Y582 PolarHBondContact O-N 3.38Å; P579-A583 PolarHBondContact O-N 2.99Å
580	Q	69.6	Low	64.7	Low	142 Å²	142	95.2 Å²	95.2	66%	0.664	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-67.3	-19.6	176.4	-64.1	-65	-17.8	0	0	113.8	C578	C578-Q580 PolarHBondContact O-N 3.37Å
581	L	59.9	Low	62.2	Low	91 Å²	91	97.6 Å²	97.6	48%	0.476	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-65.3	-40.2	175	-77.5	166	0	0	0	111.8	V538 C578 P579	V538-L581 HydrophobicContact CG1-CD1 4.44Å; C578-L581 HydrophobicContact CB-CD1 3.95Å; C578-L581 HydrophobicContact CB-CG 4.37Å; C578-L581 PolarHBondContact O-N 3.09Å; C578-L581 VanDerWaalsContact O-N 3.09Å; P579-L581 PolarHBondContact O-N 3.4Å
582	Y	52.7	Low	59.6	Low	131 Å²	131	99.6 Å²	99.6	51%	0.514	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-18.7	-176.3	-73.8	-96.8	0	0	0	113.6	D575 P579 R584 I585	D575-Y582 WeakPolarHBondContact OD1-CE2 3.3Å; P579-Y582 PolarHBondContact O-N 3.38Å; Y582-R584 PolarHBondContact O-N 3.48Å; Y582-I585 HydrophobicContact CD1-CD1 4.1Å; Y582-I585 HydrophobicContact CE1-CD1 4.46Å; Y582-I585 PolarHBondContact O-N 3.42Å
583	A	52	Low	57	Low	64 Å²	64	103.4 Å²	103.4	53%	0.529	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.3	-15	175.5	0	0	0	0	0	114.8	P579	P579-A583 PolarHBondContact O-N 2.99Å
584	R	48.4	Very low	54.3	Low	224 Å²	224	111 Å²	111	85%	0.845	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-4.5	173.4	-70.2	-169.5	179.6	170	6.8	115.1	Y582	Y582-R584 PolarHBondContact O-N 3.48Å
585	I	48.1	Very low	51.6	Low	121 Å²	121	116.8 Å²	116.8	62%	0.621	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-10.6	-172.2	-57	179.7	0	0	0	112.1	Y582 P587	Y582-I585 HydrophobicContact CD1-CD1 4.1Å; Y582-I585 HydrophobicContact CE1-CD1 4.46Å; Y582-I585 PolarHBondContact O-N 3.42Å; I585-P587 WeakPolarHBondContact O-CD 3.27Å
586	S	32	Very low	49	Very low	95 Å²	95	118.9 Å²	118.9	66%	0.664	65%	0.646	S	S	*	*			trans	-102.6	101.4	177.3	-58.3	0	0	0	0	112.9
587	P	45.8	Very low	46.5	Very low	121 Å²	121	120.4 Å²	120.4	79%	0.786	66%	0.663	S	S	*	*			trans	-83.6	118.5	168.2	32.2	-31.8	0	0	0	110.2	I585	I585-P587 WeakPolarHBondContact O-CD 3.27Å
588	T	33.8	Very low	43.8	Very low	131 Å²	131	123.7 Å²	123.7	80%	0.804	70%	0.699	S	S	*	*			trans	-149.5	132.9	169.1	-25.5	0	0	0	0	111.7
589	L	34.8	Very low	41	Very low	154 Å²	154	131.8 Å²	131.8	81%	0.806	74%	0.741	S	S	*	*			trans	-82.8	142	175.8	-63.5	72.2	0	0	0	109.2
590	T	29.7	Very low	38.7	Very low	147 Å²	147	132.1 Å²	132.1	90%	0.902	75%	0.75	S	S	*	*				-177.9	168.5	112.1	25.8	0	0	0	0	111.5
591	S	32.7	Very low	36.7	Very low	95 Å²	95	134.8 Å²	134.8	66%	0.664	76%	0.763	S	S	*	*			trans	-87.6	156.3	-175.2	52.3	0	0	0	0	113.1
592	H	32.3	Very low	35.2	Very low	189 Å²	189	137.2 Å²	137.2	88%	0.875	78%	0.781	S	S	*	*				-156.1	154.1	116.4	-105.3	-62.4	0	0	0	111.8
593	S	32.3	Very low	34	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	79%	0.791	S	S	*	*			trans	-99.3	153.3	-179.9	53.6	0	0	0	0	112.1
594	K	30.9	Very low	32.7	Very low	206 Å²	206	137.2 Å²	137.2	90%	0.896	80%	0.802	S	S	*	*			trans	-164.2	151.5	133.5	-108.2	158.8	-173.1	176.4	0	111.6
595	N	29.2	Very low	31.9	Very low	159 Å²	159	134.9 Å²	134.9	85%	0.85	80%	0.801	S	S	*	*			trans	-87.6	145.9	-176.3	-53.2	-19.4	0	0	0	110.6
596	S	30	Very low	30.9	Very low	118 Å²	118	134.9 Å²	134.9	83%	0.825	81%	0.811	S	S	*	*			trans	-150.7	144.2	133.2	58.7	0	0	0	0	111
597	T	32.1	Very low	30.7	Very low	144 Å²	144	137.5 Å²	137.5	88%	0.883	82%	0.818	S	S	*	*			trans	-63	136.7	-175.6	44.7	0	0	0	0	113.9
598	G	28.8	Very low	30	Very low	77 Å²	77	137 Å²	137	79%	0.794	82%	0.817	S	S	*	*			trans	-120.6	127.4	157.2	0	0	0	0	0	109.7
599	L	28.9	Very low	30.1	Very low	179 Å²	179	141.4 Å²	141.4	94%	0.937	82%	0.821	S	S	*	*			trans	-81.2	157.2	171	-130.2	75.4	0	0	0	109.8
600	A	30	Very low	30.3	Very low	89 Å²	89	142.5 Å²	142.5	74%	0.736	83%	0.827	S	S	*	*			trans	-91	132.1	178.9	0	0	0	0	0	111.9
601	E	27.1	Very low	30.4	Very low	198 Å²	198	140.4 Å²	140.4	93%	0.925	81%	0.81	S	S	*	*			trans	-128.7	161.2	152.7	-73	-161	144.5	0	0	109.1
602	T	27.9	Very low	30.9	Very low	141 Å²	141	143.1 Å²	143.1	87%	0.865	82%	0.823	S	S	*	*			trans	-130.4	135.6	-153.6	47.9	0	0	0	0	115.3
603	G	26.6	Very low	31.6	Very low	70 Å²	70	139 Å²	139	72%	0.722	82%	0.815	S	S	*	*			trans	100.6	153.1	166.5	0	0	0	0	0	114.7
604	T	26.6	Very low	32.1	Very low	125 Å²	125	143.6 Å²	143.6	77%	0.767	82%	0.818	S	S	*	*			cis	-159.2	153.8	-10.1	-17.6	0	0	0	0	110.5
605	H	31.5	Very low	33.1	Very low	176 Å²	176	138.7 Å²	138.7	82%	0.815	81%	0.805	S	S	*	*			trans	54.1	97.5	165.9	-67.7	-73.7	0	0	0	118.9
606	S	27	Very low	34	Very low	120 Å²	120	134.7 Å²	134.7	84%	0.839	79%	0.789	S	S	*	*			trans	-116.6	136.8	143.6	54.8	0	0	0	0	109
607	N	27.9	Very low	35.3	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	78%	0.782	S	S	*	*			trans	-80	126.3	-173.7	-76.9	-28.3	0	0	0	111.8	Y609	N607-Y609 PolarHBondContact O-N 3.45Å
608	S	31	Very low	36.5	Very low	110 Å²	110	133 Å²	133	77%	0.769	77%	0.771	S	S	*	*			trans	-87.9	94.8	178.9	57.8	0	0	0	0	112.2
609	Y	35.3	Very low	38.2	Very low	224 Å²	224	133.7 Å²	133.7	88%	0.878	76%	0.76	S	S	*	*			trans	-137.8	63.3	167.9	-87.9	-71.8	0	0	0	111.9	N607	N607-Y609 PolarHBondContact O-N 3.45Å
610	L	39.7	Very low	39.9	Very low	177 Å²	177	129.6 Å²	129.6	93%	0.927	74%	0.738	S	S	*	*			trans	-155.2	58.6	170.7	-115.7	178	0	0	0	113.5
611	D	30.5	Very low	42	Very low	103 Å²	103	129.3 Å²	129.3	55%	0.551	73%	0.727	S	S	*	*			trans	-152.3	109.2	148.5	-170.9	-4.2	0	0	0	110.4	S613	D611-S613 PolarHBondContact OD1-N 2.9Å; D611-S613 PolarHBondContact OD1-OG 3.38Å
612	T	42.7	Very low	44.3	Very low	151 Å²	151	123.3 Å²	123.3	93%	0.926	71%	0.706	S	S	*	*			trans	-130.9	49.5	170.1	55.1	0	0	0	0	110.8
613	S	47.4	Very low	46.6	Very low	104 Å²	104	118.4 Å²	118.4	73%	0.727	68%	0.683	S	S	*	*			trans	-133.7	19.6	175.6	67.2	0	0	0	0	115.2	D611	D611-S613 PolarHBondContact OD1-N 2.9Å; D611-S613 PolarHBondContact OD1-OG 3.38Å
614	R	44	Very low	49.1	Very low	194 Å²	194	120.3 Å²	120.3	73%	0.732	68%	0.676	S	S	*	*			trans	-128.5	79.3	175.7	-67.8	-169.4	176.6	-152.8	0.5	113.1	S616	R614-S616 PolarHBondContact O-N 2.94Å
615	V	51.3	Low	51.8	Low	103 Å²	103	119.5 Å²	119.5	62%	0.624	67%	0.667	S	S	*	*			trans	-71.9	115.2	161.8	178.6	0	0	0	0	108.3	V619 L620	V615-V619 HydrophobicContact CG1-CB 4.08Å; V615-V619 HydrophobicContact CG1-CG1 4.32Å; V615-L620 HydrophobicContact CG1-CD1 4.32Å
616	S	47.8	Very low	54.4	Low	74 Å²	74	116.7 Å²	116.7	52%	0.517	66%	0.657	S	S	.	*			trans	-58.7	141.8	178.2	-63	0	0	0	0	112.1	R614 S618 V619 L620	R614-S616 PolarHBondContact O-N 2.94Å; S616-S618 WeakPolarHBondContact CB-OG 3.38Å; S616-S618 PolarHBondContact O-N 2.89Å; S616-S618 VanDerWaalsContact O-N 3.08Å; S616-V619 PolarHBondContact O-N 3.35Å; S616-L620 PolarHBondContact O-N 3.22Å
617	I	56.7	Low	57	Low	132 Å²	132	115.3 Å²	115.3	68%	0.677	64%	0.643	S	S	*	*	H	α-helix	trans	-56.1	-30	179.8	-63.4	172.2	0	0	0	111.8	V619 L620 V621	I617-V619 PolarHBondContact O-N 2.94Å; I617-L620 PolarHBondContact O-N 2.98Å; I617-V621 HydrophobicContact CG2-CG2 3.93Å; I617-V621 WeakPolarHBondContact O-CG2 3.47Å; I617-V621 PolarHBondContact O-N 2.96Å; I617-V621 VanDerWaalsContact O-N 3.14Å
618	S	57.9	Low	59.8	Low	95 Å²	95	115.4 Å²	115.4	66%	0.664	64%	0.637	S	S	*	*	H	α-helix	trans	-59.8	-19.5	172.8	50.7	0	0	0	0	115.2	S616 P622	S616-S618 WeakPolarHBondContact CB-OG 3.38Å; S616-S618 PolarHBondContact O-N 2.89Å; S616-S618 VanDerWaalsContact O-N 3.08Å; S618-P622 VanDerWaalsContact O-CD 3.29Å; S618-P622 WeakPolarHBondContact O-CD 3.33Å; S618-P622 WeakPolarHBondContact O-CG 3.47Å
619	V	63.5	Low	62.5	Low	91 Å²	91	113 Å²	113	55%	0.552	62%	0.617	S	S	*	*	H	α-helix	trans	-102.3	-37.8	175.2	-175.9	0	0	0	0	110.9	V615 S616 I617 V621 P622 G623	V615-V619 HydrophobicContact CG1-CB 4.08Å; V615-V619 HydrophobicContact CG1-CG1 4.32Å; S616-V619 PolarHBondContact O-N 3.35Å; I617-V619 PolarHBondContact O-N 2.94Å; V619-V621 PolarHBondContact O-N 2.59Å; V619-P622 WeakPolarHBondContact O-CD 3.11Å; V619-P622 WeakPolarHBondContact O-CG 3.42Å; V619-G623 PolarHBondContact O-N 3.17Å; V619-G623 VanDerWaalsContact O-N 3.09Å
620	L	64.9	Low	64.7	Low	93 Å²	93	105.7 Å²	105.7	49%	0.487	60%	0.596	S	S	.	*	H	α-helix	trans	-62.9	-44.1	-177.9	-156.8	85.6	0	0	0	112.4	V615 S616 I617 G623 L624	V615-L620 HydrophobicContact CG1-CD1 4.32Å; S616-L620 PolarHBondContact O-N 3.22Å; I617-L620 PolarHBondContact O-N 2.98Å; L620-G623 PolarHBondContact O-N 3.26Å; L620-L624 HydrophobicContact CD2-CD1 4.23Å; L620-L624 HydrophobicContact CG-CD1 4.16Å; L620-L624 WeakPolarHBondContact O-CB 3.48Å; L620-L624 WeakPolarHBondContact O-CG 3.4Å; L620-L624 PolarHBondContact O-N 3.16Å
621	V	74.6	Confident	66.9	Low	83 Å²	83	99.8 Å²	99.8	50%	0.503	57%	0.569	S	S	.	*	H	α-helix	trans	-62.9	-54.7	-179	175.2	0	0	0	0	112.6	I617 V619 G623 L624 L625	I617-V621 HydrophobicContact CG2-CG2 3.93Å; I617-V621 WeakPolarHBondContact O-CG2 3.47Å; I617-V621 PolarHBondContact O-N 2.96Å; I617-V621 VanDerWaalsContact O-N 3.14Å; V619-V621 PolarHBondContact O-N 2.59Å; V621-G623 VanDerWaalsContact C-N 3.28Å; V621-G623 PolarHBondContact O-N 3.42Å; V621-L624 PolarHBondContact O-N 3.47Å; V621-L625 WeakPolarHBondContact O-CB 3.41Å; V621-L625 PolarHBondContact O-N 3.07Å
622	P	74.8	Confident	69.6	Low	73 Å²	73	97.1 Å²	97.1	47%	0.474	56%	0.562	S	S	.	*	H	α-helix	trans	-65.3	-29.9	176.6	24.5	-33.3	0	0	0	113	S618 V619 L625 L626	S618-P622 VanDerWaalsContact O-CD 3.29Å; S618-P622 WeakPolarHBondContact O-CD 3.33Å; S618-P622 WeakPolarHBondContact O-CG 3.47Å; V619-P622 WeakPolarHBondContact O-CD 3.11Å; V619-P622 WeakPolarHBondContact O-CG 3.42Å; P622-L625 PolarHBondContact O-N 3.5Å; P622-L626 WeakPolarHBondContact O-CB 3.47Å; P622-L626 PolarHBondContact O-N 3.47Å
623	G	76.8	Confident	71.7	Confident	37 Å²	37	97.2 Å²	97.2	38%	0.381	55%	0.549	S	S	.	.	H	α-helix	trans	-62	-51.2	173.1	0	0	0	0	0	112.6	V619 L620 V621 L625 L626 V627	V619-G623 PolarHBondContact O-N 3.17Å; V619-G623 VanDerWaalsContact O-N 3.09Å; L620-G623 PolarHBondContact O-N 3.26Å; V621-G623 VanDerWaalsContact C-N 3.28Å; V621-G623 PolarHBondContact O-N 3.42Å; G623-L625 VanDerWaalsContact C-N 3.31Å; G623-L625 PolarHBondContact O-N 3.09Å; G623-L626 PolarHBondContact O-N 2.92Å; G623-V627 WeakPolarHBondContact O-CG2 3.3Å; G623-V627 PolarHBondContact O-N 2.86Å
624	L	79.4	Confident	73.5	Confident	111 Å²	111	96.7 Å²	96.7	58%	0.581	54%	0.542	S	S	*	.	H	α-helix	trans	-62.1	-37.9	175.8	-72.4	168.7	0	0	0	112.2	L620 V621 L626 V627 F628	L620-L624 HydrophobicContact CD2-CD1 4.23Å; L620-L624 HydrophobicContact CG-CD1 4.16Å; L620-L624 WeakPolarHBondContact O-CB 3.48Å; L620-L624 WeakPolarHBondContact O-CG 3.4Å; L620-L624 PolarHBondContact O-N 3.16Å; V621-L624 PolarHBondContact O-N 3.47Å; L624-L626 VanDerWaalsContact C-N 3.34Å; L624-V627 PolarHBondContact O-N 2.82Å; L624-F628 WeakPolarHBondContact O-CB 3.25Å; L624-F628 PolarHBondContact O-N 2.85Å
625	L	83.6	Confident	75.6	Confident	108 Å²	108	91.9 Å²	91.9	57%	0.565	53%	0.534	S	S	*	.	H	α-helix	trans	-65.2	-38.4	176.8	-153.4	157.2	0	0	0	111.1	V621 P622 G623 F628 V629	V621-L625 WeakPolarHBondContact O-CB 3.41Å; V621-L625 PolarHBondContact O-N 3.07Å; P622-L625 PolarHBondContact O-N 3.5Å; G623-L625 VanDerWaalsContact C-N 3.31Å; G623-L625 PolarHBondContact O-N 3.09Å; L625-F628 PolarHBondContact O-N 2.87Å; L625-V629 HydrophobicContact CD2-CG2 3.92Å; L625-V629 WeakPolarHBondContact O-CB 3.47Å; L625-V629 VanDerWaalsContact O-CG2 3.3Å; L625-V629 WeakPolarHBondContact O-CG2 3.45Å; L625-V629 PolarHBondContact O-N 3.44Å
626	L	84.9	Confident	77.3	Confident	116 Å²	116	91 Å²	91	61%	0.607	53%	0.529	S	S	*	.	H	α-helix	trans	-69.9	-36.2	175.3	-166.7	143.6	0	0	0	112.6	P622 G623 L624 T630	P622-L626 WeakPolarHBondContact O-CB 3.47Å; P622-L626 PolarHBondContact O-N 3.47Å; G623-L626 PolarHBondContact O-N 2.92Å; L624-L626 VanDerWaalsContact C-N 3.34Å; L626-T630 HydrophobicContact CD2-CG2 4.28Å; L626-T630 WeakPolarHBondContact O-CB 3.37Å; L626-T630 WeakPolarHBondContact O-CG2 3.36Å; L626-T630 PolarHBondContact O-N 3Å; L626-T630 PolarHBondContact O-OG1 3.38Å
627	V	83.3	Confident	79.1	Confident	91 Å²	91	89.4 Å²	89.4	55%	0.552	52%	0.524	S	S	*	.	H	α-helix	trans	-64	-41.6	170.4	172.7	0	0	0	0	111.3	G623 L624 T630 S631	G623-V627 WeakPolarHBondContact O-CG2 3.3Å; G623-V627 PolarHBondContact O-N 2.86Å; L624-V627 PolarHBondContact O-N 2.82Å; V627-T630 WeakPolarHBondContact CA-OG1 3.46Å; V627-T630 PolarHBondContact O-OG1 3.21Å; V627-T630 VanDerWaalsContact O-OG1 3.06Å; V627-S631 WeakPolarHBondContact O-CB 3.3Å; V627-S631 PolarHBondContact O-N 3.23Å; V627-S631 PolarHBondContact O-OG 2.98Å
628	F	86.4	Confident	80.3	Confident	153 Å²	153	89.1 Å²	89.1	67%	0.671	52%	0.521	S	S	*	.	H	α-helix	trans	-68.3	-40.2	177.6	-167.9	-93.4	0	0	0	112.7	L624 L625 S631 A632	L624-F628 WeakPolarHBondContact O-CB 3.25Å; L624-F628 PolarHBondContact O-N 2.85Å; L625-F628 PolarHBondContact O-N 2.87Å; F628-S631 PolarHBondContact O-OG 3.49Å; F628-A632 WeakPolarHBondContact O-CB 3.4Å; F628-A632 PolarHBondContact O-N 2.88Å
629	V	86.9	Confident	81.5	Confident	60 Å²	60	89.3 Å²	89.3	36%	0.364	51%	0.514	S	S	.	.	H	α-helix	trans	-67.4	-41.7	176.1	167.2	0	0	0	0	111.2	L625 A632 F633	L625-V629 HydrophobicContact CD2-CG2 3.92Å; L625-V629 WeakPolarHBondContact O-CB 3.47Å; L625-V629 VanDerWaalsContact O-CG2 3.3Å; L625-V629 WeakPolarHBondContact O-CG2 3.45Å; L625-V629 PolarHBondContact O-N 3.44Å; V629-A632 PolarHBondContact O-N 3.07Å; V629-F633 HydrophobicContact CG1-CD2 3.74Å; V629-F633 HydrophobicContact CG1-CE2 3.55Å; V629-F633 WeakPolarHBondContact O-CD2 3.37Å; V629-F633 PolarHBondContact O-N 3.1Å
630	T	81.4	Confident	82.4	Confident	70 Å²	70	89.1 Å²	89.1	43%	0.429	51%	0.513	S	S	.	.	H	α-helix	trans	-67.6	-39.6	177.1	47.8	0	0	0	0	112.3	L626 V627 F633 T634	L626-T630 HydrophobicContact CD2-CG2 4.28Å; L626-T630 WeakPolarHBondContact O-CB 3.37Å; L626-T630 WeakPolarHBondContact O-CG2 3.36Å; L626-T630 PolarHBondContact O-N 3Å; L626-T630 PolarHBondContact O-OG1 3.38Å; V627-T630 WeakPolarHBondContact CA-OG1 3.46Å; V627-T630 PolarHBondContact O-OG1 3.21Å; V627-T630 VanDerWaalsContact O-OG1 3.06Å; T630-F633 PolarHBondContact O-N 3.03Å; T630-T634 WeakPolarHBondContact O-CG2 3.48Å; T630-T634 PolarHBondContact O-N 2.95Å
631	S	85.9	Confident	83.1	Confident	53 Å²	53	90.4 Å²	90.4	37%	0.371	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-38.6	174.6	71.6	0	0	0	0	112.6	V627 F628 F633 T634 V635	V627-S631 WeakPolarHBondContact O-CB 3.3Å; V627-S631 PolarHBondContact O-N 3.23Å; V627-S631 PolarHBondContact O-OG 2.98Å; F628-S631 PolarHBondContact O-OG 3.49Å; S631-F633 VanDerWaalsContact C-N 3.34Å; S631-F633 PolarHBondContact O-N 3.12Å; S631-T634 PolarHBondContact O-N 3.29Å; S631-T634 PolarHBondContact O-OG1 2.97Å; S631-V635 WeakPolarHBondContact O-CG2 3.29Å; S631-V635 PolarHBondContact O-N 2.67Å
632	A	87.9	Confident	83.4	Confident	47 Å²	47	90.9 Å²	90.9	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-59.6	-43.4	171.7	0	0	0	0	0	111.9	F628 V629 V635 V636	F628-A632 WeakPolarHBondContact O-CB 3.4Å; F628-A632 PolarHBondContact O-N 2.88Å; V629-A632 PolarHBondContact O-N 3.07Å; A632-V635 PolarHBondContact O-N 3.05Å; A632-V636 WeakPolarHBondContact O-CG2 3.29Å; A632-V636 PolarHBondContact O-N 3Å
633	F	85.7	Confident	83.4	Confident	153 Å²	153	92 Å²	92	67%	0.671	52%	0.516	S	S	*	.	H	α-helix	trans	-68.3	-35	176.4	-78.9	-58.1	0	0	0	113.7	V629 T630 S631 G637	V629-F633 HydrophobicContact CG1-CD2 3.74Å; V629-F633 HydrophobicContact CG1-CE2 3.55Å; V629-F633 WeakPolarHBondContact O-CD2 3.37Å; V629-F633 PolarHBondContact O-N 3.1Å; T630-F633 PolarHBondContact O-N 3.03Å; S631-F633 VanDerWaalsContact C-N 3.34Å; S631-F633 PolarHBondContact O-N 3.12Å; F633-G637 PolarHBondContact O-N 2.72Å
634	T	85.1	Confident	83.3	Confident	93 Å²	93	98.4 Å²	98.4	57%	0.571	53%	0.528	S	S	*	.	H	α-helix	trans	-70.1	-37	174.7	61.8	0	0	0	0	112.2	T630 S631 G637 M638	T630-T634 WeakPolarHBondContact O-CG2 3.48Å; T630-T634 PolarHBondContact O-N 2.95Å; S631-T634 PolarHBondContact O-N 3.29Å; S631-T634 PolarHBondContact O-OG1 2.97Å; T634-G637 PolarHBondContact O-N 3.2Å; T634-M638 WeakPolarHBondContact O-CB 2.98Å; T634-M638 WeakPolarHBondContact O-CG 2.82Å; T634-M638 PolarHBondContact O-N 3.32Å
635	V	88.2	Confident	82.5	Confident	94 Å²	94	96.1 Å²	96.1	57%	0.57	52%	0.516	S	S	*	.	H	α-helix	trans	-63.2	-47.1	173	171.5	0	0	0	0	111.1	S631 A632 G637 M638 L639	S631-V635 WeakPolarHBondContact O-CG2 3.29Å; S631-V635 PolarHBondContact O-N 2.67Å; A632-V635 PolarHBondContact O-N 3.05Å; V635-G637 VanDerWaalsContact C-N 3.32Å; V635-G637 PolarHBondContact O-N 3.08Å; V635-M638 PolarHBondContact O-N 3.12Å; V635-L639 WeakPolarHBondContact O-CB 3.39Å; V635-L639 PolarHBondContact O-N 3.31Å
636	V	86.9	Confident	81.8	Confident	85 Å²	85	99.7 Å²	99.7	52%	0.515	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-40	174.9	172.4	0	0	0	0	111.2	A632 L639 V640	A632-V636 WeakPolarHBondContact O-CG2 3.29Å; A632-V636 PolarHBondContact O-N 3Å; V636-L639 PolarHBondContact O-N 3.35Å; V636-V640 HydrophobicContact CG1-CG2 4.37Å; V636-V640 WeakPolarHBondContact O-CB 3.42Å; V636-V640 WeakPolarHBondContact O-CG2 3.34Å; V636-V640 PolarHBondContact O-N 2.86Å
637	G	85.6	Confident	80.8	Confident	40 Å²	40	102.3 Å²	102.3	41%	0.412	53%	0.529	S	S	.	.	H	α-helix	trans	-60.2	-46.4	175	0	0	0	0	0	113.1	F633 T634 V635 V640 F641	F633-G637 PolarHBondContact O-N 2.72Å; T634-G637 PolarHBondContact O-N 3.2Å; V635-G637 VanDerWaalsContact C-N 3.32Å; V635-G637 PolarHBondContact O-N 3.08Å; G637-V640 PolarHBondContact O-N 3.24Å; G637-F641 WeakPolarHBondContact O-CB 3.02Å; G637-F641 PolarHBondContact O-N 3.14Å
638	M	81.8	Confident	79.7	Confident	126 Å²	126	105.8 Å²	105.8	62%	0.621	53%	0.532	S	S	*	.	H	α-helix	trans	-58.7	-46	172.4	-80.4	-71.3	-164.9	0	0	111.7	T634 V635 F641 I642	T634-M638 WeakPolarHBondContact O-CB 2.98Å; T634-M638 WeakPolarHBondContact O-CG 2.82Å; T634-M638 PolarHBondContact O-N 3.32Å; V635-M638 PolarHBondContact O-N 3.12Å; M638-F641 WeakPolarHBondContact O-CB 3.13Å; M638-F641 PolarHBondContact O-N 2.95Å; M638-I642 WeakPolarHBondContact O-CB 3.49Å; M638-I642 VanDerWaalsContact O-CG1 3.26Å; M638-I642 WeakPolarHBondContact O-CG1 3.06Å; M638-I642 PolarHBondContact O-N 2.86Å
639	L	83.1	Confident	78.2	Confident	99 Å²	99	101.3 Å²	101.3	52%	0.518	52%	0.52	S	S	.	.	H	α-helix	trans	-66.2	-41.3	-178	-143.4	163.1	0	0	0	111.3	V635 V636 I642 L643	V635-L639 WeakPolarHBondContact O-CB 3.39Å; V635-L639 PolarHBondContact O-N 3.31Å; V636-L639 PolarHBondContact O-N 3.35Å; L639-I642 PolarHBondContact O-N 3.42Å; L639-L643 HydrophobicContact CD2-CD1 3.66Å; L639-L643 HydrophobicContact CD2-CG 4.07Å; L639-L643 WeakPolarHBondContact O-CB 3.33Å; L639-L643 VanDerWaalsContact O-CG 3.3Å; L639-L643 WeakPolarHBondContact O-CG 3.35Å; L639-L643 PolarHBondContact O-N 3.48Å
640	V	84	Confident	76.8	Confident	87 Å²	87	106.6 Å²	106.6	53%	0.527	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-39.7	171.9	170.7	0	0	0	0	111.7	V636 G637 L643 R644	V636-V640 HydrophobicContact CG1-CG2 4.37Å; V636-V640 WeakPolarHBondContact O-CB 3.42Å; V636-V640 WeakPolarHBondContact O-CG2 3.34Å; V636-V640 PolarHBondContact O-N 2.86Å; G637-V640 PolarHBondContact O-N 3.24Å; V640-L643 PolarHBondContact O-N 2.87Å; V640-R644 WeakPolarHBondContact O-CB 3.39Å; V640-R644 PolarHBondContact O-N 3.4Å
641	F	79.1	Confident	75.5	Confident	120 Å²	120	113 Å²	113	53%	0.526	55%	0.554	S	S	.	*	H	α-helix	trans	-63.7	-45	175.2	178.8	-100.6	0	0	0	111.9	G637 M638 R644 N645	G637-F641 WeakPolarHBondContact O-CB 3.02Å; G637-F641 PolarHBondContact O-N 3.14Å; M638-F641 WeakPolarHBondContact O-CB 3.13Å; M638-F641 PolarHBondContact O-N 2.95Å; F641-R644 PolarHBondContact O-N 2.8Å; F641-N645 VanDerWaalsContact CE1-ND2 3.29Å; F641-N645 WeakPolarHBondContact CE1-ND2 3.49Å; F641-N645 VanDerWaalsContact CZ-ND2 3.3Å; F641-N645 WeakPolarHBondContact CZ-ND2 3.43Å; F641-N645 WeakPolarHBondContact O-CB 3.02Å; F641-N645 PolarHBondContact O-N 3.34Å
642	I	80.4	Confident	74	Confident	92 Å²	92	120 Å²	120	47%	0.472	57%	0.572	S	S	.	*	H	α-helix	trans	-61.5	-46.1	175.6	-70.1	163.2	0	0	0	110.7	M638 L639 R644 N645 R646	M638-I642 WeakPolarHBondContact O-CB 3.49Å; M638-I642 VanDerWaalsContact O-CG1 3.26Å; M638-I642 WeakPolarHBondContact O-CG1 3.06Å; M638-I642 PolarHBondContact O-N 2.86Å; L639-I642 PolarHBondContact O-N 3.42Å; I642-R644 PolarHBondContact O-N 3.24Å; I642-N645 PolarHBondContact O-N 2.77Å; I642-R646 WeakPolarHBondContact O-CG 3.47Å; I642-R646 PolarHBondContact O-N 2.69Å
643	L	75.3	Confident	72.2	Confident	98 Å²	98	121.9 Å²	121.9	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-63.7	-40.2	176.1	-71.9	170.5	0	0	0	112.1	L639 V640 N645 R646 K647	L639-L643 HydrophobicContact CD2-CD1 3.66Å; L639-L643 HydrophobicContact CD2-CG 4.07Å; L639-L643 WeakPolarHBondContact O-CB 3.33Å; L639-L643 VanDerWaalsContact O-CG 3.3Å; L639-L643 WeakPolarHBondContact O-CG 3.35Å; L639-L643 PolarHBondContact O-N 3.48Å; V640-L643 PolarHBondContact O-N 2.87Å; L643-N645 VanDerWaalsContact C-N 3.34Å; L643-R646 PolarHBondContact O-N 2.9Å; L643-K647 WeakPolarHBondContact O-CB 3.49Å; L643-K647 PolarHBondContact O-N 3.35Å
644	R	73.6	Confident	70.5	Confident	171 Å²	171	117.7 Å²	117.7	65%	0.645	57%	0.569	S	S	*	*	H	α-helix	trans	-65.1	-36.5	175	-171.5	173.4	-177.4	171.7	-0.4	111.9	V640 F641 I642 K647 R648	V640-R644 WeakPolarHBondContact O-CB 3.39Å; V640-R644 PolarHBondContact O-N 3.4Å; F641-R644 PolarHBondContact O-N 2.8Å; I642-R644 PolarHBondContact O-N 3.24Å; R644-K647 PolarHBondContact O-N 2.88Å; R644-R648 PolarHBondContact O-N 3.06Å
645	N	64.5	Low	68.8	Low	62 Å²	62	119.5 Å²	119.5	33%	0.332	58%	0.575	S	S	.	*	H	α-helix	trans	-74	-39.4	174.3	-82.4	-9.3	0	0	0	112.8	F641 I642 L643 K647 R648 S649	F641-N645 VanDerWaalsContact CE1-ND2 3.29Å; F641-N645 WeakPolarHBondContact CE1-ND2 3.49Å; F641-N645 VanDerWaalsContact CZ-ND2 3.3Å; F641-N645 WeakPolarHBondContact CZ-ND2 3.43Å; F641-N645 WeakPolarHBondContact O-CB 3.02Å; F641-N645 PolarHBondContact O-N 3.34Å; I642-N645 PolarHBondContact O-N 2.77Å; L643-N645 VanDerWaalsContact C-N 3.34Å; N645-K647 VanDerWaalsContact C-N 3.26Å; N645-K647 PolarHBondContact O-N 2.02Å; N645-R648 CarbonylContact O-C 3.09Å; N645-R648 WeakPolarHBondContact O-CA 3.34Å; N645-R648 WeakPolarHBondContact O-CB 3.25Å; N645-R648 PolarHBondContact O-N 3.17Å; N645-R648 VanDerWaalsContact O-N 3.08Å; N645-S649 PolarHBondContact O-N 3.31Å
646	R	68.7	Low	66.8	Low	183 Å²	183	119.1 Å²	119.1	69%	0.691	58%	0.577	S	S	*	*	H	α-helix	trans	-61	-36	170.3	-69.6	-177	83.6	177	6.2	111.7	I642 L643 S649 K650	I642-R646 WeakPolarHBondContact O-CG 3.47Å; I642-R646 PolarHBondContact O-N 2.69Å; L643-R646 PolarHBondContact O-N 2.9Å; R646-S649 PolarHBondContact O-N 2.04Å; R646-K650 PolarHBondContact O-N 2.86Å; R646-K650 VanDerWaalsContact O-N 3.1Å
647	K	63.7	Low	64.8	Low	172 Å²	172	119.7 Å²	119.7	75%	0.748	59%	0.585	S	S	*	*	H	α-helix	trans	-73.6	-23.6	174.2	-158.2	169.1	-173.2	174.4	0	113.5	L643 R644 N645	L643-K647 WeakPolarHBondContact O-CB 3.49Å; L643-K647 PolarHBondContact O-N 3.35Å; R644-K647 PolarHBondContact O-N 2.88Å; N645-K647 VanDerWaalsContact C-N 3.26Å; N645-K647 PolarHBondContact O-N 2.02Å
648	R	59	Low	62.8	Low	163 Å²	163	122.2 Å²	122.2	62%	0.615	60%	0.602	S	S	*	*	H	α-helix	trans	-76.5	-41.9	166.8	-85	178.6	159	172.8	-8.3	112.3	R644 N645 R651 R652	R644-R648 PolarHBondContact O-N 3.06Å; N645-R648 CarbonylContact O-C 3.09Å; N645-R648 WeakPolarHBondContact O-CA 3.34Å; N645-R648 WeakPolarHBondContact O-CB 3.25Å; N645-R648 PolarHBondContact O-N 3.17Å; N645-R648 VanDerWaalsContact O-N 3.08Å; R648-R651 WeakPolarHBondContact O-CA 3.16Å; R648-R651 WeakPolarHBondContact O-CB 3.46Å; R648-R651 PolarHBondContact O-N 3.06Å; R648-R651 VanDerWaalsContact O-N 3.07Å; R648-R652 PolarHBondContact O-N 3.11Å
649	S	56.1	Low	61	Low	59 Å²	59	120 Å²	120	41%	0.413	60%	0.599	S	S	.	*	H	α-helix	trans	-56.7	-55.4	176.4	-162.7	0	0	0	0	110.4	N645 R646 R651 R652 D653	N645-S649 PolarHBondContact O-N 3.31Å; R646-S649 PolarHBondContact O-N 2.04Å; S649-R651 PolarHBondContact O-N 3.1Å; S649-R652 CarbonylContact O-C 3.56Å; S649-R652 WeakPolarHBondContact O-CA 3.47Å; S649-R652 WeakPolarHBondContact O-CB 3.36Å; S649-R652 PolarHBondContact O-N 3.17Å; S649-D653 PolarHBondContact O-N 2.92Å; S649-D653 PolarHBondContact OG-OD2 3.23Å
650	K	57.1	Low	58.8	Low	171 Å²	171	124.2 Å²	124.2	74%	0.743	62%	0.616	S	S	*	*	H	α-helix	trans	-57.3	-18.2	177.2	-73.5	-163.5	171.1	-164.3	0	114.8	R646 D653 A654	R646-K650 PolarHBondContact O-N 2.86Å; R646-K650 VanDerWaalsContact O-N 3.1Å; K650-D653 WeakPolarHBondContact CA-OD2 3.38Å; K650-D653 PolarHBondContact N-OD2 3.33Å; K650-A654 WeakPolarHBondContact O-CB 2.99Å
651	R	54.7	Low	56.6	Low	205 Å²	205	128.3 Å²	128.3	77%	0.774	63%	0.633	S	S	*	*	H	α-helix	trans	-89.7	-20.7	172.7	-114.7	-175	179.6	-170.7	-0.6	113.9	R648 S649 N655	R648-R651 WeakPolarHBondContact O-CA 3.16Å; R648-R651 WeakPolarHBondContact O-CB 3.46Å; R648-R651 PolarHBondContact O-N 3.06Å; R648-R651 VanDerWaalsContact O-N 3.07Å; S649-R651 PolarHBondContact O-N 3.1Å; R651-N655 PolarHBondContact O-OD1 3.28Å
652	R	52.8	Low	54.4	Low	200 Å²	200	130.4 Å²	130.4	76%	0.755	65%	0.65	S	S	*	*	H	α-helix	trans	-82.5	-44	171.3	-169.5	175	-178.3	171.8	-1.2	110.1	R648 S649 A654 N655 S656	R648-R652 PolarHBondContact O-N 3.11Å; S649-R652 CarbonylContact O-C 3.56Å; S649-R652 WeakPolarHBondContact O-CA 3.47Å; S649-R652 WeakPolarHBondContact O-CB 3.36Å; S649-R652 PolarHBondContact O-N 3.17Å; R652-A654 VanDerWaalsContact C-N 3.33Å; R652-A654 PolarHBondContact O-N 3.09Å; R652-N655 PolarHBondContact O-N 3Å; R652-S656 WeakPolarHBondContact O-CB 3.18Å; R652-S656 PolarHBondContact O-N 3.22Å
653	D	50.7	Low	52.1	Low	87 Å²	87	131 Å²	131	47%	0.465	66%	0.662	S	S	.	*	H	α-helix	trans	-60.4	-42.8	179.2	-47.8	-30.3	0	0	0	110.8	S649 K650 N655 S656 S657	S649-D653 PolarHBondContact O-N 2.92Å; S649-D653 PolarHBondContact OG-OD2 3.23Å; K650-D653 WeakPolarHBondContact CA-OD2 3.38Å; K650-D653 PolarHBondContact N-OD2 3.33Å; D653-N655 VanDerWaalsContact C-N 3.29Å; D653-N655 PolarHBondContact O-N 2.96Å; D653-S656 PolarHBondContact O-N 2.9Å; D653-S657 PolarHBondContact O-N 2.96Å; D653-S657 PolarHBondContact O-OG 3.37Å
654	A	49.4	Very low	50	Low	64 Å²	64	134.5 Å²	134.5	53%	0.529	68%	0.68	S	S	.	*	H	α-helix	trans	-70	-17.6	175.7	0	0	0	0	0	115.1	K650 R652	K650-A654 WeakPolarHBondContact O-CB 2.99Å; R652-A654 VanDerWaalsContact C-N 3.33Å; R652-A654 PolarHBondContact O-N 3.09Å
655	N	49.4	Very low	48	Very low	131 Å²	131	134.8 Å²	134.8	70%	0.701	69%	0.689	S	S	*	*	H	α-helix	trans	-95.2	-20.6	174	-83	34.4	0	0	0	112.1	R651 R652 D653	R651-N655 PolarHBondContact O-OD1 3.28Å; R652-N655 PolarHBondContact O-N 3Å; D653-N655 VanDerWaalsContact C-N 3.29Å; D653-N655 PolarHBondContact O-N 2.96Å
656	S	47.1	Very low	46.5	Very low	86 Å²	86	137.4 Å²	137.4	60%	0.601	71%	0.707	S	S	*	*	H	α-helix	trans	-86	-8.1	-179.6	-162.6	0	0	0	0	113.7	R652 D653	R652-S656 WeakPolarHBondContact O-CB 3.18Å; R652-S656 PolarHBondContact O-N 3.22Å; D653-S656 PolarHBondContact O-N 2.9Å
657	S	44.2	Very low	44.6	Very low	97 Å²	97	134.9 Å²	134.9	68%	0.678	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	13	-178.9	53.1	0	0	0	0	114.1	D653	D653-S657 PolarHBondContact O-N 2.96Å; D653-S657 PolarHBondContact O-OG 3.37Å
658	A	43.8	Very low	42.9	Very low	94 Å²	94	131.7 Å²	131.7	78%	0.777	71%	0.71	S	S	*	*	S	Bend	trans	-108.6	3.8	-179.3	0	0	0	0	0	113.9
659	S	45.3	Very low	41.5	Very low	79 Å²	79	131.4 Å²	131.4	55%	0.552	72%	0.721	S	S	*	*	S	Bend	trans	-140.6	141.1	-180	53.6	0	0	0	0	110.2
660	E	36.8	Very low	40.1	Very low	187 Å²	187	134.4 Å²	134.4	87%	0.874	74%	0.742	S	S	*	*			trans	69	55.7	165.7	-56.2	-176.4	170.4	0	0	118.1
661	I	36.5	Very low	38.8	Very low	173 Å²	173	130.4 Å²	130.4	89%	0.887	74%	0.736	S	S	*	*			trans	-130.9	95.5	141	-55.6	179.7	0	0	0	108.5
662	N	33.1	Very low	37.6	Very low	164 Å²	164	130.1 Å²	130.1	88%	0.877	74%	0.736	S	S	*	*			trans	-155.8	45.6	171.3	-156	20.6	0	0	0	114
663	S	31.6	Very low	36.6	Very low	105 Å²	105	129.5 Å²	129.5	73%	0.734	73%	0.734	S	S	*	*	S	Bend	trans	-156	116.8	171.3	59	0	0	0	0	114.2
664	L	31.8	Very low	35.7	Very low	171 Å²	171	131.8 Å²	131.8	90%	0.895	74%	0.741	S	S	*	*			trans	53.2	107.5	153.4	-75.6	80.6	0	0	0	120.6
665	Q	30.9	Very low	34.7	Very low	178 Å²	178	135.4 Å²	135.4	83%	0.832	75%	0.752	S	S	*	*			trans	-67.5	167.3	146.9	-169.2	150.8	-31.4	0	0	112.2
666	T	33.9	Very low	33.9	Very low	116 Å²	116	132.3 Å²	132.3	71%	0.712	75%	0.751	S	S	*	*				138.8	145.1	120.3	-33.6	0	0	0	0	114.9
667	V	29.1	Very low	34	Very low	130 Å²	130	133.9 Å²	133.9	79%	0.788	76%	0.759	S	S	*	*			trans	73.3	151.9	165.2	-164.8	0	0	0	0	116.2
668	C	28.4	Very low	33.8	Very low	105 Å²	105	139.7 Å²	139.7	71%	0.709	77%	0.767	S	S	*	*				176	154.4	-56.7	-92.1	0	0	0	0	108.4
669	D	27.9	Very low	33.3	Very low	158 Å²	158	142.1 Å²	142.1	85%	0.845	77%	0.767	S	S	*	*			trans	16.9	134.7	160.4	-53.5	-38.2	0	0	0	122.3
670	S	27.8	Very low	32.8	Very low	121 Å²	121	141.5 Å²	141.5	85%	0.846	77%	0.767	S	S	*	*				-171.5	177.4	107.3	-159.7	0	0	0	0	112.7
671	S	29.6	Very low	32.7	Very low	88 Å²	88	140.3 Å²	140.3	62%	0.615	77%	0.767	S	S	*	*			trans	-125.9	167	-172.7	49.5	0	0	0	0	112.3
672	Y	28.6	Very low	32.5	Very low	198 Å²	198	135.8 Å²	135.8	78%	0.776	76%	0.763	S	S	*	*				168.8	116.3	124.9	-104.7	-110.5	0	0	0	115.1
673	W	32.1	Very low	32.4	Very low	188 Å²	188	131.9 Å²	131.9	71%	0.712	75%	0.753	S	S	*	*			trans	39	138.4	139.3	-62	82.1	0	0	0	127.4
674	H	32.9	Very low	32.5	Very low	135 Å²	135	135.6 Å²	135.6	63%	0.625	76%	0.759	S	S	*	*				103.5	123.3	123.8	-96.2	-40.3	0	0	0	125.9
675	N	28.6	Very low	32.5	Very low	140 Å²	140	139 Å²	139	75%	0.749	76%	0.76	S	S	*	*			trans	91.6	131.3	135.1	-69.9	-20.8	0	0	0	124.1
676	G	31.1	Very low	32.5	Very low	66 Å²	66	136.7 Å²	136.7	68%	0.68	76%	0.757	S	S	*	*			trans	-108.3	-162.5	160.4	0	0	0	0	0	111.7
677	P	50.8	Low	32.4	Very low	118 Å²	118	141.8 Å²	141.8	77%	0.766	77%	0.765	S	S	*	*				-154.9	166.7	92.7	36.2	-16	0	0	0	118.6
678	Y	38.7	Very low	32.3	Very low	220 Å²	220	142.1 Å²	142.1	86%	0.863	76%	0.762	S	S	*	*			trans	28.1	150.3	149.8	-63.4	-66.8	0	0	0	122.9
679	N	34.3	Very low	32.3	Very low	144 Å²	144	143.5 Å²	143.5	77%	0.77	77%	0.772	S	S	*	*			cis	-147.9	-163.5	16.8	-148.5	26.8	0	0	0	110.2
680	A	33.7	Very low	32.4	Very low	66 Å²	66	139.9 Å²	139.9	55%	0.545	77%	0.771	S	S	.	*			cis	-155.7	-150.7	8.8	0	0	0	0	0	112.4
681	D	34.3	Very low	32.8	Very low	163 Å²	163	138.9 Å²	138.9	87%	0.872	76%	0.764	S	S	*	*			trans	0.4	137	162.8	-51	-11.2	0	0	0	119.8
682	G	32.3	Very low	33	Very low	78 Å²	78	143.5 Å²	143.5	80%	0.804	78%	0.776	S	S	*	*			cis	134.7	146.6	-2	0	0	0	0	0	112.9
683	A	32.6	Very low	33.3	Very low	82 Å²	82	138.3 Å²	138.3	68%	0.678	77%	0.769	S	S	*	*			cis	-164.9	153.9	-14	0	0	0	0	0	111.7
684	H	32.4	Very low	33.5	Very low	183 Å²	183	137 Å²	137	85%	0.847	77%	0.774	S	S	*	*			trans	66.6	129.1	170.4	-51.4	-64.9	0	0	0	118.4
685	R	32.7	Very low	33.7	Very low	243 Å²	243	135.6 Å²	135.6	92%	0.917	78%	0.78	S	S	*	*				-149.8	163.8	51.3	-84.7	-178.3	167.3	158.2	-1.9	113.9
686	V	30.6	Very low	34.1	Very low	128 Å²	128	140.1 Å²	140.1	78%	0.776	80%	0.804	S	S	*	*			trans	-112.2	144.6	174.7	172.6	0	0	0	0	109.4
687	Y	31.3	Very low	34.3	Very low	223 Å²	223	143.8 Å²	143.8	88%	0.875	81%	0.81	S	S	*	*			trans	-154.6	158.9	144.3	-101.9	-63.6	0	0	0	111.3
688	D	28.4	Very low	33.4	Very low	138 Å²	138	145.2 Å²	145.2	74%	0.738	81%	0.813	S	S	*	*			trans	-65	153.4	-154	-66.8	-80.9	0	0	0	119.1
689	C	28.4	Very low	33.1	Very low	134 Å²	134	141 Å²	141	91%	0.905	81%	0.81	S	S	*	*			trans	-87	114.3	152.5	-62.3	0	0	0	0	109.9
690	G	29.8	Very low	33	Very low	81 Å²	81	140.8 Å²	140.8	84%	0.835	81%	0.812	S	S	*	*			trans	-101	95.7	173.3	0	0	0	0	0	112.3
691	S	35.6	Very low	33	Very low	100 Å²	100	145.5 Å²	145.5	70%	0.699	83%	0.829	S	S	*	*			trans	-77	146.2	173.8	57.6	0	0	0	0	112.4
692	H	32.8	Very low	32.9	Very low	185 Å²	185	144.3 Å²	144.3	86%	0.856	83%	0.826	S	S	*	*			trans	-160.6	176.5	130.6	-109.5	-65.5	0	0	0	112
693	S	34.8	Very low	33	Very low	90 Å²	90	149.1 Å²	149.1	63%	0.629	83%	0.828	S	S	*	*			trans	-148.2	160.6	-155.7	55.5	0	0	0	0	113.8
694	L	36.9	Very low	33	Very low	159 Å²	159	154.2 Å²	154.2	83%	0.832	84%	0.839	S	S	*	*			trans	73.8	146.8	160.1	-69.3	159	0	0	0	119.3
695	S	36.8	Very low	33	Very low	107 Å²	107	151.8 Å²	151.8	75%	0.748	84%	0.839	S	S	*	*			trans	64	134.8	171.6	28.5	0	0	0	0	116.8
696	D	38.3	Very low	33.1	Very low	234 Å²	234	143.5 Å²	143.5	100%	1.251	83%	0.831	S	S	*	*			cis	-120.9	0	-0.3	-76	-43.1	0	0	0	112.1

Retrieved 696 of 696 residues in 1314.6 ms (Link to these results)

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