A0A077ZHZ7_TRITR Loading...

F box:WD repeat containing protein 7

AlphaFold DB , UniProt , Accession A0A077ZHZ7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 510 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	34.5	Very low	250 Å²	250	147.6 Å²	147.6	100%	1.232	84%	0.836	S	S	*	*				0	113.7	0	-77	-171.1	-148.2	0	0	108.1
2	G	39.5	Very low	34	Very low	76 Å²	76	145.4 Å²	145.4	78%	0.784	83%	0.834	S	S	*	*			trans	74.5	81.9	167.4	0	0	0	0	0	115.6
3	E	32.3	Very low	33.6	Very low	181 Å²	181	147.9 Å²	147.9	85%	0.846	83%	0.834	S	S	*	*				30.7	125.1	79.4	-72	-167.6	173.8	0	0	115.8
4	I	38.6	Very low	33.5	Very low	153 Å²	153	148.3 Å²	148.3	79%	0.785	83%	0.833	S	S	*	*				-172.4	107.9	122.2	-90	150.5	0	0	0	111.7
5	F	37	Very low	33.4	Very low	184 Å²	184	144.9 Å²	144.9	81%	0.807	82%	0.823	S	S	*	*			trans	70.5	106.6	139.7	-68.3	-96.6	0	0	0	123.2
6	S	30.1	Very low	33.5	Very low	108 Å²	108	143.6 Å²	143.6	76%	0.755	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-79.9	146.5	143.3	51.2	0	0	0	0	111.4
7	P	37.7	Very low	33.5	Very low	125 Å²	125	143.1 Å²	143.1	81%	0.812	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-101	148.6	156.2	22.3	-5.5	0	0	0	112.3
8	S	33.7	Very low	33.6	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-65.1	152.7	-175.9	45.6	0	0	0	0	116.3
9	S	30.5	Very low	33.9	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	82%	0.818	S	S	*	*			trans	-18	130.3	152.4	51.7	0	0	0	0	117.3
10	N	35.3	Very low	34.3	Very low	165 Å²	165	141.8 Å²	141.8	88%	0.882	80%	0.8	S	S	*	*			trans	-146.3	134.8	137.9	-110.5	-5.2	0	0	0	110.3
11	E	28.7	Very low	34.8	Very low	164 Å²	164	138.8 Å²	138.8	77%	0.766	79%	0.792	S	S	*	*			trans	-64.9	136.8	-172.7	-61.8	164.8	136.5	0	0	112.3
12	C	28.7	Very low	35.2	Very low	121 Å²	121	133.7 Å²	133.7	82%	0.818	77%	0.766	S	S	*	*			trans	-140	96.6	145.3	-99.3	0	0	0	0	106.8	N14	C12-N14 PolarHBondContact O-N 3.29Å
13	Q	28.3	Very low	35.5	Very low	178 Å²	178	135.6 Å²	135.6	83%	0.832	75%	0.754	S	S	*	*			trans	-60.3	114	163.9	-66.9	174	-13	0	0	107.8
14	N	32.3	Very low	36.2	Very low	153 Å²	153	132.7 Å²	132.7	82%	0.818	74%	0.744	S	S	*	*			trans	-136.8	115.9	159.2	-86.9	-25.9	0	0	0	107.5	C12	C12-N14 PolarHBondContact O-N 3.29Å
15	S	32.1	Very low	36.7	Very low	98 Å²	98	131.5 Å²	131.5	69%	0.685	74%	0.736	S	S	*	*			trans	-58.7	146	178.8	40.4	0	0	0	0	112.6	D17	S15-D17 PolarHBondContact O-N 3.3Å
16	P	34.6	Very low	37.4	Very low	123 Å²	123	128.3 Å²	128.3	80%	0.799	73%	0.726	S	S	*	*	S	Bend	trans	-93.2	75.7	177.7	36.8	-29.1	0	0	0	110.1
17	D	33.9	Very low	38.2	Very low	136 Å²	136	127.2 Å²	127.2	73%	0.727	71%	0.708	S	S	*	*			trans	-146.7	94.9	168.6	-77.6	-46.8	0	0	0	106.7	S15	S15-D17 PolarHBondContact O-N 3.3Å
18	D	34.3	Very low	38.9	Very low	169 Å²	169	125.9 Å²	125.9	90%	0.904	70%	0.698	S	S	*	*			trans	160.8	69.3	155.5	-82.7	-23.2	0	0	0	110.1
19	E	40.9	Very low	40	Very low	165 Å²	165	126 Å²	126	77%	0.771	69%	0.686	S	S	*	*			trans	-96.4	122.5	154.8	-122	-176.5	-172.6	0	0	107.3	A21	E19-A21 PolarHBondContact O-N 3.47Å
20	P	40.9	Very low	41.1	Very low	69 Å²	69	123 Å²	123	45%	0.448	67%	0.667	S	S	.	*			trans	-71.2	132.6	-163.9	27	-32.2	0	0	0	111	E22 Q23	P20-E22 PolarHBondContact O-N 3.5Å; P20-Q23 PolarHBondContact O-N 3.04Å
21	A	44.9	Very low	42	Very low	78 Å²	78	119 Å²	119	65%	0.645	65%	0.646	S	S	*	*	H	α-helix	trans	-49.1	-23.3	174.2	0	0	0	0	0	113.6	E19 Q23 N24 E25	E19-A21 PolarHBondContact O-N 3.47Å; A21-Q23 VanDerWaalsContact C-N 3.34Å; A21-Q23 PolarHBondContact O-N 2.92Å; A21-N24 PolarHBondContact O-N 2.97Å; A21-E25 PolarHBondContact O-N 2.54Å
22	E	45.1	Very low	43.3	Very low	144 Å²	144	114.2 Å²	114.2	67%	0.673	63%	0.63	S	S	*	*	H	α-helix	trans	-59.2	-32.9	174.8	-77.5	-175.1	143.9	0	0	114.5	P20 L26	P20-E22 PolarHBondContact O-N 3.5Å; E22-L26 WeakPolarHBondContact O-CG 3.41Å; E22-L26 PolarHBondContact O-N 3.39Å
23	Q	46.5	Very low	44.7	Very low	115 Å²	115	114.3 Å²	114.3	54%	0.537	62%	0.623	S	S	.	*	H	α-helix	trans	-75.3	-30.1	179.4	-79.9	-172.4	0.4	0	0	112.9	P20 A21 F27	P20-Q23 PolarHBondContact O-N 3.04Å; A21-Q23 VanDerWaalsContact C-N 3.34Å; A21-Q23 PolarHBondContact O-N 2.92Å; Q23-F27 PolarHBondContact O-N 3.47Å
24	N	46.4	Very low	46	Very low	120 Å²	120	108.7 Å²	108.7	64%	0.642	60%	0.596	S	S	*	*	H	α-helix	trans	-74.7	-33.7	174.3	-104	-17.6	0	0	0	111.8	A21 F27 T28	A21-N24 PolarHBondContact O-N 2.97Å; N24-F27 PolarHBondContact O-N 3.35Å; N24-T28 PolarHBondContact O-N 3.34Å; N24-T28 VanDerWaalsContact O-N 3.12Å; N24-T28 PolarHBondContact O-OG1 3.11Å
25	E	48.3	Very low	47.1	Very low	129 Å²	129	102.1 Å²	102.1	60%	0.603	56%	0.563	S	S	*	*	H	α-helix	trans	-65.1	-45.3	173.3	-76.3	-173.2	156.4	0	0	111.5	A21 F27 T28 Q29	A21-E25 PolarHBondContact O-N 2.54Å; E25-F27 VanDerWaalsContact C-N 3.28Å; E25-F27 PolarHBondContact O-N 3.17Å; E25-T28 PolarHBondContact O-N 3.15Å; E25-Q29 VanDerWaalsContact O-CB 3.3Å; E25-Q29 WeakPolarHBondContact O-CB 3.18Å; E25-Q29 PolarHBondContact O-N 3.35Å
26	L	51.5	Low	48.4	Very low	117 Å²	117	104.6 Å²	104.6	61%	0.613	57%	0.569	S	S	*	*	H	α-helix	trans	-58.6	-37.7	174	-78.4	161	0	0	0	112.9	E22 A30	E22-L26 WeakPolarHBondContact O-CG 3.41Å; E22-L26 PolarHBondContact O-N 3.39Å; L26-A30 WeakPolarHBondContact O-CB 3.25Å; L26-A30 PolarHBondContact O-N 3.04Å
27	F	46.7	Very low	49.7	Very low	85 Å²	85	102.2 Å²	102.2	37%	0.373	57%	0.567	S	S	.	*	H	α-helix	trans	-66.4	-39.7	178.3	-162.3	-92	0	0	0	112.3	Q23 N24 E25 I31 L55	Q23-F27 PolarHBondContact O-N 3.47Å; N24-F27 PolarHBondContact O-N 3.35Å; E25-F27 VanDerWaalsContact C-N 3.28Å; E25-F27 PolarHBondContact O-N 3.17Å; F27-I31 HydrophobicContact CD1-CD1 4.24Å; F27-I31 HydrophobicContact CE1-CD1 4.02Å; F27-L55 HydrophobicContact CE2-CD1 4.12Å; F27-L55 HydrophobicContact CZ-CD1 3.91Å
28	T	54.3	Low	51.3	Low	96 Å²	96	101.5 Å²	101.5	59%	0.589	56%	0.557	S	S	*	*	H	α-helix	trans	-75.4	-35.4	-179.6	-40.5	0	0	0	0	111.2	N24 E25 I31 S32	N24-T28 PolarHBondContact O-N 3.34Å; N24-T28 VanDerWaalsContact O-N 3.12Å; N24-T28 PolarHBondContact O-OG1 3.11Å; E25-T28 PolarHBondContact O-N 3.15Å; T28-I31 PolarHBondContact O-N 3.19Å; T28-S32 PolarHBondContact O-N 3Å; T28-S32 VanDerWaalsContact O-N 3.13Å
29	Q	55.1	Low	53.2	Low	113 Å²	113	96.6 Å²	96.6	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-73.3	-37	-179.4	-148.4	152.8	12.1	0	0	112.5	E25 I31 S32 D33	E25-Q29 VanDerWaalsContact O-CB 3.3Å; E25-Q29 WeakPolarHBondContact O-CB 3.18Å; E25-Q29 PolarHBondContact O-N 3.35Å; Q29-I31 VanDerWaalsContact C-N 3.28Å; Q29-I31 PolarHBondContact O-N 3.11Å; Q29-S32 WeakPolarHBondContact CA-OG 3.44Å; Q29-S32 PolarHBondContact O-N 3.11Å; Q29-S32 PolarHBondContact O-OG 2.99Å; Q29-D33 WeakPolarHBondContact O-CB 3.41Å; Q29-D33 VanDerWaalsContact O-CG 3.27Å; Q29-D33 PolarHBondContact O-N 3.14Å
30	A	54	Low	54.5	Low	44 Å²	44	93.9 Å²	93.9	36%	0.364	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-33.5	174.2	0	0	0	0	0	113.1	L26	L26-A30 WeakPolarHBondContact O-CB 3.25Å; L26-A30 PolarHBondContact O-N 3.04Å
31	I	53.6	Low	56.1	Low	83 Å²	83	98.4 Å²	98.4	43%	0.426	54%	0.54	S	S	.	.	H	α-helix	trans	-79.6	-33	177.2	-63.6	174.3	0	0	0	111	F27 T28 Q29	F27-I31 HydrophobicContact CD1-CD1 4.24Å; F27-I31 HydrophobicContact CE1-CD1 4.02Å; T28-I31 PolarHBondContact O-N 3.19Å; Q29-I31 VanDerWaalsContact C-N 3.28Å; Q29-I31 PolarHBondContact O-N 3.11Å
32	S	56.2	Low	57.7	Low	63 Å²	63	102 Å²	102	44%	0.441	54%	0.541	S	S	.	.	H	α-helix	trans	-71.3	-36.5	177	65.7	0	0	0	0	113.3	T28 Q29 E34 A35	T28-S32 PolarHBondContact O-N 3Å; T28-S32 VanDerWaalsContact O-N 3.13Å; Q29-S32 WeakPolarHBondContact CA-OG 3.44Å; Q29-S32 PolarHBondContact O-N 3.11Å; Q29-S32 PolarHBondContact O-OG 2.99Å; S32-E34 VanDerWaalsContact C-N 3.33Å; S32-E34 PolarHBondContact O-N 2.65Å; S32-A35 PolarHBondContact O-N 3.39Å
33	D	59	Low	59.2	Low	123 Å²	123	96.7 Å²	96.7	66%	0.658	52%	0.515	S	S	*	.	H	α-helix	trans	-70.2	-28.2	-176.4	-74.4	-7.4	0	0	0	112.9	Q29	Q29-D33 WeakPolarHBondContact O-CB 3.41Å; Q29-D33 VanDerWaalsContact O-CG 3.27Å; Q29-D33 PolarHBondContact O-N 3.14Å
34	E	55.6	Low	61	Low	60 Å²	60	94.9 Å²	94.9	28%	0.28	51%	0.511	S	S	.	.	H	α-helix	trans	-83.6	-22.4	176	-69.8	-160.6	132.3	0	0	113.7	S32 N36 W43 A51 R54	S32-E34 VanDerWaalsContact C-N 3.33Å; S32-E34 PolarHBondContact O-N 2.65Å; E34-N36 VanDerWaalsContact C-N 3.28Å; E34-N36 PolarHBondContact O-N 3.4Å; E34-W43 HydrophobicContact CB-CH2 4.36Å; E34-A51 VanDerWaalsContact OE2-CA 3.28Å; E34-A51 WeakPolarHBondContact OE2-CA 3.44Å; E34-A51 WeakPolarHBondContact OE2-CB 3.34Å; E34-R54 WeakPolarHBondContact OE1-CD 3.46Å; E34-R54 IonicContact OE1-CZ 2.99Å; E34-R54 IonicContact OE1-NE 3.4Å; E34-R54 PolarHBondContact OE1-NE 3.24Å; E34-R54 IonicContact OE1-NH1 3.64Å; E34-R54 PolarHBondContact OE1-NH1 3.16Å
35	A	55.9	Low	62.4	Low	15 Å²	15	95 Å²	95	12%	0.124	51%	0.512	C	S	.	.	H	α-helix	trans	-71.6	-21.7	-173.4	0	0	0	0	0	112.8	S32 G37 K38 W43	S32-A35 PolarHBondContact O-N 3.39Å; A35-G37 PolarHBondContact O-N 2.99Å; A35-G37 VanDerWaalsContact O-N 3.08Å; A35-K38 WeakPolarHBondContact O-CA 3.41Å; A35-K38 VanDerWaalsContact O-CB 3.25Å; A35-K38 WeakPolarHBondContact O-CB 3.06Å; A35-K38 PolarHBondContact O-N 3.14Å; A35-W43 HydrophobicContact CB-CZ2 3.83Å
36	N	59.4	Low	63.8	Low	149 Å²	149	91.7 Å²	91.7	80%	0.797	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	34.7	-161.9	-87.5	-13.5	0	0	0	111.2	E34 K38	E34-N36 VanDerWaalsContact C-N 3.28Å; E34-N36 PolarHBondContact O-N 3.4Å; N36-K38 PolarHBondContact O-N 3.42Å
37	G	61.7	Low	65	Low	74 Å²	74	89.1 Å²	89.1	76%	0.763	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	9.6	-173	0	0	0	0	0	116	A35	A35-G37 PolarHBondContact O-N 2.99Å; A35-G37 VanDerWaalsContact O-N 3.08Å
38	K	67.2	Low	66.5	Low	121 Å²	121	89.2 Å²	89.2	53%	0.526	49%	0.494	S	S	.	.			trans	-82.5	131.8	176.9	-66.1	-178.2	-178	175.2	0	110.9	A35 N36 W43	A35-K38 WeakPolarHBondContact O-CA 3.41Å; A35-K38 VanDerWaalsContact O-CB 3.25Å; A35-K38 WeakPolarHBondContact O-CB 3.06Å; A35-K38 PolarHBondContact O-N 3.14Å; N36-K38 PolarHBondContact O-N 3.42Å; K38-W43 PolarHBondContact O-NE1 3.44Å; K38-W43 VanDerWaalsContact O-NE1 3.09Å
39	P	73.5	Confident	67.4	Low	65 Å²	65	90.5 Å²	90.5	42%	0.422	50%	0.496	S	S	.	.			trans	-62	146.3	172.5	28	-34.8	0	0	0	110.5	Q41 K42	P39-Q41 PolarHBondContact O-N 3.43Å; P39-K42 HydrophobicContact CG-CD 4.09Å; P39-K42 HydrophobicContact CG-CG 4.13Å; P39-K42 PolarHBondContact O-N 2.71Å
40	L	67.8	Low	68.5	Low	109 Å²	109	92.4 Å²	92.4	57%	0.571	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-51	-30.8	-176.7	-170.6	75.2	0	0	0	113.1	K42 W43	L40-K42 PolarHBondContact O-N 2.86Å; L40-W43 HydrophobicContact CD1-CD2 3.99Å; L40-W43 HydrophobicContact CD1-CE3 3.85Å; L40-W43 HydrophobicContact CD1-CH2 4.47Å; L40-W43 HydrophobicContact CD1-CZ3 4.07Å; L40-W43 WeakPolarHBondContact O-CB 3.29Å; L40-W43 PolarHBondContact O-N 3.06Å
41	Q	74.5	Confident	69.5	Low	163 Å²	163	91 Å²	91	76%	0.762	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-62.1	-22	176.7	-63	86.5	-7.8	0	0	113.5	P39	P39-Q41 PolarHBondContact O-N 3.43Å
42	K	79	Confident	70.5	Confident	154 Å²	154	92.1 Å²	92.1	67%	0.67	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-97.8	0.9	179.8	-69.2	-172.1	179.7	-179.5	0	114.2	P39 L40	P39-K42 HydrophobicContact CG-CD 4.09Å; P39-K42 HydrophobicContact CG-CG 4.13Å; P39-K42 PolarHBondContact O-N 2.71Å; L40-K42 PolarHBondContact O-N 2.86Å
43	W	78.1	Confident	71.5	Confident	33 Å²	33	90.9 Å²	90.9	13%	0.125	49%	0.49	C	S	.	.			trans	-76.5	140.1	-179.5	-71.8	26.3	0	0	0	111.4	E34 A35 K38 L40 D47 K48 A51	E34-W43 HydrophobicContact CB-CH2 4.36Å; A35-W43 HydrophobicContact CB-CZ2 3.83Å; K38-W43 PolarHBondContact O-NE1 3.44Å; K38-W43 VanDerWaalsContact O-NE1 3.09Å; L40-W43 HydrophobicContact CD1-CD2 3.99Å; L40-W43 HydrophobicContact CD1-CE3 3.85Å; L40-W43 HydrophobicContact CD1-CH2 4.47Å; L40-W43 HydrophobicContact CD1-CZ3 4.07Å; L40-W43 WeakPolarHBondContact O-CB 3.29Å; L40-W43 PolarHBondContact O-N 3.06Å; W43-D47 HydrophobicContact CB-CB 4.28Å; W43-D47 HydrophobicContact CE3-CB 4.35Å; W43-K48 HydrophobicContact CB-CG 3.91Å; W43-K48 HydrophobicContact CE3-CG 4.14Å; W43-K48 WeakPolarHBondContact O-CE 3.29Å; W43-A51 HydrophobicContact CE3-CB 4.35Å; W43-A51 HydrophobicContact CH2-CB 4.05Å; W43-A51 HydrophobicContact CZ3-CB 3.39Å
44	T	84	Confident	72.2	Confident	76 Å²	76	91.5 Å²	91.5	47%	0.466	48%	0.484	S	S	.	.			trans	-71.8	162.2	171.8	73.2	0	0	0	0	110.6	A46 D47 K48	T44-A46 PolarHBondContact O-N 2.9Å; T44-D47 WeakPolarHBondContact CB-OD2 3.36Å; T44-D47 WeakPolarHBondContact CG2-OD2 3.49Å; T44-D47 PolarHBondContact N-OD2 3.36Å; T44-D47 PolarHBondContact O-N 3.12Å; T44-D47 PolarHBondContact OG1-N 2.9Å; T44-D47 PolarHBondContact OG1-OD2 2.77Å; T44-K48 WeakPolarHBondContact O-CG 3.36Å; T44-K48 PolarHBondContact O-N 3.46Å
45	N	74.9	Confident	73.1	Confident	123 Å²	123	91.3 Å²	91.3	66%	0.658	48%	0.484	S	S	*	.	H	α-helix	trans	-60.6	-34	175.8	-71.6	-17.7	0	0	0	112.2	K48 I49	N45-K48 PolarHBondContact O-N 3.44Å; N45-I49 VanDerWaalsContact O-CG1 3.25Å; N45-I49 WeakPolarHBondContact O-CG1 3.32Å; N45-I49 PolarHBondContact O-N 3.1Å
46	A	77.6	Confident	74	Confident	60 Å²	60	94 Å²	94	50%	0.496	50%	0.499	S	S	.	.	H	α-helix	trans	-66.5	-40.2	176	0	0	0	0	0	111.9	T44 I49 R50	T44-A46 PolarHBondContact O-N 2.9Å; A46-I49 PolarHBondContact O-N 3.46Å; A46-R50 WeakPolarHBondContact O-CB 3.41Å; A46-R50 PolarHBondContact O-N 2.71Å
47	D	76.7	Confident	74.8	Confident	63 Å²	63	95.4 Å²	95.4	34%	0.337	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-45.4	176.4	-56.7	-38.3	0	0	0	110.8	W43 T44 I49 R50 A51	W43-D47 HydrophobicContact CB-CB 4.28Å; W43-D47 HydrophobicContact CE3-CB 4.35Å; T44-D47 WeakPolarHBondContact CB-OD2 3.36Å; T44-D47 WeakPolarHBondContact CG2-OD2 3.49Å; T44-D47 PolarHBondContact N-OD2 3.36Å; T44-D47 PolarHBondContact O-N 3.12Å; T44-D47 PolarHBondContact OG1-N 2.9Å; T44-D47 PolarHBondContact OG1-OD2 2.77Å; D47-I49 PolarHBondContact O-N 3.33Å; D47-R50 PolarHBondContact O-N 3.29Å; D47-A51 WeakPolarHBondContact O-CB 3.39Å; D47-A51 PolarHBondContact O-N 2.98Å
48	K	77.6	Confident	75.6	Confident	86 Å²	86	97.7 Å²	97.7	37%	0.374	49%	0.493	S	S	.	.	H	α-helix	trans	-59.8	-44.5	176.8	-68.2	175.7	-175	176.3	0	112.2	W43 T44 N45 L52	W43-K48 HydrophobicContact CB-CG 3.91Å; W43-K48 HydrophobicContact CE3-CG 4.14Å; W43-K48 WeakPolarHBondContact O-CE 3.29Å; T44-K48 WeakPolarHBondContact O-CG 3.36Å; T44-K48 PolarHBondContact O-N 3.46Å; N45-K48 PolarHBondContact O-N 3.44Å; K48-L52 VanDerWaalsContact O-CB 3.3Å; K48-L52 WeakPolarHBondContact O-CB 3.24Å; K48-L52 PolarHBondContact O-N 3.42Å
49	I	74.5	Confident	75.9	Confident	124 Å²	124	93.1 Å²	93.1	64%	0.636	48%	0.475	S	S	*	.	H	α-helix	trans	-65.4	-41.2	178.2	-69.9	166.9	0	0	0	110.8	N45 A46 D47 L52 G53	N45-I49 VanDerWaalsContact O-CG1 3.25Å; N45-I49 WeakPolarHBondContact O-CG1 3.32Å; N45-I49 PolarHBondContact O-N 3.1Å; A46-I49 PolarHBondContact O-N 3.46Å; D47-I49 PolarHBondContact O-N 3.33Å; I49-L52 PolarHBondContact O-N 3.43Å; I49-G53 PolarHBondContact O-N 2.93Å
50	R	76.9	Confident	76.3	Confident	153 Å²	153	92.5 Å²	92.5	58%	0.577	47%	0.473	S	S	*	.	H	α-helix	trans	-63.8	-46.7	178.1	-175.2	-176.5	-61.4	168.3	2.4	111.6	A46 D47 G53 R54	A46-R50 WeakPolarHBondContact O-CB 3.41Å; A46-R50 PolarHBondContact O-N 2.71Å; D47-R50 PolarHBondContact O-N 3.29Å; R50-G53 PolarHBondContact O-N 3.41Å; R50-R54 PolarHBondContact O-N 2.97Å
51	A	76	Confident	76.8	Confident	14 Å²	14	93.6 Å²	93.6	12%	0.116	48%	0.478	C	S	.	.	H	α-helix	trans	-63.5	-43.5	177.7	0	0	0	0	0	111.6	E34 W43 D47 G53 R54 L55	E34-A51 VanDerWaalsContact OE2-CA 3.28Å; E34-A51 WeakPolarHBondContact OE2-CA 3.44Å; E34-A51 WeakPolarHBondContact OE2-CB 3.34Å; W43-A51 HydrophobicContact CE3-CB 4.35Å; W43-A51 HydrophobicContact CH2-CB 4.05Å; W43-A51 HydrophobicContact CZ3-CB 3.39Å; D47-A51 WeakPolarHBondContact O-CB 3.39Å; D47-A51 PolarHBondContact O-N 2.98Å; A51-G53 VanDerWaalsContact C-N 3.33Å; A51-G53 PolarHBondContact O-N 2.95Å; A51-R54 PolarHBondContact O-N 3.28Å; A51-L55 WeakPolarHBondContact O-CB 3.49Å; A51-L55 PolarHBondContact O-N 2.93Å
52	L	74.3	Confident	77.1	Confident	107 Å²	107	91.1 Å²	91.1	56%	0.56	47%	0.469	S	S	*	.	H	α-helix	trans	-60.7	-43.2	174	-167.2	78.7	0	0	0	111.3	K48 I49 R54 L55 V56	K48-L52 VanDerWaalsContact O-CB 3.3Å; K48-L52 WeakPolarHBondContact O-CB 3.24Å; K48-L52 PolarHBondContact O-N 3.42Å; I49-L52 PolarHBondContact O-N 3.43Å; L52-R54 VanDerWaalsContact C-N 3.29Å; L52-R54 PolarHBondContact O-N 3.2Å; L52-L55 WeakPolarHBondContact O-CB 3.42Å; L52-L55 PolarHBondContact O-N 2.81Å; L52-V56 VanDerWaalsContact O-CG2 3.31Å; L52-V56 WeakPolarHBondContact O-CG2 3.46Å; L52-V56 PolarHBondContact O-N 3.08Å
53	G	77.1	Confident	77.1	Confident	37 Å²	37	87.2 Å²	87.2	38%	0.381	45%	0.454	S	S	.	.	H	α-helix	trans	-63.2	-32.8	176.8	0	0	0	0	0	113.5	I49 R50 A51 K57	I49-G53 PolarHBondContact O-N 2.93Å; R50-G53 PolarHBondContact O-N 3.41Å; A51-G53 VanDerWaalsContact C-N 3.33Å; A51-G53 PolarHBondContact O-N 2.95Å; G53-K57 WeakPolarHBondContact O-CG 3.48Å; G53-K57 PolarHBondContact O-N 3.17Å
54	R	75.1	Confident	77	Confident	136 Å²	136	88.4 Å²	88.4	51%	0.513	46%	0.462	S	S	.	.	H	α-helix	trans	-76.8	-40.3	173.1	-81.9	170.5	170.8	-165.2	-2.9	112.2	E34 R50 A51 L52 V56 K57 N58	E34-R54 WeakPolarHBondContact OE1-CD 3.46Å; E34-R54 IonicContact OE1-CZ 2.99Å; E34-R54 IonicContact OE1-NE 3.4Å; E34-R54 PolarHBondContact OE1-NE 3.24Å; E34-R54 IonicContact OE1-NH1 3.64Å; E34-R54 PolarHBondContact OE1-NH1 3.16Å; R50-R54 PolarHBondContact O-N 2.97Å; A51-R54 PolarHBondContact O-N 3.28Å; L52-R54 VanDerWaalsContact C-N 3.29Å; L52-R54 PolarHBondContact O-N 3.2Å; R54-V56 VanDerWaalsContact C-N 3.33Å; R54-V56 PolarHBondContact O-N 2.92Å; R54-K57 WeakPolarHBondContact O-CB 3.38Å; R54-K57 PolarHBondContact O-N 2.78Å; R54-K57 VanDerWaalsContact O-N 3.1Å; R54-N58 PolarHBondContact O-N 2.91Å
55	L	72.9	Confident	76.6	Confident	55 Å²	55	92.7 Å²	92.7	29%	0.288	47%	0.47	S	S	.	.	H	α-helix	trans	-55.9	-50.3	174.1	-171.5	78.7	0	0	0	110.2	F27 A51 L52 K57 N58 C59	F27-L55 HydrophobicContact CE2-CD1 4.12Å; F27-L55 HydrophobicContact CZ-CD1 3.91Å; A51-L55 WeakPolarHBondContact O-CB 3.49Å; A51-L55 PolarHBondContact O-N 2.93Å; L52-L55 WeakPolarHBondContact O-CB 3.42Å; L52-L55 PolarHBondContact O-N 2.81Å; L55-K57 PolarHBondContact O-N 3.31Å; L55-N58 PolarHBondContact O-N 2.93Å; L55-N58 VanDerWaalsContact O-N 3.08Å; L55-C59 PolarHBondContact O-N 2.66Å; L55-C59 PolarHBondContact O-SG 3.31Å
56	V	75	Confident	76.8	Confident	73 Å²	73	91.1 Å²	91.1	44%	0.442	46%	0.458	S	S	.	.	H	α-helix	trans	-61.3	-32.5	178.2	173.3	0	0	0	0	112.4	L52 R54 L64	L52-V56 VanDerWaalsContact O-CG2 3.31Å; L52-V56 WeakPolarHBondContact O-CG2 3.46Å; L52-V56 PolarHBondContact O-N 3.08Å; R54-V56 VanDerWaalsContact C-N 3.33Å; R54-V56 PolarHBondContact O-N 2.92Å; V56-L64 HydrophobicContact CG1-CD2 4.38Å
57	K	77.3	Confident	76.7	Confident	178 Å²	178	92 Å²	92	77%	0.774	45%	0.454	S	S	*	.	H	α-helix	trans	-73.6	-29.1	176.2	-78.8	-178.7	178.7	-171.8	0	113.7	G53 R54 L55	G53-K57 WeakPolarHBondContact O-CG 3.48Å; G53-K57 PolarHBondContact O-N 3.17Å; R54-K57 WeakPolarHBondContact O-CB 3.38Å; R54-K57 PolarHBondContact O-N 2.78Å; R54-K57 VanDerWaalsContact O-N 3.1Å; L55-K57 PolarHBondContact O-N 3.31Å
58	N	78.3	Confident	76.5	Confident	122 Å²	122	94.4 Å²	94.4	65%	0.652	46%	0.463	S	S	*	.	H	α-helix	trans	-95.1	-12.9	-177.6	-66.5	-10.5	0	0	0	112.6	R54 L55	R54-N58 PolarHBondContact O-N 2.91Å; L55-N58 PolarHBondContact O-N 2.93Å; L55-N58 VanDerWaalsContact O-N 3.08Å
59	C	73.7	Confident	76.5	Confident	24 Å²	24	96.6 Å²	96.6	16%	0.162	47%	0.473	C	S	.	.			trans	-70.3	132.2	179	-76.7	0	0	0	0	112.1	L55 Q63 L64	L55-C59 PolarHBondContact O-N 2.66Å; L55-C59 PolarHBondContact O-SG 3.31Å; C59-Q63 VanDerWaalsContact CA-OE1 3.23Å; C59-Q63 HydrophobicContact CB-CB 4.02Å; C59-L64 HydrophobicContact CB-CD2 3.85Å; C59-L64 HydrophobicContact CB-CG 3.77Å
60	S	82.2	Confident	76.5	Confident	53 Å²	53	95 Å²	95	37%	0.371	47%	0.469	S	S	.	.			trans	-64.7	159	167	77	0	0	0	0	110.8	I62 Q63 L64	S60-I62 PolarHBondContact O-N 2.9Å; S60-I62 VanDerWaalsContact O-N 3.12Å; S60-I62 PolarHBondContact OG-N 2.76Å; S60-Q63 PolarHBondContact O-N 3.31Å; S60-Q63 WeakPolarHBondContact OG-CG 3.11Å; S60-Q63 PolarHBondContact OG-N 3.16Å; S60-L64 PolarHBondContact O-N 3.29Å
61	L	77.1	Confident	76.2	Confident	131 Å²	131	90.9 Å²	90.9	69%	0.686	46%	0.458	S	S	*	.	H	α-helix	trans	-54.9	-30.2	174.4	-100	159.1	0	0	0	112.7	R65	L61-R65 VanDerWaalsContact O-CG 3.31Å; L61-R65 WeakPolarHBondContact O-CG 3.32Å; L61-R65 PolarHBondContact O-N 3.09Å; L61-R65 VanDerWaalsContact O-N 3.11Å
62	I	80.4	Confident	75.7	Confident	112 Å²	112	93.7 Å²	93.7	57%	0.574	47%	0.469	S	S	*	.	H	α-helix	trans	-70.7	-46.7	176.7	-62	168.8	0	0	0	110	S60 L64 R65 E66	S60-I62 PolarHBondContact O-N 2.9Å; S60-I62 VanDerWaalsContact O-N 3.12Å; S60-I62 PolarHBondContact OG-N 2.76Å; I62-L64 VanDerWaalsContact C-N 3.34Å; I62-L64 PolarHBondContact O-N 3.44Å; I62-R65 WeakPolarHBondContact O-CB 3.22Å; I62-R65 PolarHBondContact O-N 3.28Å; I62-R65 VanDerWaalsContact O-N 3.16Å; I62-E66 PolarHBondContact O-N 3.28Å
63	Q	79.1	Confident	75.3	Confident	72 Å²	72	92 Å²	92	34%	0.336	46%	0.464	S	S	.	.	H	α-helix	trans	-62.9	-39.7	177.2	-71.1	170	-19.9	0	0	112.1	C59 S60 R65 E66 L67	C59-Q63 VanDerWaalsContact CA-OE1 3.23Å; C59-Q63 HydrophobicContact CB-CB 4.02Å; S60-Q63 PolarHBondContact O-N 3.31Å; S60-Q63 WeakPolarHBondContact OG-CG 3.11Å; S60-Q63 PolarHBondContact OG-N 3.16Å; Q63-R65 VanDerWaalsContact C-N 3.34Å; Q63-E66 PolarHBondContact O-N 3.15Å; Q63-L67 WeakPolarHBondContact O-CB 3.35Å; Q63-L67 PolarHBondContact O-N 3.25Å
64	L	76.2	Confident	74.5	Confident	58 Å²	58	97.7 Å²	97.7	30%	0.304	48%	0.475	S	S	.	.	H	α-helix	trans	-64.9	-37.4	174.2	-72.3	174.8	0	0	0	112.3	V56 C59 S60 I62 H68	V56-L64 HydrophobicContact CG1-CD2 4.38Å; C59-L64 HydrophobicContact CB-CD2 3.85Å; C59-L64 HydrophobicContact CB-CG 3.77Å; S60-L64 PolarHBondContact O-N 3.29Å; I62-L64 VanDerWaalsContact C-N 3.34Å; I62-L64 PolarHBondContact O-N 3.44Å; L64-H68 VanDerWaalsContact O-CB 3.29Å; L64-H68 WeakPolarHBondContact O-CB 3.35Å; L64-H68 PolarHBondContact O-N 3.4Å
65	R	76.4	Confident	73.7	Confident	166 Å²	166	96.9 Å²	96.9	63%	0.626	48%	0.475	S	S	*	.	H	α-helix	trans	-66	-41.1	175.2	-79.9	175.1	177.8	173.9	0.9	112.1	L61 I62 Q63 H68 K69	L61-R65 VanDerWaalsContact O-CG 3.31Å; L61-R65 WeakPolarHBondContact O-CG 3.32Å; L61-R65 PolarHBondContact O-N 3.09Å; L61-R65 VanDerWaalsContact O-N 3.11Å; I62-R65 WeakPolarHBondContact O-CB 3.22Å; I62-R65 PolarHBondContact O-N 3.28Å; I62-R65 VanDerWaalsContact O-N 3.16Å; Q63-R65 VanDerWaalsContact C-N 3.34Å; R65-H68 PolarHBondContact O-N 3Å; R65-K69 WeakPolarHBondContact O-CG 3.49Å; R65-K69 PolarHBondContact O-N 3.16Å
66	E	78.2	Confident	73.2	Confident	90 Å²	90	101.6 Å²	101.6	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-69.9	-39.1	176.3	-71.3	-51.3	136	0	0	112.4	I62 Q63 H68 K69 T70	I62-E66 PolarHBondContact O-N 3.28Å; Q63-E66 PolarHBondContact O-N 3.15Å; E66-H68 VanDerWaalsContact C-N 3.32Å; E66-H68 PolarHBondContact O-N 3.15Å; E66-K69 PolarHBondContact O-N 3.12Å; E66-K69 IonicContact OE1-NZ 2.78Å; E66-K69 PolarHBondContact OE1-NZ 2.96Å; E66-T70 WeakPolarHBondContact O-CB 3.4Å; E66-T70 PolarHBondContact O-N 3.44Å; E66-T70 PolarHBondContact O-OG1 2.73Å
67	L	75.6	Confident	73	Confident	78 Å²	78	106.2 Å²	106.2	41%	0.408	51%	0.505	S	S	.	.	H	α-helix	trans	-57.8	-47.8	170.7	-168.6	88.8	0	0	0	110.6	Q63 T70 I71	Q63-L67 WeakPolarHBondContact O-CB 3.35Å; Q63-L67 PolarHBondContact O-N 3.25Å; L67-T70 PolarHBondContact O-N 3.2Å; L67-I71 HydrophobicContact CD1-CD1 4.21Å; L67-I71 HydrophobicContact CD2-CD1 3.98Å; L67-I71 HydrophobicContact CG-CD1 3.67Å; L67-I71 HydrophobicContact CG-CG1 4.49Å; L67-I71 VanDerWaalsContact O-CB 3.32Å; L67-I71 WeakPolarHBondContact O-CB 3.49Å; L67-I71 WeakPolarHBondContact O-CG1 3.23Å; L67-I71 PolarHBondContact O-N 3.47Å
68	H	71.9	Confident	73.2	Confident	113 Å²	113	100.4 Å²	100.4	52%	0.523	48%	0.483	S	S	.	.	H	α-helix	trans	-60.9	-48.5	177.8	-176.3	64.9	0	0	0	111.6	L64 R65 E66 T70 I71 E72	L64-H68 VanDerWaalsContact O-CB 3.29Å; L64-H68 WeakPolarHBondContact O-CB 3.35Å; L64-H68 PolarHBondContact O-N 3.4Å; R65-H68 PolarHBondContact O-N 3Å; E66-H68 VanDerWaalsContact C-N 3.32Å; E66-H68 PolarHBondContact O-N 3.15Å; H68-T70 VanDerWaalsContact C-N 3.26Å; H68-T70 PolarHBondContact O-N 2.94Å; H68-I71 PolarHBondContact O-N 3.31Å; H68-E72 IonicContact CE1-OE2 2.6Å; H68-E72 PolarHBondContact CE1-OE2 2.92Å; H68-E72 IonicContact ND1-OE2 3.89Å; H68-E72 IonicContact NE2-OE2 3.07Å; H68-E72 WeakPolarHBondContact O-CB 3.22Å; H68-E72 PolarHBondContact O-N 3.03Å
69	K	77.7	Confident	73.5	Confident	132 Å²	132	98.4 Å²	98.4	57%	0.574	47%	0.468	S	S	*	.	H	α-helix	trans	-58.3	-35.5	175.2	-77.4	178.8	-174	167.9	0	113.4	R65 E66 P73	R65-K69 WeakPolarHBondContact O-CG 3.49Å; R65-K69 PolarHBondContact O-N 3.16Å; E66-K69 PolarHBondContact O-N 3.12Å; E66-K69 IonicContact OE1-NZ 2.78Å; E66-K69 PolarHBondContact OE1-NZ 2.96Å; K69-P73 WeakPolarHBondContact O-CD 3.47Å
70	T	75.9	Confident	74.2	Confident	91 Å²	91	97.8 Å²	97.8	56%	0.558	46%	0.463	S	S	*	.	H	α-helix	trans	-73.6	-35.6	179.6	-54.1	0	0	0	0	111.6	E66 L67 H68 Y74	E66-T70 WeakPolarHBondContact O-CB 3.4Å; E66-T70 PolarHBondContact O-N 3.44Å; E66-T70 PolarHBondContact O-OG1 2.73Å; L67-T70 PolarHBondContact O-N 3.2Å; H68-T70 VanDerWaalsContact C-N 3.26Å; H68-T70 PolarHBondContact O-N 2.94Å; T70-Y74 WeakPolarHBondContact O-CD2 3.39Å; T70-Y74 WeakPolarHBondContact O-CE2 3.29Å
71	I	69.2	Low	74.4	Confident	67 Å²	67	97.2 Å²	97.2	34%	0.344	46%	0.459	S	S	.	.	H	α-helix	trans	-85	-37.4	-175.7	-70.8	177.5	0	0	0	111.8	L67 H68 P73 Y74 F75	L67-I71 HydrophobicContact CD1-CD1 4.21Å; L67-I71 HydrophobicContact CD2-CD1 3.98Å; L67-I71 HydrophobicContact CG-CD1 3.67Å; L67-I71 HydrophobicContact CG-CG1 4.49Å; L67-I71 VanDerWaalsContact O-CB 3.32Å; L67-I71 WeakPolarHBondContact O-CB 3.49Å; L67-I71 WeakPolarHBondContact O-CG1 3.23Å; L67-I71 PolarHBondContact O-N 3.47Å; H68-I71 PolarHBondContact O-N 3.31Å; I71-P73 VanDerWaalsContact C-CD 3.45Å; I71-Y74 WeakPolarHBondContact O-CA 3.06Å; I71-Y74 WeakPolarHBondContact O-CB 3.44Å; I71-Y74 PolarHBondContact O-N 3.19Å; I71-F75 HydrophobicContact CG2-CD2 3.29Å; I71-F75 HydrophobicContact CG2-CE2 3.18Å; I71-F75 HydrophobicContact CG2-CZ 4.43Å; I71-F75 PolarHBondContact O-N 3.45Å
72	E	65.4	Low	74.8	Confident	73 Å²	73	97.7 Å²	97.7	34%	0.341	46%	0.458	S	S	.	.	H	α-helix	trans	-51.7	-42.6	-174.6	-172.9	64.7	-161.1	0	0	114.2	H68 Y74 F75 Q76	H68-E72 IonicContact CE1-OE2 2.6Å; H68-E72 PolarHBondContact CE1-OE2 2.92Å; H68-E72 IonicContact ND1-OE2 3.89Å; H68-E72 IonicContact NE2-OE2 3.07Å; H68-E72 WeakPolarHBondContact O-CB 3.22Å; H68-E72 PolarHBondContact O-N 3.03Å; E72-Y74 PolarHBondContact O-N 2.89Å; E72-F75 CarbonylContact O-C 3.41Å; E72-F75 WeakPolarHBondContact O-CA 3.47Å; E72-F75 WeakPolarHBondContact O-CB 3.36Å; E72-F75 PolarHBondContact O-N 3.39Å; E72-Q76 WeakPolarHBondContact O-CG 3.22Å; E72-Q76 PolarHBondContact O-N 3.36Å
73	P	67	Low	75.2	Confident	71 Å²	71	94 Å²	94	46%	0.461	44%	0.439	S	S	.	.	H	α-helix	trans	-62.8	-26	176.9	-22.8	34.2	0	0	0	113.9	K69 I71	K69-P73 WeakPolarHBondContact O-CD 3.47Å; I71-P73 VanDerWaalsContact C-CD 3.45Å
74	Y	60.1	Low	75.8	Confident	156 Å²	156	94.1 Å²	94.1	61%	0.612	45%	0.446	S	S	*	.	H	α-helix	trans	-80.4	-25.2	174.5	-63.3	-85.6	0	0	0	112.1	T70 I71 E72	T70-Y74 WeakPolarHBondContact O-CD2 3.39Å; T70-Y74 WeakPolarHBondContact O-CE2 3.29Å; I71-Y74 WeakPolarHBondContact O-CA 3.06Å; I71-Y74 WeakPolarHBondContact O-CB 3.44Å; I71-Y74 PolarHBondContact O-N 3.19Å; E72-Y74 PolarHBondContact O-N 2.89Å
75	F	58.7	Low	76.5	Confident	120 Å²	120	96.4 Å²	96.4	53%	0.526	45%	0.454	S	S	.	.	H	α-helix	trans	-80	-22.4	170.9	-84.7	-95	0	0	0	113.2	I71 E72 R77	I71-F75 HydrophobicContact CG2-CD2 3.29Å; I71-F75 HydrophobicContact CG2-CE2 3.18Å; I71-F75 HydrophobicContact CG2-CZ 4.43Å; I71-F75 PolarHBondContact O-N 3.45Å; E72-F75 CarbonylContact O-C 3.41Å; E72-F75 WeakPolarHBondContact O-CA 3.47Å; E72-F75 WeakPolarHBondContact O-CB 3.36Å; E72-F75 PolarHBondContact O-N 3.39Å; F75-R77 PolarHBondContact O-N 2.89Å
76	Q	62.8	Low	77.2	Confident	154 Å²	154	95.2 Å²	95.2	72%	0.72	46%	0.455	S	S	*	.	S	Bend	trans	-71.1	-19.1	171.3	-69.8	-100.4	-30.3	0	0	113	E72	E72-Q76 WeakPolarHBondContact O-CG 3.22Å; E72-Q76 PolarHBondContact O-N 3.36Å
77	R	69.9	Low	77.8	Confident	170 Å²	170	94.8 Å²	94.8	64%	0.642	46%	0.455	S	S	*	.	S	Bend	trans	-91.3	161	172.2	-65.4	-176.6	179.3	-179.6	1	109.6	F75 F79	F75-R77 PolarHBondContact O-N 2.89Å; R77-F79 PolarHBondContact O-N 2.75Å
78	D	81.1	Confident	78.6	Confident	55 Å²	55	91.1 Å²	91.1	29%	0.294	44%	0.435	S	S	.	.			trans	-64.3	85.8	175	-176.3	-7.3	0	0	0	110.7	I80 S81 H82 W110	D78-I80 VanDerWaalsContact C-N 3.3Å; D78-I80 PolarHBondContact O-N 3.38Å; D78-I80 PolarHBondContact OD1-N 2.9Å; D78-S81 PolarHBondContact O-N 2.99Å; D78-S81 VanDerWaalsContact O-N 3.11Å; D78-S81 PolarHBondContact OD1-N 3.44Å; D78-S81 VanDerWaalsContact OD1-N 3.1Å; D78-S81 PolarHBondContact OD1-OG 2.84Å; D78-S81 VanDerWaalsContact OD2-CB 3.25Å; D78-S81 WeakPolarHBondContact OD2-CB 3.29Å; D78-S81 PolarHBondContact OD2-OG 3Å; D78-H82 PolarHBondContact O-CD2 2.9Å; D78-H82 PolarHBondContact O-N 3.23Å; D78-W110 PolarHBondContact OD1-NE1 3.37Å; D78-W110 PolarHBondContact OD2-NE1 3.26Å
79	F	85.1	Confident	79.6	Confident	80 Å²	80	86.3 Å²	86.3	35%	0.351	41%	0.414	S	S	.	.	H	α-helix	trans	-57.2	-42.5	-175	176.4	-101.6	0	0	0	111.7	R77 S81 H82 L83 I91	R77-F79 PolarHBondContact O-N 2.75Å; F79-S81 VanDerWaalsContact C-N 3.32Å; F79-S81 PolarHBondContact O-N 3.22Å; F79-H82 PolarHBondContact O-N 3.46Å; F79-H82 VanDerWaalsContact O-N 3.17Å; F79-L83 HydrophobicContact CD1-CD1 3.92Å; F79-L83 HydrophobicContact CD1-CG 4.45Å; F79-L83 HydrophobicContact CE1-CD1 3.47Å; F79-L83 VanDerWaalsContact CE1-CD1 3.47Å; F79-L83 HydrophobicContact CE1-CD2 4.41Å; F79-L83 HydrophobicContact CE1-CG 4.14Å; F79-L83 HydrophobicContact CE2-CD2 4.43Å; F79-L83 HydrophobicContact CZ-CD1 3.95Å; F79-L83 HydrophobicContact CZ-CD2 4.05Å; F79-L83 HydrophobicContact CZ-CG 4.24Å; F79-L83 WeakPolarHBondContact O-CG 3.32Å; F79-L83 PolarHBondContact O-N 2.9Å; F79-I91 HydrophobicContact CE1-CD1 4.09Å
80	I	88.4	Confident	80.2	Confident	12 Å²	12	85.5 Å²	85.5	6%	0.062	41%	0.408	C	S	.	.	H	α-helix	trans	-63.4	-38.8	178.8	-67	-62	0	0	0	111.1	D78 H82 L83 A88 I91 W110 L113	D78-I80 VanDerWaalsContact C-N 3.3Å; D78-I80 PolarHBondContact O-N 3.38Å; D78-I80 PolarHBondContact OD1-N 2.9Å; I80-H82 PolarHBondContact O-N 2.72Å; I80-L83 HydrophobicContact CD1-CD1 4.42Å; I80-L83 PolarHBondContact O-N 3.42Å; I80-A88 HydrophobicContact CG2-CB 4.08Å; I80-I91 HydrophobicContact CD1-CB 4.33Å; I80-I91 HydrophobicContact CD1-CD1 4.24Å; I80-I91 HydrophobicContact CD1-CG2 3.99Å; I80-W110 HydrophobicContact CB-CH2 4.18Å; I80-W110 HydrophobicContact CB-CZ2 3.5Å; I80-W110 HydrophobicContact CG1-CH2 3.58Å; I80-W110 HydrophobicContact CG1-CZ2 3.38Å; I80-W110 HydrophobicContact CG1-CZ3 4.42Å; I80-W110 HydrophobicContact CG2-CD2 4.44Å; I80-W110 HydrophobicContact CG2-CZ2 4.18Å; I80-L113 HydrophobicContact CG2-CD1 3.56Å
81	S	86.7	Confident	80.9	Confident	41 Å²	41	84 Å²	84	29%	0.287	40%	0.396	S	S	.	.	H	α-helix	trans	-68.3	-19.7	177.3	-72.4	0	0	0	0	114.3	D78 F79 Y109	D78-S81 PolarHBondContact O-N 2.99Å; D78-S81 VanDerWaalsContact O-N 3.11Å; D78-S81 PolarHBondContact OD1-N 3.44Å; D78-S81 VanDerWaalsContact OD1-N 3.1Å; D78-S81 PolarHBondContact OD1-OG 2.84Å; D78-S81 VanDerWaalsContact OD2-CB 3.25Å; D78-S81 WeakPolarHBondContact OD2-CB 3.29Å; D78-S81 PolarHBondContact OD2-OG 3Å; F79-S81 VanDerWaalsContact C-N 3.32Å; F79-S81 PolarHBondContact O-N 3.22Å; S81-Y109 WeakPolarHBondContact OG-CD1 3.25Å
82	H	85.4	Confident	82	Confident	140 Å²	140	81 Å²	81	65%	0.648	38%	0.38	S	S	*	.	H	α-helix	trans	-95.6	-10.2	178.6	-70.6	-61.6	0	0	0	114.4	D78 F79 I80	D78-H82 PolarHBondContact O-CD2 2.9Å; D78-H82 PolarHBondContact O-N 3.23Å; F79-H82 PolarHBondContact O-N 3.46Å; F79-H82 VanDerWaalsContact O-N 3.17Å; I80-H82 PolarHBondContact O-N 2.72Å
83	L	87.8	Confident	83.2	Confident	35 Å²	35	78.4 Å²	78.4	18%	0.183	37%	0.37	C	S	.	.	S	Bend	trans	-80.7	151.2	178.1	-72.5	175.8	0	0	0	112.3	F79 I80 K85 I87 A88 I91	F79-L83 HydrophobicContact CD1-CD1 3.92Å; F79-L83 HydrophobicContact CD1-CG 4.45Å; F79-L83 HydrophobicContact CE1-CD1 3.47Å; F79-L83 VanDerWaalsContact CE1-CD1 3.47Å; F79-L83 HydrophobicContact CE1-CD2 4.41Å; F79-L83 HydrophobicContact CE1-CG 4.14Å; F79-L83 HydrophobicContact CE2-CD2 4.43Å; F79-L83 HydrophobicContact CZ-CD1 3.95Å; F79-L83 HydrophobicContact CZ-CD2 4.05Å; F79-L83 HydrophobicContact CZ-CG 4.24Å; F79-L83 WeakPolarHBondContact O-CG 3.32Å; F79-L83 PolarHBondContact O-N 2.9Å; I80-L83 HydrophobicContact CD1-CD1 4.42Å; I80-L83 PolarHBondContact O-N 3.42Å; L83-K85 PolarHBondContact O-N 3.22Å; L83-I87 HydrophobicContact CB-CB 4.49Å; L83-I87 HydrophobicContact CD1-CG2 3.99Å; L83-I87 HydrophobicContact CD2-CG2 4.3Å; L83-A88 HydrophobicContact CB-CB 4.31Å; L83-I91 HydrophobicContact CD1-CD1 3.37Å
84	P	91.8	Very high	84.3	Confident	74 Å²	74	81.7 Å²	81.7	48%	0.481	38%	0.378	S	S	.	.			trans	-50.1	137.4	160.8	-24.4	33.5	0	0	0	110.5	E86 I87 A88	P84-E86 PolarHBondContact O-N 3.38Å; P84-E86 VanDerWaalsContact O-N 3.08Å; P84-I87 HydrophobicContact CB-CD1 4.34Å; P84-I87 HydrophobicContact CB-CG1 4.27Å; P84-I87 HydrophobicContact CG-CD1 4.03Å; P84-I87 HydrophobicContact CG-CG1 4.49Å; P84-I87 PolarHBondContact O-N 2.83Å; P84-A88 PolarHBondContact O-N 3.27Å
85	K	91	Very high	85.7	Confident	107 Å²	107	76.9 Å²	76.9	47%	0.465	36%	0.362	S	S	.	.	H	α-helix	trans	-53.6	-37.2	-171.9	-175.5	177	-178.7	179.8	0	112.5	L83 A88 L89 L113	L83-K85 PolarHBondContact O-N 3.22Å; K85-A88 PolarHBondContact O-N 3.39Å; K85-L89 HydrophobicContact CG-CD1 4.07Å; K85-L89 HydrophobicContact CG-CG 4.4Å; K85-L89 WeakPolarHBondContact O-CB 3.4Å; K85-L89 VanDerWaalsContact O-CG 3.24Å; K85-L89 WeakPolarHBondContact O-CG 3.48Å; K85-L89 PolarHBondContact O-N 3.01Å; K85-L113 HydrophobicContact CG-CD2 3.88Å
86	E	90.9	Very high	87.2	Confident	140 Å²	140	73 Å²	73	65%	0.654	35%	0.35	S	S	*	.	H	α-helix	trans	-64.5	-41.6	179.6	-60.2	70.9	-153.1	0	0	111.7	P84 Y90	P84-E86 PolarHBondContact O-N 3.38Å; P84-E86 VanDerWaalsContact O-N 3.08Å; E86-Y90 WeakPolarHBondContact O-CB 3.49Å; E86-Y90 PolarHBondContact O-N 3.43Å
87	I	91.2	Very high	88.3	Confident	82 Å²	82	67.5 Å²	67.5	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-70.7	-43.2	178.3	-55.6	-176.4	0	0	0	109.6	L83 P84 L89 Y90 I91	L83-I87 HydrophobicContact CB-CB 4.49Å; L83-I87 HydrophobicContact CD1-CG2 3.99Å; L83-I87 HydrophobicContact CD2-CG2 4.3Å; P84-I87 HydrophobicContact CB-CD1 4.34Å; P84-I87 HydrophobicContact CB-CG1 4.27Å; P84-I87 HydrophobicContact CG-CD1 4.03Å; P84-I87 HydrophobicContact CG-CG1 4.49Å; P84-I87 PolarHBondContact O-N 2.83Å; I87-L89 PolarHBondContact O-N 3.17Å; I87-Y90 WeakPolarHBondContact O-CB 3.36Å; I87-Y90 PolarHBondContact O-N 3.23Å; I87-I91 HydrophobicContact CG2-CD1 4.1Å; I87-I91 WeakPolarHBondContact O-CG1 3.41Å; I87-I91 PolarHBondContact O-N 2.96Å
88	A	92.7	Very high	89.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-57.3	-48.5	174.6	0	0	0	0	0	111.7	I80 L83 P84 K85 Y90 I91 L92 L113	I80-A88 HydrophobicContact CG2-CB 4.08Å; L83-A88 HydrophobicContact CB-CB 4.31Å; P84-A88 PolarHBondContact O-N 3.27Å; K85-A88 PolarHBondContact O-N 3.39Å; A88-Y90 VanDerWaalsContact C-N 3.33Å; A88-Y90 PolarHBondContact O-N 3.02Å; A88-I91 PolarHBondContact O-N 3.08Å; A88-L92 VanDerWaalsContact O-CG 3.29Å; A88-L92 WeakPolarHBondContact O-CG 3.48Å; A88-L92 PolarHBondContact O-N 3.49Å; A88-L113 HydrophobicContact CB-CD1 3.85Å
89	L	92.6	Very high	89.7	Confident	13 Å²	13	66.4 Å²	66.4	7%	0.068	34%	0.335	C	S	.	.	H	α-helix	trans	-64.4	-35.6	176.6	-69.9	173.6	0	0	0	112.7	K85 I87 S93 L113 S116 F118 L119	K85-L89 HydrophobicContact CG-CD1 4.07Å; K85-L89 HydrophobicContact CG-CG 4.4Å; K85-L89 WeakPolarHBondContact O-CB 3.4Å; K85-L89 VanDerWaalsContact O-CG 3.24Å; K85-L89 WeakPolarHBondContact O-CG 3.48Å; K85-L89 PolarHBondContact O-N 3.01Å; I87-L89 PolarHBondContact O-N 3.17Å; L89-S93 PolarHBondContact O-N 3.1Å; L89-L113 HydrophobicContact CD2-CB 4.31Å; L89-L113 HydrophobicContact CD2-CD2 4Å; L89-L113 WeakPolarHBondContact CD2-O 3.5Å; L89-L113 HydrophobicContact CG-CD2 4.2Å; L89-S116 VanDerWaalsContact CD2-CB 3.5Å; L89-F118 HydrophobicContact CD1-CD1 4.38Å; L89-L119 HydrophobicContact CD2-CB 4.17Å
90	Y	89.7	Confident	90.1	Very high	114 Å²	114	62.6 Å²	62.6	45%	0.447	32%	0.318	S	S	.	.	H	α-helix	trans	-63.8	-46.1	174.6	-179.3	-105.3	0	0	0	111.6	E86 I87 A88 S93 F94	E86-Y90 WeakPolarHBondContact O-CB 3.49Å; E86-Y90 PolarHBondContact O-N 3.43Å; I87-Y90 WeakPolarHBondContact O-CB 3.36Å; I87-Y90 PolarHBondContact O-N 3.23Å; A88-Y90 VanDerWaalsContact C-N 3.33Å; A88-Y90 PolarHBondContact O-N 3.02Å; Y90-S93 WeakPolarHBondContact O-CB 3.48Å; Y90-S93 PolarHBondContact O-N 3.39Å; Y90-S93 VanDerWaalsContact O-N 3.13Å; Y90-S93 PolarHBondContact O-OG 3.08Å; Y90-F94 AromaticContact CD1-CE2 3.87Å; Y90-F94 HydrophobicContact CD1-CE2 3.87Å; Y90-F94 HydrophobicContact CD2-CE2 4.43Å; Y90-F94 AromaticContact CE1-CE2 3.48Å; Y90-F94 HydrophobicContact CE1-CE2 3.48Å; Y90-F94 VanDerWaalsContact CE1-CE2 3.48Å; Y90-F94 AromaticContact CE1-CZ 3.92Å; Y90-F94 HydrophobicContact CE1-CZ 3.92Å; Y90-F94 HydrophobicContact CE2-CE2 4.1Å; Y90-F94 HydrophobicContact CE2-CZ 4.19Å; Y90-F94 HydrophobicContact CG-CE2 4.34Å; Y90-F94 AromaticContact CZ-CE2 3.6Å; Y90-F94 AromaticContact CZ-CZ 3.62Å; Y90-F94 WeakPolarHBondContact O-CD2 3.41Å; Y90-F94 WeakPolarHBondContact O-CE2 3.28Å
91	I	91	Very high	90.1	Very high	61 Å²	61	63.8 Å²	63.8	31%	0.313	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-47.9	175.6	-66.9	167.5	0	0	0	110.4	F79 I80 L83 I87 A88 S93 F94	F79-I91 HydrophobicContact CE1-CD1 4.09Å; I80-I91 HydrophobicContact CD1-CB 4.33Å; I80-I91 HydrophobicContact CD1-CD1 4.24Å; I80-I91 HydrophobicContact CD1-CG2 3.99Å; L83-I91 HydrophobicContact CD1-CD1 3.37Å; I87-I91 HydrophobicContact CG2-CD1 4.1Å; I87-I91 WeakPolarHBondContact O-CG1 3.41Å; I87-I91 PolarHBondContact O-N 2.96Å; A88-I91 PolarHBondContact O-N 3.08Å; I91-S93 PolarHBondContact O-N 2.83Å; I91-S93 VanDerWaalsContact O-N 3.16Å; I91-F94 PolarHBondContact O-N 3.14Å; I91-F94 VanDerWaalsContact O-N 3.11Å
92	L	92.7	Very high	90.4	Very high	3 Å²	3	66.7 Å²	66.7	2%	0.016	35%	0.347	C	S	.	.	H	α-helix	trans	-61.5	-24.4	177.9	-68	177	0	0	0	112.7	A88 F94 L95 L100 W110 L113 L119	A88-L92 VanDerWaalsContact O-CG 3.29Å; A88-L92 WeakPolarHBondContact O-CG 3.48Å; A88-L92 PolarHBondContact O-N 3.49Å; L92-F94 PolarHBondContact O-N 3.47Å; L92-L95 HydrophobicContact CD2-CD1 3.65Å; L92-L95 WeakPolarHBondContact O-CB 3.48Å; L92-L95 PolarHBondContact O-N 3.38Å; L92-L95 VanDerWaalsContact O-N 3.13Å; L92-L100 HydrophobicContact CB-CD2 4.05Å; L92-L100 HydrophobicContact CD2-CD2 4.29Å; L92-W110 HydrophobicContact CD2-CZ3 4.46Å; L92-L113 HydrophobicContact CD1-CB 3.57Å; L92-L113 HydrophobicContact CD1-CD1 4.26Å; L92-L119 HydrophobicContact CB-CD1 4.12Å; L92-L119 HydrophobicContact CB-CD2 4.09Å
93	S	90.3	Very high	90.7	Very high	18 Å²	18	60.4 Å²	60.4	13%	0.126	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-12.8	177.6	78.9	0	0	0	0	114.7	L89 Y90 I91 L119	L89-S93 PolarHBondContact O-N 3.1Å; Y90-S93 WeakPolarHBondContact O-CB 3.48Å; Y90-S93 PolarHBondContact O-N 3.39Å; Y90-S93 VanDerWaalsContact O-N 3.13Å; Y90-S93 PolarHBondContact O-OG 3.08Å; I91-S93 PolarHBondContact O-N 2.83Å; I91-S93 VanDerWaalsContact O-N 3.16Å; S93-L119 VanDerWaalsContact CA-CD1 3.49Å
94	F	89.4	Confident	90.8	Very high	140 Å²	140	59.5 Å²	59.5	61%	0.614	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-11.4	172.3	-66.7	-80.9	0	0	0	113.5	Y90 I91 L92	Y90-F94 AromaticContact CD1-CE2 3.87Å; Y90-F94 HydrophobicContact CD1-CE2 3.87Å; Y90-F94 HydrophobicContact CD2-CE2 4.43Å; Y90-F94 AromaticContact CE1-CE2 3.48Å; Y90-F94 HydrophobicContact CE1-CE2 3.48Å; Y90-F94 VanDerWaalsContact CE1-CE2 3.48Å; Y90-F94 AromaticContact CE1-CZ 3.92Å; Y90-F94 HydrophobicContact CE1-CZ 3.92Å; Y90-F94 HydrophobicContact CE2-CE2 4.1Å; Y90-F94 HydrophobicContact CE2-CZ 4.19Å; Y90-F94 HydrophobicContact CG-CE2 4.34Å; Y90-F94 AromaticContact CZ-CE2 3.6Å; Y90-F94 AromaticContact CZ-CZ 3.62Å; Y90-F94 WeakPolarHBondContact O-CD2 3.41Å; Y90-F94 WeakPolarHBondContact O-CE2 3.28Å; I91-F94 PolarHBondContact O-N 3.14Å; I91-F94 VanDerWaalsContact O-N 3.11Å; L92-F94 PolarHBondContact O-N 3.47Å
95	L	91.1	Very high	90.8	Very high	55 Å²	55	63.6 Å²	63.6	29%	0.288	33%	0.33	S	S	.	.	S	Bend	trans	-80.1	142.9	178.6	-61.7	-177.1	0	0	0	110.9	L92 E99 L100 A103	L92-L95 HydrophobicContact CD2-CD1 3.65Å; L92-L95 WeakPolarHBondContact O-CB 3.48Å; L92-L95 PolarHBondContact O-N 3.38Å; L92-L95 VanDerWaalsContact O-N 3.13Å; L95-E99 HydrophobicContact CB-CB 3.96Å; L95-E99 HydrophobicContact CD2-CB 4.31Å; L95-E99 HydrophobicContact CG-CB 4.49Å; L95-L100 HydrophobicContact CB-CD2 4.01Å; L95-L100 HydrophobicContact CB-CG 3.91Å; L95-L100 HydrophobicContact CD1-CD2 4.11Å; L95-A103 HydrophobicContact CD1-CB 4.5Å
96	S	88.7	Confident	90.7	Very high	40 Å²	40	62.5 Å²	62.5	28%	0.28	33%	0.333	S	S	.	.			trans	-63.2	156	167.3	66.4	0	0	0	0	110.8	T98 E99 L100	S96-T98 PolarHBondContact O-N 2.94Å; S96-T98 PolarHBondContact OG-OG1 3.13Å; S96-E99 VanDerWaalsContact CB-OE2 3.23Å; S96-E99 WeakPolarHBondContact CB-OE2 3.23Å; S96-E99 PolarHBondContact N-OE2 2.92Å; S96-E99 CarbonylContact O-C 3.56Å; S96-E99 WeakPolarHBondContact O-CB 3.48Å; S96-E99 PolarHBondContact O-N 3.26Å; S96-E99 WeakPolarHBondContact OG-CB 3.43Å; S96-E99 VanDerWaalsContact OG-CG 3.23Å; S96-E99 WeakPolarHBondContact OG-CG 3.35Å; S96-E99 PolarHBondContact OG-N 3.11Å; S96-E99 PolarHBondContact OG-OE2 3.13Å; S96-L100 WeakPolarHBondContact O-CG 3.48Å; S96-L100 PolarHBondContact O-N 3.01Å
97	P	86	Confident	90.7	Very high	37 Å²	37	58.2 Å²	58.2	24%	0.24	32%	0.317	C	S	.	.	H	α-helix	trans	-56.2	-32.6	175.4	-21.8	27.5	0	0	0	114	L100 A101 W120 Y153	P97-L100 PolarHBondContact O-N 3.4Å; P97-A101 WeakPolarHBondContact O-CB 3.41Å; P97-A101 PolarHBondContact O-N 3.16Å; P97-W120 HydrophobicContact CB-CH2 4.07Å; P97-W120 HydrophobicContact CB-CZ3 4.35Å; P97-Y153 HydrophobicContact CB-CE1 3.82Å; P97-Y153 HydrophobicContact CG-CD1 4.25Å; P97-Y153 HydrophobicContact CG-CE1 3.27Å; P97-Y153 HydrophobicContact CG-CE2 4.29Å; P97-Y153 WeakPolarHBondContact CG-OH 3.44Å
98	T	88.5	Confident	90.6	Very high	104 Å²	104	65.6 Å²	65.6	64%	0.638	34%	0.34	S	S	*	.	H	α-helix	trans	-65.9	-44.2	174.4	36.3	0	0	0	0	111.3	S96 L100 A101 T102	S96-T98 PolarHBondContact O-N 2.94Å; S96-T98 PolarHBondContact OG-OG1 3.13Å; T98-L100 VanDerWaalsContact C-N 3.34Å; T98-A101 WeakPolarHBondContact O-CB 3.43Å; T98-A101 PolarHBondContact O-N 2.64Å; T98-T102 PolarHBondContact O-N 3.11Å; T98-T102 VanDerWaalsContact O-N 3.09Å; T98-T102 PolarHBondContact O-OG1 3.12Å
99	E	92.7	Very high	90.5	Very high	98 Å²	98	69.3 Å²	69.3	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-67.2	-35.7	174.4	-70.5	161.9	138.6	0	0	111.5	L95 S96 T102 A103	L95-E99 HydrophobicContact CB-CB 3.96Å; L95-E99 HydrophobicContact CD2-CB 4.31Å; L95-E99 HydrophobicContact CG-CB 4.49Å; S96-E99 VanDerWaalsContact CB-OE2 3.23Å; S96-E99 WeakPolarHBondContact CB-OE2 3.23Å; S96-E99 PolarHBondContact N-OE2 2.92Å; S96-E99 CarbonylContact O-C 3.56Å; S96-E99 WeakPolarHBondContact O-CB 3.48Å; S96-E99 PolarHBondContact O-N 3.26Å; S96-E99 WeakPolarHBondContact OG-CB 3.43Å; S96-E99 VanDerWaalsContact OG-CG 3.23Å; S96-E99 WeakPolarHBondContact OG-CG 3.35Å; S96-E99 PolarHBondContact OG-N 3.11Å; S96-E99 PolarHBondContact OG-OE2 3.13Å; E99-T102 PolarHBondContact O-N 2.94Å; E99-A103 VanDerWaalsContact O-CB 3.23Å; E99-A103 WeakPolarHBondContact O-CB 3.22Å; E99-A103 PolarHBondContact O-N 3.14Å
100	L	92.5	Very high	90.5	Very high	0 Å²	0	71 Å²	71	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-66.3	-36	173.7	-73	172.6	0	0	0	112.8	L92 L95 S96 P97 T98 A103 S104 L119 W120 I123	L92-L100 HydrophobicContact CB-CD2 4.05Å; L92-L100 HydrophobicContact CD2-CD2 4.29Å; L95-L100 HydrophobicContact CB-CD2 4.01Å; L95-L100 HydrophobicContact CB-CG 3.91Å; L95-L100 HydrophobicContact CD1-CD2 4.11Å; S96-L100 WeakPolarHBondContact O-CG 3.48Å; S96-L100 PolarHBondContact O-N 3.01Å; P97-L100 PolarHBondContact O-N 3.4Å; T98-L100 VanDerWaalsContact C-N 3.34Å; L100-A103 PolarHBondContact O-N 3.24Å; L100-S104 WeakPolarHBondContact O-CB 3.31Å; L100-S104 PolarHBondContact O-N 3.49Å; L100-L119 HydrophobicContact CD1-CD2 4.2Å; L100-L119 HydrophobicContact CD2-CD2 3.87Å; L100-W120 HydrophobicContact CD1-CZ2 4.43Å; L100-I123 HydrophobicContact CD1-CD1 3.27Å
101	A	89.5	Confident	90.6	Very high	38 Å²	38	71.1 Å²	71.1	31%	0.314	36%	0.363	S	S	.	.	H	α-helix	trans	-63.4	-44.6	172.4	0	0	0	0	0	110.6	P97 T98 S104	P97-A101 WeakPolarHBondContact O-CB 3.41Å; P97-A101 PolarHBondContact O-N 3.16Å; T98-A101 WeakPolarHBondContact O-CB 3.43Å; T98-A101 PolarHBondContact O-N 2.64Å; A101-S104 PolarHBondContact O-N 3.16Å; A101-S104 PolarHBondContact O-OG 3.17Å
102	T	92.2	Very high	90.5	Very high	102 Å²	102	73.6 Å²	73.6	63%	0.626	38%	0.376	S	S	*	.	H	α-helix	trans	-62.6	-46.1	173.9	-53.3	0	0	0	0	111.7	T98 E99 S104 M105	T98-T102 PolarHBondContact O-N 3.11Å; T98-T102 VanDerWaalsContact O-N 3.09Å; T98-T102 PolarHBondContact O-OG1 3.12Å; E99-T102 PolarHBondContact O-N 2.94Å; T102-S104 VanDerWaalsContact C-N 3.25Å; T102-S104 PolarHBondContact O-N 3.05Å; T102-M105 WeakPolarHBondContact O-CB 3.43Å; T102-M105 PolarHBondContact O-N 3.31Å
103	A	91.4	Very high	90.5	Very high	7 Å²	7	73.5 Å²	73.5	6%	0.058	38%	0.376	C	S	.	.	H	α-helix	trans	-57.6	-37.8	176.7	0	0	0	0	0	111.8	L95 E99 L100 M105 T106 W110	L95-A103 HydrophobicContact CD1-CB 4.5Å; E99-A103 VanDerWaalsContact O-CB 3.23Å; E99-A103 WeakPolarHBondContact O-CB 3.22Å; E99-A103 PolarHBondContact O-N 3.14Å; L100-A103 PolarHBondContact O-N 3.24Å; A103-M105 PolarHBondContact O-N 3.02Å; A103-M105 VanDerWaalsContact O-N 3.14Å; A103-T106 WeakPolarHBondContact O-CB 3.37Å; A103-T106 PolarHBondContact O-N 2.92Å; A103-T106 VanDerWaalsContact O-N 3.16Å; A103-T106 PolarHBondContact O-OG1 3.48Å; A103-T106 VanDerWaalsContact O-OG1 3.12Å; A103-W110 HydrophobicContact CB-CE3 3.74Å; A103-W110 HydrophobicContact CB-CZ3 3.91Å; A103-W110 VanDerWaalsContact O-CB 3.32Å; A103-W110 WeakPolarHBondContact O-CB 3.48Å
104	S	90.8	Very high	90.5	Very high	17 Å²	17	72.7 Å²	72.7	12%	0.119	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.6	177.4	80.4	0	0	0	0	114	L100 A101 T102 K111 S114	L100-S104 WeakPolarHBondContact O-CB 3.31Å; L100-S104 PolarHBondContact O-N 3.49Å; A101-S104 PolarHBondContact O-N 3.16Å; A101-S104 PolarHBondContact O-OG 3.17Å; T102-S104 VanDerWaalsContact C-N 3.25Å; T102-S104 PolarHBondContact O-N 3.05Å; S104-K111 WeakPolarHBondContact O-CB 3.45Å; S104-S114 VanDerWaalsContact CA-OG 3.29Å; S104-S114 WeakPolarHBondContact CA-OG 3.35Å; S104-S114 WeakPolarHBondContact CB-OG 3.3Å
105	M	91	Very high	90.4	Very high	159 Å²	159	68.5 Å²	68.5	78%	0.783	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-8.3	179.3	-60.8	-64.3	-68.4	0	0	113.3	T102 A103	T102-M105 WeakPolarHBondContact O-CB 3.43Å; T102-M105 PolarHBondContact O-N 3.31Å; A103-M105 PolarHBondContact O-N 3.02Å; A103-M105 VanDerWaalsContact O-N 3.14Å
106	T	90.4	Very high	90.3	Very high	85 Å²	85	66.8 Å²	66.8	52%	0.521	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-55.9	-176.3	-54	0	0	0	0	112.5	A103 W110	A103-T106 WeakPolarHBondContact O-CB 3.37Å; A103-T106 PolarHBondContact O-N 2.92Å; A103-T106 VanDerWaalsContact O-N 3.16Å; A103-T106 PolarHBondContact O-OG1 3.48Å; A103-T106 VanDerWaalsContact O-OG1 3.12Å; T106-W110 HydrophobicContact CG2-CD2 4.11Å; T106-W110 HydrophobicContact CG2-CG 4.19Å
107	C	89.9	Confident	90.2	Very high	50 Å²	50	67.6 Å²	67.6	34%	0.338	35%	0.352	S	S	.	.			trans	-160.8	174.8	176.7	81.6	0	0	0	0	110.9	Y109 W110 K111	C107-Y109 VanDerWaalsContact C-N 3.29Å; C107-Y109 PolarHBondContact O-N 3.46Å; C107-Y109 PolarHBondContact SG-N 3.31Å; C107-W110 PolarHBondContact O-N 3.21Å; C107-K111 PolarHBondContact O-N 3.05Å
108	R	89.6	Confident	90.3	Very high	236 Å²	236	71.9 Å²	71.9	89%	0.891	37%	0.367	S	S	*	.	H	α-helix	trans	-59.2	-36.9	-179.5	-68.8	-175	-177.7	178.9	1.5	113.4	K111 L112	R108-K111 PolarHBondContact O-N 3.09Å; R108-L112 PolarHBondContact O-N 3.34Å
109	Y	90.3	Very high	90.4	Very high	79 Å²	79	67 Å²	67	31%	0.31	34%	0.337	S	S	.	.	H	α-helix	trans	-70	-43.8	179.3	-173.2	-104.4	0	0	0	111.6	S81 C107 K111 L112 L113	S81-Y109 WeakPolarHBondContact OG-CD1 3.25Å; C107-Y109 VanDerWaalsContact C-N 3.29Å; C107-Y109 PolarHBondContact O-N 3.46Å; C107-Y109 PolarHBondContact SG-N 3.31Å; Y109-K111 VanDerWaalsContact C-N 3.32Å; Y109-K111 PolarHBondContact O-N 3.01Å; Y109-L112 WeakPolarHBondContact O-CB 3.3Å; Y109-L112 PolarHBondContact O-N 3.08Å; Y109-L112 VanDerWaalsContact O-N 3.14Å; Y109-L113 HydrophobicContact CD1-CD1 3.83Å; Y109-L113 HydrophobicContact CD1-CG 4.29Å; Y109-L113 HydrophobicContact CE1-CD1 3.37Å; Y109-L113 HydrophobicContact CE1-CD2 4.49Å; Y109-L113 HydrophobicContact CE1-CG 3.96Å; Y109-L113 PolarHBondContact O-N 3.38Å
110	W	93	Very high	90.2	Very high	48 Å²	48	62.4 Å²	62.4	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-38.7	173.8	-79.4	61.6	0	0	0	112.5	D78 I80 L92 A103 T106 C107 L113 S114	D78-W110 PolarHBondContact OD1-NE1 3.37Å; D78-W110 PolarHBondContact OD2-NE1 3.26Å; I80-W110 HydrophobicContact CB-CH2 4.18Å; I80-W110 HydrophobicContact CB-CZ2 3.5Å; I80-W110 HydrophobicContact CG1-CH2 3.58Å; I80-W110 HydrophobicContact CG1-CZ2 3.38Å; I80-W110 HydrophobicContact CG1-CZ3 4.42Å; I80-W110 HydrophobicContact CG2-CD2 4.44Å; I80-W110 HydrophobicContact CG2-CZ2 4.18Å; L92-W110 HydrophobicContact CD2-CZ3 4.46Å; A103-W110 HydrophobicContact CB-CE3 3.74Å; A103-W110 HydrophobicContact CB-CZ3 3.91Å; A103-W110 VanDerWaalsContact O-CB 3.32Å; A103-W110 WeakPolarHBondContact O-CB 3.48Å; T106-W110 HydrophobicContact CG2-CD2 4.11Å; T106-W110 HydrophobicContact CG2-CG 4.19Å; C107-W110 PolarHBondContact O-N 3.21Å; W110-L113 PolarHBondContact O-N 3.31Å; W110-S114 VanDerWaalsContact O-CB 3.29Å; W110-S114 WeakPolarHBondContact O-CB 3.38Å; W110-S114 PolarHBondContact O-N 3.13Å; W110-S114 PolarHBondContact O-OG 2.91Å
111	K	91.1	Very high	90	Very high	116 Å²	116	68.4 Å²	68.4	50%	0.504	34%	0.338	S	S	.	.	H	α-helix	trans	-58.1	-47.3	170.9	-170.8	172.8	179.9	172.9	0	111.7	S104 C107 R108 Y109 L113 S114 D115	S104-K111 WeakPolarHBondContact O-CB 3.45Å; C107-K111 PolarHBondContact O-N 3.05Å; R108-K111 PolarHBondContact O-N 3.09Å; Y109-K111 VanDerWaalsContact C-N 3.32Å; Y109-K111 PolarHBondContact O-N 3.01Å; K111-L113 VanDerWaalsContact C-N 3.35Å; K111-L113 PolarHBondContact O-N 2.91Å; K111-S114 WeakPolarHBondContact CA-OG 3.46Å; K111-S114 PolarHBondContact O-N 2.75Å; K111-S114 PolarHBondContact O-OG 3.23Å; K111-S114 VanDerWaalsContact O-OG 3.06Å; K111-D115 WeakPolarHBondContact O-CB 3.22Å; K111-D115 PolarHBondContact O-N 2.93Å
112	L	90	Very high	89.9	Confident	114 Å²	114	69.9 Å²	69.9	60%	0.597	34%	0.336	S	S	*	.	H	α-helix	trans	-61.3	-41.2	178.4	-173.5	73.1	0	0	0	112.5	R108 Y109 S116	R108-L112 PolarHBondContact O-N 3.34Å; Y109-L112 WeakPolarHBondContact O-CB 3.3Å; Y109-L112 PolarHBondContact O-N 3.08Å; Y109-L112 VanDerWaalsContact O-N 3.14Å; L112-S116 PolarHBondContact O-N 3.23Å
113	L	91.2	Very high	89.7	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-70.8	-44.6	178	-69.8	179.8	0	0	0	112.4	I80 K85 A88 L89 L92 Y109 W110 K111 D115 S116	I80-L113 HydrophobicContact CG2-CD1 3.56Å; K85-L113 HydrophobicContact CG-CD2 3.88Å; A88-L113 HydrophobicContact CB-CD1 3.85Å; L89-L113 HydrophobicContact CD2-CB 4.31Å; L89-L113 HydrophobicContact CD2-CD2 4Å; L89-L113 WeakPolarHBondContact CD2-O 3.5Å; L89-L113 HydrophobicContact CG-CD2 4.2Å; L92-L113 HydrophobicContact CD1-CB 3.57Å; L92-L113 HydrophobicContact CD1-CD1 4.26Å; Y109-L113 HydrophobicContact CD1-CD1 3.83Å; Y109-L113 HydrophobicContact CD1-CG 4.29Å; Y109-L113 HydrophobicContact CE1-CD1 3.37Å; Y109-L113 HydrophobicContact CE1-CD2 4.49Å; Y109-L113 HydrophobicContact CE1-CG 3.96Å; Y109-L113 PolarHBondContact O-N 3.38Å; W110-L113 PolarHBondContact O-N 3.31Å; K111-L113 VanDerWaalsContact C-N 3.35Å; K111-L113 PolarHBondContact O-N 2.91Å; L113-D115 VanDerWaalsContact C-N 3.28Å; L113-D115 PolarHBondContact O-N 3.18Å; L113-S116 WeakPolarHBondContact O-CB 3.38Å; L113-S116 PolarHBondContact O-N 3.19Å; L113-S116 VanDerWaalsContact O-N 3.12Å
114	S	90.7	Very high	89.5	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.7	-23.6	179.8	56	0	0	0	0	113.4	S104 W110 K111 W120	S104-S114 VanDerWaalsContact CA-OG 3.29Å; S104-S114 WeakPolarHBondContact CA-OG 3.35Å; S104-S114 WeakPolarHBondContact CB-OG 3.3Å; W110-S114 VanDerWaalsContact O-CB 3.29Å; W110-S114 WeakPolarHBondContact O-CB 3.38Å; W110-S114 PolarHBondContact O-N 3.13Å; W110-S114 PolarHBondContact O-OG 2.91Å; K111-S114 WeakPolarHBondContact CA-OG 3.46Å; K111-S114 PolarHBondContact O-N 2.75Å; K111-S114 PolarHBondContact O-OG 3.23Å; K111-S114 VanDerWaalsContact O-OG 3.06Å; S114-W120 PolarHBondContact O-NE1 2.7Å
115	D	87	Confident	89.2	Confident	53 Å²	53	70.1 Å²	70.1	28%	0.283	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	8.4	172.2	-75	-31.1	0	0	0	113.7	K111 L113 S117 C147 R150	K111-D115 WeakPolarHBondContact O-CB 3.22Å; K111-D115 PolarHBondContact O-N 2.93Å; L113-D115 VanDerWaalsContact C-N 3.28Å; L113-D115 PolarHBondContact O-N 3.18Å; D115-S117 PolarHBondContact O-N 3.12Å; D115-C147 WeakPolarHBondContact O-CB 3.23Å; D115-R150 IonicContact OD1-CZ 3.51Å; D115-R150 IonicContact OD1-NE 3.8Å; D115-R150 IonicContact OD1-NH1 2.66Å; D115-R150 PolarHBondContact OD1-NH1 3.25Å
116	S	89.1	Confident	88.8	Confident	19 Å²	19	69.1 Å²	69.1	13%	0.133	32%	0.32	C	S	.	.			trans	-62.5	129.7	-179.2	176.9	0	0	0	0	112.6	L89 L112 L113 F118 L119 W120	L89-S116 VanDerWaalsContact CD2-CB 3.5Å; L112-S116 PolarHBondContact O-N 3.23Å; L113-S116 WeakPolarHBondContact O-CB 3.38Å; L113-S116 PolarHBondContact O-N 3.19Å; L113-S116 VanDerWaalsContact O-N 3.12Å; S116-F118 PolarHBondContact O-N 2.7Å; S116-F118 PolarHBondContact OG-N 3.35Å; S116-L119 WeakPolarHBondContact O-CB 3.48Å; S116-L119 PolarHBondContact O-N 3.2Å; S116-L119 VanDerWaalsContact O-N 3.16Å; S116-W120 PolarHBondContact O-N 2.73Å; S116-W120 VanDerWaalsContact O-N 3.15Å
117	S	88	Confident	88.3	Confident	57 Å²	57	67.2 Å²	67.2	40%	0.399	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-34.8	175	-170.1	0	0	0	0	113.2	D115 R121 C147	D115-S117 PolarHBondContact O-N 3.12Å; S117-R121 VanDerWaalsContact O-CB 3.22Å; S117-R121 WeakPolarHBondContact O-CB 3.33Å; S117-R121 PolarHBondContact O-N 3.13Å; S117-C147 VanDerWaalsContact CA-SG 3.54Å
118	F	86.5	Confident	87.7	Confident	126 Å²	126	71.3 Å²	71.3	55%	0.553	33%	0.332	S	S	*	.	H	α-helix	trans	-67.9	-42.2	178.1	-177.7	-94.1	0	0	0	111.9	L89 S116 R121 R122	L89-F118 HydrophobicContact CD1-CD1 4.38Å; S116-F118 PolarHBondContact O-N 2.7Å; S116-F118 PolarHBondContact OG-N 3.35Å; F118-R121 PolarHBondContact O-N 3.19Å; F118-R122 PolarHBondContact O-N 3.2Å; F118-R122 VanDerWaalsContact O-N 3.08Å
119	L	91	Very high	87.1	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-61.1	-53.9	178.1	173.7	63.3	0	0	0	110.6	L89 L92 S93 L100 S116 R121 R122 I123	L89-L119 HydrophobicContact CD2-CB 4.17Å; L92-L119 HydrophobicContact CB-CD1 4.12Å; L92-L119 HydrophobicContact CB-CD2 4.09Å; S93-L119 VanDerWaalsContact CA-CD1 3.49Å; L100-L119 HydrophobicContact CD1-CD2 4.2Å; L100-L119 HydrophobicContact CD2-CD2 3.87Å; S116-L119 WeakPolarHBondContact O-CB 3.48Å; S116-L119 PolarHBondContact O-N 3.2Å; S116-L119 VanDerWaalsContact O-N 3.16Å; L119-R121 VanDerWaalsContact C-N 3.32Å; L119-R121 PolarHBondContact O-N 3.06Å; L119-R122 WeakPolarHBondContact O-CB 3.38Å; L119-R122 PolarHBondContact O-N 2.82Å; L119-R122 VanDerWaalsContact O-N 3.14Å; L119-I123 HydrophobicContact CD1-CD1 3.94Å; L119-I123 HydrophobicContact CD1-CG1 4.36Å; L119-I123 HydrophobicContact CG-CD1 3.85Å; L119-I123 WeakPolarHBondContact O-CG1 3.14Å; L119-I123 PolarHBondContact O-N 3.37Å
120	W	90	Very high	85.6	Confident	3 Å²	3	60.3 Å²	60.3	1%	0.011	31%	0.306	C	S	.	.	H	α-helix	trans	-66.3	-33	-178.9	-74.5	100.8	0	0	0	113	P97 L100 S114 S116 R122 I123 C124 W149 R150 Y153	P97-W120 HydrophobicContact CB-CH2 4.07Å; P97-W120 HydrophobicContact CB-CZ3 4.35Å; L100-W120 HydrophobicContact CD1-CZ2 4.43Å; S114-W120 PolarHBondContact O-NE1 2.7Å; S116-W120 PolarHBondContact O-N 2.73Å; S116-W120 VanDerWaalsContact O-N 3.15Å; W120-R122 VanDerWaalsContact C-N 3.34Å; W120-I123 HydrophobicContact CD2-CD1 4.34Å; W120-I123 HydrophobicContact CE3-CD1 4.12Å; W120-I123 HydrophobicContact CE3-CG2 4.47Å; W120-I123 HydrophobicContact CZ3-CD1 4.39Å; W120-I123 PolarHBondContact O-N 3.43Å; W120-C124 WeakPolarHBondContact O-CB 3.26Å; W120-C124 PolarHBondContact O-N 2.66Å; W120-C124 PolarHBondContact O-SG 3.01Å; W120-W149 HydrophobicContact CB-CB 3.49Å; W120-W149 VanDerWaalsContact CB-CB 3.49Å; W120-R150 HydrophobicContact CB-CB 4.42Å; W120-R150 HydrophobicContact CD2-CB 3.63Å; W120-R150 HydrophobicContact CD2-CG 3.83Å; W120-R150 HydrophobicContact CE3-CB 4.22Å; W120-R150 HydrophobicContact CE3-CG 4.24Å; W120-R150 HydrophobicContact CG-CB 3.69Å; W120-R150 HydrophobicContact CG-CG 4.37Å; W120-R150 HydrophobicContact CH2-CG 4.11Å; W120-R150 HydrophobicContact CZ2-CB 4.4Å; W120-R150 HydrophobicContact CZ2-CG 3.69Å; W120-R150 HydrophobicContact CZ3-CG 4.36Å; W120-Y153 HydrophobicContact CE3-CD1 4.46Å; W120-Y153 HydrophobicContact CE3-CG 4.07Å; W120-Y153 AromaticContact CZ3-CD1 3.7Å; W120-Y153 HydrophobicContact CZ3-CD1 3.7Å; W120-Y153 HydrophobicContact CZ3-CD2 4.45Å; W120-Y153 HydrophobicContact CZ3-CE1 4.39Å; W120-Y153 AromaticContact CZ3-CG 3.76Å; W120-Y153 HydrophobicContact CZ3-CG 3.76Å
121	R	88.3	Confident	83.6	Confident	125 Å²	125	66.5 Å²	66.5	47%	0.472	34%	0.342	S	S	.	.	H	α-helix	trans	-59	-47.1	171.3	179	171.7	-175.3	-177.8	4.4	111.6	S117 F118 L119 C124 Q125 W149	S117-R121 VanDerWaalsContact O-CB 3.22Å; S117-R121 WeakPolarHBondContact O-CB 3.33Å; S117-R121 PolarHBondContact O-N 3.13Å; F118-R121 PolarHBondContact O-N 3.19Å; L119-R121 VanDerWaalsContact C-N 3.32Å; L119-R121 PolarHBondContact O-N 3.06Å; R121-C124 PolarHBondContact O-N 3.17Å; R121-Q125 WeakPolarHBondContact O-CG 3.45Å; R121-Q125 PolarHBondContact O-N 3.37Å; R121-W149 VanDerWaalsContact CA-CE3 3.49Å; R121-W149 HydrophobicContact CB-CD2 3.66Å; R121-W149 HydrophobicContact CB-CE3 3.77Å; R121-W149 HydrophobicContact CB-CG 3.98Å; R121-W149 HydrophobicContact CB-CZ3 4.17Å; R121-W149 HydrophobicContact CG-CD2 4.01Å; R121-W149 HydrophobicContact CG-CE3 3.82Å; R121-W149 HydrophobicContact CG-CH2 3.9Å; R121-W149 HydrophobicContact CG-CZ2 4.08Å; R121-W149 HydrophobicContact CG-CZ3 3.67Å
122	R	86.9	Confident	81.4	Confident	69 Å²	69	62.2 Å²	62.2	26%	0.26	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-42.3	178.3	-174.7	173.5	178.1	145	2.1	112.2	F118 L119 W120 C124 Q125 H126	F118-R122 PolarHBondContact O-N 3.2Å; F118-R122 VanDerWaalsContact O-N 3.08Å; L119-R122 WeakPolarHBondContact O-CB 3.38Å; L119-R122 PolarHBondContact O-N 2.82Å; L119-R122 VanDerWaalsContact O-N 3.14Å; W120-R122 VanDerWaalsContact C-N 3.34Å; R122-C124 VanDerWaalsContact C-N 3.35Å; R122-C124 PolarHBondContact O-N 3.41Å; R122-Q125 PolarHBondContact O-N 2.89Å; R122-H126 PolarHBondContact NE-NE2 3.33Å; R122-H126 PolarHBondContact O-CD2 2.87Å; R122-H126 PolarHBondContact O-N 2.63Å
123	I	88.4	Confident	79.6	Confident	17 Å²	17	63.8 Å²	63.8	9%	0.087	33%	0.329	C	S	.	.	H	α-helix	trans	-60.1	-45.5	175.3	-67.2	166.2	0	0	0	110.7	L100 L119 W120 Q125 H126 A127 Y153	L100-I123 HydrophobicContact CD1-CD1 3.27Å; L119-I123 HydrophobicContact CD1-CD1 3.94Å; L119-I123 HydrophobicContact CD1-CG1 4.36Å; L119-I123 HydrophobicContact CG-CD1 3.85Å; L119-I123 WeakPolarHBondContact O-CG1 3.14Å; L119-I123 PolarHBondContact O-N 3.37Å; W120-I123 HydrophobicContact CD2-CD1 4.34Å; W120-I123 HydrophobicContact CE3-CD1 4.12Å; W120-I123 HydrophobicContact CE3-CG2 4.47Å; W120-I123 HydrophobicContact CZ3-CD1 4.39Å; W120-I123 PolarHBondContact O-N 3.43Å; I123-Q125 VanDerWaalsContact C-N 3.34Å; I123-Q125 PolarHBondContact O-N 3.11Å; I123-H126 PolarHBondContact O-N 3.05Å; I123-A127 WeakPolarHBondContact O-CB 3.23Å; I123-A127 PolarHBondContact O-N 3.39Å; I123-Y153 HydrophobicContact CG2-CD2 3.67Å; I123-Y153 HydrophobicContact CG2-CE2 3.54Å
124	C	87	Confident	77.8	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.7	-38.3	178.5	-64.9	0	0	0	0	112.5	W120 R121 R122 A127 N128 I129 L132 W149	W120-C124 WeakPolarHBondContact O-CB 3.26Å; W120-C124 PolarHBondContact O-N 2.66Å; W120-C124 PolarHBondContact O-SG 3.01Å; R121-C124 PolarHBondContact O-N 3.17Å; R122-C124 VanDerWaalsContact C-N 3.35Å; R122-C124 PolarHBondContact O-N 3.41Å; C124-A127 PolarHBondContact O-N 2.93Å; C124-N128 PolarHBondContact O-N 3.5Å; C124-I129 HydrophobicContact CB-CB 4.29Å; C124-I129 HydrophobicContact CB-CD1 4.44Å; C124-I129 PolarHBondContact O-N 3.47Å; C124-L132 HydrophobicContact CB-CD1 3.37Å; C124-L132 HydrophobicContact CB-CD2 3.93Å; C124-L132 HydrophobicContact CB-CG 4.33Å; C124-W149 HydrophobicContact CB-CE3 4.25Å; C124-W149 PolarHBondContact SG-O 2.94Å; C124-W149 VanDerWaalsContact SG-O 3.39Å
125	Q	84.2	Confident	76	Confident	115 Å²	115	67.8 Å²	67.8	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-62.3	-45.6	174.2	-74.8	172.7	-27.3	0	0	111.9	R121 R122 I123 A127 N128	R121-Q125 WeakPolarHBondContact O-CG 3.45Å; R121-Q125 PolarHBondContact O-N 3.37Å; R122-Q125 PolarHBondContact O-N 2.89Å; I123-Q125 VanDerWaalsContact C-N 3.34Å; I123-Q125 PolarHBondContact O-N 3.11Å; Q125-A127 VanDerWaalsContact C-N 3.32Å; Q125-A127 PolarHBondContact O-N 2.74Å; Q125-N128 PolarHBondContact O-N 2.97Å; Q125-N128 VanDerWaalsContact O-N 3.15Å
126	H	83	Confident	74.4	Confident	138 Å²	138	73.5 Å²	73.5	64%	0.639	38%	0.38	S	S	*	.	H	α-helix	trans	-65.3	-35.3	176.4	-78.4	-63.3	0	0	0	112.8	R122 I123 N128	R122-H126 PolarHBondContact NE-NE2 3.33Å; R122-H126 PolarHBondContact O-CD2 2.87Å; R122-H126 PolarHBondContact O-N 2.63Å; I123-H126 PolarHBondContact O-N 3.05Å; H126-N128 PolarHBondContact O-N 3Å
127	A	80.2	Confident	72.1	Confident	44 Å²	44	77.9 Å²	77.9	36%	0.364	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	1.7	176	0	0	0	0	0	113.6	I123 C124 Q125 I129 Y153	I123-A127 WeakPolarHBondContact O-CB 3.23Å; I123-A127 PolarHBondContact O-N 3.39Å; C124-A127 PolarHBondContact O-N 2.93Å; Q125-A127 VanDerWaalsContact C-N 3.32Å; Q125-A127 PolarHBondContact O-N 2.74Å; A127-I129 HydrophobicContact CB-CD1 3.9Å; A127-I129 HydrophobicContact CB-CG1 3.8Å; A127-I129 PolarHBondContact O-N 3.29Å; A127-I129 VanDerWaalsContact O-N 3.11Å; A127-Y153 HydrophobicContact CB-CE2 4.15Å
128	N	76.8	Confident	69.6	Low	137 Å²	137	83.2 Å²	83.2	73%	0.733	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	33.2	-176.2	-154.3	20.6	0	0	0	113.4	C124 Q125 H126 A130	C124-N128 PolarHBondContact O-N 3.5Å; Q125-N128 PolarHBondContact O-N 2.97Å; Q125-N128 VanDerWaalsContact O-N 3.15Å; H126-N128 PolarHBondContact O-N 3Å; N128-A130 PolarHBondContact O-N 3.37Å
129	I	76.2	Confident	67.1	Low	7 Å²	7	79.8 Å²	79.8	4%	0.036	42%	0.418	C	S	.	.			trans	-68.6	117	175.5	-63.3	176.6	0	0	0	105.5	C124 A127 L131 L132 T152 Y153 H156	C124-I129 HydrophobicContact CB-CB 4.29Å; C124-I129 HydrophobicContact CB-CD1 4.44Å; C124-I129 PolarHBondContact O-N 3.47Å; A127-I129 HydrophobicContact CB-CD1 3.9Å; A127-I129 HydrophobicContact CB-CG1 3.8Å; A127-I129 PolarHBondContact O-N 3.29Å; A127-I129 VanDerWaalsContact O-N 3.11Å; I129-L131 PolarHBondContact O-N 3.17Å; I129-L132 HydrophobicContact CB-CD1 4.39Å; I129-L132 HydrophobicContact CG2-CD1 4.46Å; I129-L132 HydrophobicContact CG2-CD2 4.23Å; I129-L132 HydrophobicContact CG2-CG 4.39Å; I129-L132 WeakPolarHBondContact O-CD1 3.32Å; I129-T152 HydrophobicContact CG2-CG2 4.16Å; I129-Y153 HydrophobicContact CD1-CD2 3.39Å; I129-Y153 HydrophobicContact CD1-CE2 3.85Å; I129-Y153 HydrophobicContact CD1-CG 4.15Å; I129-H156 HydrophobicContact CD1-CB 3.96Å; I129-H156 HydrophobicContact CG1-CB 4.24Å; I129-H156 HydrophobicContact CG2-CB 3.89Å
130	A	59.9	Low	64.6	Low	76 Å²	76	89.6 Å²	89.6	63%	0.628	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-30.6	120.2	-167.4	0	0	0	0	0	112.9	N128 L132	N128-A130 PolarHBondContact O-N 3.37Å; A130-L132 VanDerWaalsContact C-N 3.3Å; A130-L132 WeakPolarHBondContact O-CA 3.25Å; A130-L132 PolarHBondContact O-N 3.36Å
131	L	50.8	Low	62	Low	179 Å²	179	99 Å²	99	94%	0.937	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-11.6	84.2	174.2	-76.3	154.9	0	0	0	112.3	I129 E133	I129-L131 PolarHBondContact O-N 3.17Å; L131-E133 PolarHBondContact O-N 3.48Å
132	L	44.7	Very low	59.6	Low	26 Å²	26	95.4 Å²	95.4	14%	0.136	51%	0.51	C	S	.	.			trans	-65.4	108.4	-159.6	-71.1	104.4	0	0	0	111.5	C124 I129 A130 W149 T152	C124-L132 HydrophobicContact CB-CD1 3.37Å; C124-L132 HydrophobicContact CB-CD2 3.93Å; C124-L132 HydrophobicContact CB-CG 4.33Å; I129-L132 HydrophobicContact CB-CD1 4.39Å; I129-L132 HydrophobicContact CG2-CD1 4.46Å; I129-L132 HydrophobicContact CG2-CD2 4.23Å; I129-L132 HydrophobicContact CG2-CG 4.39Å; I129-L132 WeakPolarHBondContact O-CD1 3.32Å; A130-L132 VanDerWaalsContact C-N 3.3Å; A130-L132 WeakPolarHBondContact O-CA 3.25Å; A130-L132 PolarHBondContact O-N 3.36Å; L132-W149 HydrophobicContact CB-CE3 3.87Å; L132-W149 HydrophobicContact CB-CH2 3.43Å; L132-W149 VanDerWaalsContact CB-CH2 3.43Å; L132-W149 HydrophobicContact CB-CZ2 4.48Å; L132-W149 HydrophobicContact CB-CZ3 3.13Å; L132-W149 HydrophobicContact CD1-CE3 3.88Å; L132-W149 HydrophobicContact CD1-CH2 4.43Å; L132-W149 HydrophobicContact CD1-CZ3 3.39Å; L132-W149 HydrophobicContact CD2-CE3 3.54Å; L132-W149 HydrophobicContact CD2-CZ3 3.7Å; L132-W149 HydrophobicContact CG-CE3 3.95Å; L132-W149 HydrophobicContact CG-CH2 4.35Å; L132-W149 HydrophobicContact CG-CZ3 3.55Å; L132-T152 VanDerWaalsContact CD2-CB 3.47Å; L132-T152 HydrophobicContact CD2-CG2 3.27Å; L132-T152 HydrophobicContact CG-CG2 4.3Å
133	E	52	Low	57.3	Low	146 Å²	146	97 Å²	97	68%	0.682	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-71.2	121	134.7	-72.5	-160.3	170.9	0	0	106.2	L131 A135	L131-E133 PolarHBondContact O-N 3.48Å; E133-A135 PolarHBondContact O-N 2.94Å
134	P	52.6	Low	55.6	Low	52 Å²	52	101.4 Å²	101.4	34%	0.338	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-53.7	146	168.1	23.5	-30.7	0	0	0	108.1	K136 P148	P134-K136 PolarHBondContact O-N 3.2Å; P134-P148 HydrophobicContact CB-CB 3.67Å
135	A	53.8	Low	54.2	Low	33 Å²	33	111.2 Å²	111.2	27%	0.273	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-46.2	116.4	172.5	0	0	0	0	0	107.9	E133 T137 Y151	E133-A135 PolarHBondContact O-N 2.94Å; A135-T137 PolarHBondContact O-N 3.49Å; A135-Y151 HydrophobicContact CB-CD1 3.99Å; A135-Y151 HydrophobicContact CB-CE1 3.85Å
136	K	52.2	Low	53.6	Low	174 Å²	174	107.4 Å²	107.4	76%	0.757	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-51.7	116.6	176.3	-78.7	-179.2	-178.5	173.5	0	105.5	P134 M138	P134-K136 PolarHBondContact O-N 3.2Å; K136-M138 PolarHBondContact O-N 3.47Å
137	T	42	Very low	53.6	Low	110 Å²	110	101.7 Å²	101.7	68%	0.675	56%	0.556	S	S	*	*			trans	-48.4	107.4	-173.8	36.3	0	0	0	0	109.1	A135 S139	A135-T137 PolarHBondContact O-N 3.49Å; T137-S139 VanDerWaalsContact C-N 3.33Å; T137-S139 PolarHBondContact O-N 2.88Å
138	M	35	Very low	53.7	Low	169 Å²	169	101.8 Å²	101.8	83%	0.833	55%	0.553	S	S	*	*			trans	-63.8	102.8	159.2	-75.9	-155.8	72.3	0	0	106.9	K136	K136-M138 PolarHBondContact O-N 3.47Å
139	S	35.2	Very low	54.1	Low	54 Å²	54	96.8 Å²	96.8	38%	0.378	52%	0.524	S	S	.	.			trans	-176.7	110.6	140.8	58.4	0	0	0	0	109.5	T137 E141	T137-S139 VanDerWaalsContact C-N 3.33Å; T137-S139 PolarHBondContact O-N 2.88Å; S139-E141 VanDerWaalsContact C-N 3.3Å
140	E	38.2	Very low	54.6	Low	208 Å²	208	99.1 Å²	99.1	97%	0.972	53%	0.532	S	S	*	.	S	Bend	trans	-79	-22.5	131.3	-74.9	-175.1	161.1	0	0	109.8
141	E	34.1	Very low	55.8	Low	200 Å²	200	99.5 Å²	99.5	94%	0.935	52%	0.518	S	S	*	.	S	Bend	trans	-143.9	13.1	178.2	-67.5	-171	156.4	0	0	117.7	S139	S139-E141 VanDerWaalsContact C-N 3.3Å
142	G	38.5	Very low	57.4	Low	49 Å²	49	92 Å²	92	51%	0.505	48%	0.479	S	S	.	.			trans	-131.4	64.4	-178.5	0	0	0	0	0	115.6	F144	G142-F144 PolarHBondContact O-N 3.38Å; G142-F144 VanDerWaalsContact O-N 3.11Å
143	T	39	Very low	59.4	Low	104 Å²	104	92.1 Å²	92.1	64%	0.638	48%	0.478	S	S	*	.			trans	-50.4	113	-171	51.8	0	0	0	0	114.2	K145	T143-K145 PolarHBondContact O-N 3.43Å
144	F	51.5	Low	61	Low	108 Å²	108	89 Å²	89	47%	0.474	47%	0.466	S	S	.	.			trans	-72.7	104.8	164.7	-171.2	-102.4	0	0	0	109.8	G142 G146 Y151	G142-F144 PolarHBondContact O-N 3.38Å; G142-F144 VanDerWaalsContact O-N 3.11Å; F144-G146 WeakPolarHBondContact CD1-O 3.37Å; F144-G146 VanDerWaalsContact CE1-CA 3.43Å; F144-G146 WeakPolarHBondContact CE1-O 3.49Å; F144-G146 PolarHBondContact O-N 3.26Å; F144-G146 VanDerWaalsContact O-N 3.11Å; F144-Y151 HydrophobicContact CD2-CD2 4.47Å; F144-Y151 HydrophobicContact CE1-CG 4.36Å; F144-Y151 AromaticContact CE2-CD2 3.59Å; F144-Y151 HydrophobicContact CE2-CD2 3.59Å; F144-Y151 HydrophobicContact CE2-CE2 4.23Å; F144-Y151 HydrophobicContact CE2-CG 4.21Å; F144-Y151 AromaticContact CZ-CD2 3.63Å; F144-Y151 HydrophobicContact CZ-CD2 3.63Å; F144-Y151 AromaticContact CZ-CG 3.89Å; F144-Y151 HydrophobicContact CZ-CG 3.89Å
145	K	59	Low	62.7	Low	207 Å²	207	89.9 Å²	89.9	90%	0.9	46%	0.462	S	S	*	.			trans	-80.9	34.1	179.7	-76.7	-174.7	175.4	176.9	0	114.1	T143	T143-K145 PolarHBondContact O-N 3.43Å
146	G	71.8	Confident	64.2	Low	35 Å²	35	90.5 Å²	90.5	36%	0.361	46%	0.459	S	S	.	.	S	Bend	trans	-137.8	166.8	-172.8	0	0	0	0	0	115	F144 P148	F144-G146 WeakPolarHBondContact CD1-O 3.37Å; F144-G146 VanDerWaalsContact CE1-CA 3.43Å; F144-G146 WeakPolarHBondContact CE1-O 3.49Å; F144-G146 PolarHBondContact O-N 3.26Å; F144-G146 VanDerWaalsContact O-N 3.11Å; G146-P148 WeakPolarHBondContact O-CD 3.31Å
147	C	81.8	Confident	65.9	Low	18 Å²	18	86.1 Å²	86.1	12%	0.122	44%	0.44	C	S	.	.			trans	-63.3	120.9	173.4	173.1	0	0	0	0	110.7	D115 S117 W149 R150 Y151	D115-C147 WeakPolarHBondContact O-CB 3.23Å; S117-C147 VanDerWaalsContact CA-SG 3.54Å; C147-W149 VanDerWaalsContact C-N 3.28Å; C147-W149 PolarHBondContact O-N 3.39Å; C147-R150 HydrophobicContact CB-CB 3.84Å; C147-R150 WeakPolarHBondContact O-CB 3.39Å; C147-R150 PolarHBondContact O-N 3.29Å; C147-R150 VanDerWaalsContact O-N 3.15Å; C147-Y151 PolarHBondContact O-N 3.1Å; C147-Y151 VanDerWaalsContact O-N 3.08Å
148	P	82.5	Confident	68.1	Low	46 Å²	46	83.9 Å²	83.9	30%	0.299	43%	0.426	S	S	.	.	H	α-helix	trans	-58.8	-37.5	-179.4	-26.5	35.1	0	0	0	113.4	P134 G146 Y151 T152	P134-P148 HydrophobicContact CB-CB 3.67Å; G146-P148 WeakPolarHBondContact O-CD 3.31Å; P148-Y151 WeakPolarHBondContact O-CB 3.37Å; P148-Y151 PolarHBondContact O-N 3.44Å; P148-T152 PolarHBondContact O-N 3.45Å; P148-T152 PolarHBondContact O-OG1 3.25Å; P148-T152 VanDerWaalsContact O-OG1 3.1Å
149	W	85.9	Confident	70.7	Confident	32 Å²	32	76.3 Å²	76.3	12%	0.121	39%	0.39	C	S	.	.	H	α-helix	trans	-69.4	-35.3	179.1	-62	89.1	0	0	0	112.4	W120 R121 C124 L132 C147 Y151 T152 Y153	W120-W149 HydrophobicContact CB-CB 3.49Å; W120-W149 VanDerWaalsContact CB-CB 3.49Å; R121-W149 VanDerWaalsContact CA-CE3 3.49Å; R121-W149 HydrophobicContact CB-CD2 3.66Å; R121-W149 HydrophobicContact CB-CE3 3.77Å; R121-W149 HydrophobicContact CB-CG 3.98Å; R121-W149 HydrophobicContact CB-CZ3 4.17Å; R121-W149 HydrophobicContact CG-CD2 4.01Å; R121-W149 HydrophobicContact CG-CE3 3.82Å; R121-W149 HydrophobicContact CG-CH2 3.9Å; R121-W149 HydrophobicContact CG-CZ2 4.08Å; R121-W149 HydrophobicContact CG-CZ3 3.67Å; C124-W149 HydrophobicContact CB-CE3 4.25Å; C124-W149 PolarHBondContact SG-O 2.94Å; C124-W149 VanDerWaalsContact SG-O 3.39Å; L132-W149 HydrophobicContact CB-CE3 3.87Å; L132-W149 HydrophobicContact CB-CH2 3.43Å; L132-W149 VanDerWaalsContact CB-CH2 3.43Å; L132-W149 HydrophobicContact CB-CZ2 4.48Å; L132-W149 HydrophobicContact CB-CZ3 3.13Å; L132-W149 HydrophobicContact CD1-CE3 3.88Å; L132-W149 HydrophobicContact CD1-CH2 4.43Å; L132-W149 HydrophobicContact CD1-CZ3 3.39Å; L132-W149 HydrophobicContact CD2-CE3 3.54Å; L132-W149 HydrophobicContact CD2-CZ3 3.7Å; L132-W149 HydrophobicContact CG-CE3 3.95Å; L132-W149 HydrophobicContact CG-CH2 4.35Å; L132-W149 HydrophobicContact CG-CZ3 3.55Å; C147-W149 VanDerWaalsContact C-N 3.28Å; C147-W149 PolarHBondContact O-N 3.39Å; W149-Y151 VanDerWaalsContact C-N 3.35Å; W149-T152 PolarHBondContact O-N 3.01Å; W149-Y153 WeakPolarHBondContact O-CB 3.28Å; W149-Y153 PolarHBondContact O-N 3.44Å
150	R	86.9	Confident	73.2	Confident	56 Å²	56	75 Å²	75	21%	0.211	38%	0.378	C	S	.	.	H	α-helix	trans	-62.8	-45.1	171.7	-176.1	174	177.7	131.5	7.8	110.4	D115 W120 C147 Y153 I154	D115-R150 IonicContact OD1-CZ 3.51Å; D115-R150 IonicContact OD1-NE 3.8Å; D115-R150 IonicContact OD1-NH1 2.66Å; D115-R150 PolarHBondContact OD1-NH1 3.25Å; W120-R150 HydrophobicContact CB-CB 4.42Å; W120-R150 HydrophobicContact CD2-CB 3.63Å; W120-R150 HydrophobicContact CD2-CG 3.83Å; W120-R150 HydrophobicContact CE3-CB 4.22Å; W120-R150 HydrophobicContact CE3-CG 4.24Å; W120-R150 HydrophobicContact CG-CB 3.69Å; W120-R150 HydrophobicContact CG-CG 4.37Å; W120-R150 HydrophobicContact CH2-CG 4.11Å; W120-R150 HydrophobicContact CZ2-CB 4.4Å; W120-R150 HydrophobicContact CZ2-CG 3.69Å; W120-R150 HydrophobicContact CZ3-CG 4.36Å; C147-R150 HydrophobicContact CB-CB 3.84Å; C147-R150 WeakPolarHBondContact O-CB 3.39Å; C147-R150 PolarHBondContact O-N 3.29Å; C147-R150 VanDerWaalsContact O-N 3.15Å; R150-Y153 PolarHBondContact O-N 3.2Å; R150-I154 HydrophobicContact CG-CD1 3.87Å; R150-I154 VanDerWaalsContact O-CG1 3.28Å; R150-I154 WeakPolarHBondContact O-CG1 3.38Å; R150-I154 PolarHBondContact O-N 2.97Å
151	Y	84	Confident	75.7	Confident	83 Å²	83	67.6 Å²	67.6	33%	0.325	35%	0.352	S	S	.	.	H	α-helix	trans	-59	-48.4	175.3	178.8	-97.2	0	0	0	111.7	A135 F144 C147 P148 W149 Y153 I154 R155	A135-Y151 HydrophobicContact CB-CD1 3.99Å; A135-Y151 HydrophobicContact CB-CE1 3.85Å; F144-Y151 HydrophobicContact CD2-CD2 4.47Å; F144-Y151 HydrophobicContact CE1-CG 4.36Å; F144-Y151 AromaticContact CE2-CD2 3.59Å; F144-Y151 HydrophobicContact CE2-CD2 3.59Å; F144-Y151 HydrophobicContact CE2-CE2 4.23Å; F144-Y151 HydrophobicContact CE2-CG 4.21Å; F144-Y151 AromaticContact CZ-CD2 3.63Å; F144-Y151 HydrophobicContact CZ-CD2 3.63Å; F144-Y151 AromaticContact CZ-CG 3.89Å; F144-Y151 HydrophobicContact CZ-CG 3.89Å; C147-Y151 PolarHBondContact O-N 3.1Å; C147-Y151 VanDerWaalsContact O-N 3.08Å; P148-Y151 WeakPolarHBondContact O-CB 3.37Å; P148-Y151 PolarHBondContact O-N 3.44Å; W149-Y151 VanDerWaalsContact C-N 3.35Å; Y151-Y153 VanDerWaalsContact C-N 3.32Å; Y151-Y153 PolarHBondContact O-N 2.93Å; Y151-I154 PolarHBondContact O-N 3.23Å; Y151-R155 HydrophobicContact CE1-CB 4.47Å; Y151-R155 WeakPolarHBondContact O-CB 3.47Å; Y151-R155 PolarHBondContact O-N 2.98Å
152	T	84.2	Confident	78.6	Confident	22 Å²	22	59.3 Å²	59.3	14%	0.135	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-39	-180	-50.4	0	0	0	0	112.2	I129 L132 P148 W149 R155 H156	I129-T152 HydrophobicContact CG2-CG2 4.16Å; L132-T152 VanDerWaalsContact CD2-CB 3.47Å; L132-T152 HydrophobicContact CD2-CG2 3.27Å; L132-T152 HydrophobicContact CG-CG2 4.3Å; P148-T152 PolarHBondContact O-N 3.45Å; P148-T152 PolarHBondContact O-OG1 3.25Å; P148-T152 VanDerWaalsContact O-OG1 3.1Å; W149-T152 PolarHBondContact O-N 3.01Å; T152-R155 PolarHBondContact O-N 2.63Å; T152-H156 WeakPolarHBondContact O-CB 3.17Å; T152-H156 PolarHBondContact O-N 2.9Å
153	Y	87.1	Confident	81.2	Confident	29 Å²	29	57 Å²	57	11%	0.114	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-50.9	173.7	-173.9	-86.6	0	0	0	111.8	P97 W120 I123 A127 I129 W149 R150 Y151 H156 K157	P97-Y153 HydrophobicContact CB-CE1 3.82Å; P97-Y153 HydrophobicContact CG-CD1 4.25Å; P97-Y153 HydrophobicContact CG-CE1 3.27Å; P97-Y153 HydrophobicContact CG-CE2 4.29Å; P97-Y153 WeakPolarHBondContact CG-OH 3.44Å; W120-Y153 HydrophobicContact CE3-CD1 4.46Å; W120-Y153 HydrophobicContact CE3-CG 4.07Å; W120-Y153 AromaticContact CZ3-CD1 3.7Å; W120-Y153 HydrophobicContact CZ3-CD1 3.7Å; W120-Y153 HydrophobicContact CZ3-CD2 4.45Å; W120-Y153 HydrophobicContact CZ3-CE1 4.39Å; W120-Y153 AromaticContact CZ3-CG 3.76Å; W120-Y153 HydrophobicContact CZ3-CG 3.76Å; I123-Y153 HydrophobicContact CG2-CD2 3.67Å; I123-Y153 HydrophobicContact CG2-CE2 3.54Å; A127-Y153 HydrophobicContact CB-CE2 4.15Å; I129-Y153 HydrophobicContact CD1-CD2 3.39Å; I129-Y153 HydrophobicContact CD1-CE2 3.85Å; I129-Y153 HydrophobicContact CD1-CG 4.15Å; W149-Y153 WeakPolarHBondContact O-CB 3.28Å; W149-Y153 PolarHBondContact O-N 3.44Å; R150-Y153 PolarHBondContact O-N 3.2Å; Y151-Y153 VanDerWaalsContact C-N 3.32Å; Y151-Y153 PolarHBondContact O-N 2.93Å; Y153-H156 PolarHBondContact O-N 3.34Å; Y153-K157 HydrophobicContact CD1-CG 4.11Å; Y153-K157 HydrophobicContact CE1-CG 3.54Å; Y153-K157 PolarHBondContact O-N 3.31Å; Y153-K157 VanDerWaalsContact OH-CE 3.26Å; Y153-K157 WeakPolarHBondContact OH-CE 3.33Å
154	I	86.6	Confident	83.8	Confident	81 Å²	81	55.3 Å²	55.3	42%	0.415	27%	0.272	S	S	.	.	H	α-helix	trans	-61.6	-48.6	-179.4	-67.3	167.8	0	0	0	110	R150 Y151 H156 K157 T158	R150-I154 HydrophobicContact CG-CD1 3.87Å; R150-I154 VanDerWaalsContact O-CG1 3.28Å; R150-I154 WeakPolarHBondContact O-CG1 3.38Å; R150-I154 PolarHBondContact O-N 2.97Å; Y151-I154 PolarHBondContact O-N 3.23Å; I154-H156 PolarHBondContact O-N 2.8Å; I154-K157 PolarHBondContact O-N 3.08Å; I154-T158 WeakPolarHBondContact O-CB 3.32Å; I154-T158 PolarHBondContact O-N 3.44Å; I154-T158 PolarHBondContact O-OG1 3.37Å; I154-T158 VanDerWaalsContact O-OG1 3.06Å
155	R	86.3	Confident	85.7	Confident	70 Å²	70	60.9 Å²	60.9	26%	0.264	29%	0.29	S	S	.	.	H	α-helix	trans	-55.1	-49.8	176.8	-179.6	179.5	170.4	-166.2	-3.4	111.3	Y151 T152 K157 T158 V159 D506	Y151-R155 HydrophobicContact CE1-CB 4.47Å; Y151-R155 WeakPolarHBondContact O-CB 3.47Å; Y151-R155 PolarHBondContact O-N 2.98Å; T152-R155 PolarHBondContact O-N 2.63Å; R155-K157 VanDerWaalsContact C-N 3.34Å; R155-K157 PolarHBondContact O-N 3.01Å; R155-T158 PolarHBondContact O-N 3Å; R155-V159 HydrophobicContact CG-CG2 4.49Å; R155-V159 WeakPolarHBondContact O-CG2 3.47Å; R155-V159 PolarHBondContact O-N 2.65Å; R155-D506 IonicContact CZ-OD1 3.19Å; R155-D506 IonicContact CZ-OD2 2.75Å; R155-D506 VanDerWaalsContact NE-CG 3.32Å; R155-D506 IonicContact NE-OD1 3.71Å; R155-D506 PolarHBondContact NE-OD1 3.04Å; R155-D506 IonicContact NE-OD2 3.57Å; R155-D506 PolarHBondContact NE-OD2 3.36Å; R155-D506 IonicContact NH2-OD1 3.96Å; R155-D506 IonicContact NH2-OD2 3.11Å; R155-D506 PolarHBondContact NH2-OD2 3.21Å
156	H	86	Confident	86.9	Confident	46 Å²	46	51.9 Å²	51.9	21%	0.213	26%	0.256	C	S	.	.	H	α-helix	trans	-57.6	-45.9	177.6	177.8	-78.6	0	0	0	111.9	I129 T152 Y153 I154 V159 E160	I129-H156 HydrophobicContact CD1-CB 3.96Å; I129-H156 HydrophobicContact CG1-CB 4.24Å; I129-H156 HydrophobicContact CG2-CB 3.89Å; T152-H156 WeakPolarHBondContact O-CB 3.17Å; T152-H156 PolarHBondContact O-N 2.9Å; Y153-H156 PolarHBondContact O-N 3.34Å; I154-H156 PolarHBondContact O-N 2.8Å; H156-V159 PolarHBondContact O-N 3.3Å; H156-E160 IonicContact CE1-OE2 3.97Å; H156-E160 IonicContact ND1-OE2 3.96Å; H156-E160 VanDerWaalsContact O-CB 3.32Å; H156-E160 WeakPolarHBondContact O-CB 3.2Å; H156-E160 PolarHBondContact O-N 2.8Å
157	K	87.3	Confident	87.4	Confident	81 Å²	81	54.7 Å²	54.7	35%	0.352	27%	0.269	S	S	.	.	H	α-helix	trans	-66.8	-35.8	177.8	-72.3	-61.7	175.7	-166.7	0	113.1	Y153 I154 R155 E160 A161	Y153-K157 HydrophobicContact CD1-CG 4.11Å; Y153-K157 HydrophobicContact CE1-CG 3.54Å; Y153-K157 PolarHBondContact O-N 3.31Å; Y153-K157 VanDerWaalsContact OH-CE 3.26Å; Y153-K157 WeakPolarHBondContact OH-CE 3.33Å; I154-K157 PolarHBondContact O-N 3.08Å; R155-K157 VanDerWaalsContact C-N 3.34Å; R155-K157 PolarHBondContact O-N 3.01Å; K157-E160 WeakPolarHBondContact CD-OE2 3.45Å; K157-E160 IonicContact NZ-OE1 3.19Å; K157-E160 IonicContact NZ-OE2 3.94Å; K157-E160 PolarHBondContact NZ-OE2 3.41Å; K157-A161 VanDerWaalsContact O-CB 3.32Å; K157-A161 WeakPolarHBondContact O-CB 3.33Å; K157-A161 PolarHBondContact O-N 2.87Å
158	T	88.5	Confident	87.4	Confident	63 Å²	63	55.7 Å²	55.7	39%	0.387	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-47.9	173	-62.5	0	0	0	0	111	I154 R155 E160 A161 N162	I154-T158 WeakPolarHBondContact O-CB 3.32Å; I154-T158 PolarHBondContact O-N 3.44Å; I154-T158 PolarHBondContact O-OG1 3.37Å; I154-T158 VanDerWaalsContact O-OG1 3.06Å; R155-T158 PolarHBondContact O-N 3Å; T158-E160 PolarHBondContact O-N 3.08Å; T158-A161 WeakPolarHBondContact O-CB 3.41Å; T158-A161 PolarHBondContact O-N 3.32Å; T158-N162 WeakPolarHBondContact O-CB 3.48Å; T158-N162 PolarHBondContact O-N 3.4Å; T158-N162 PolarHBondContact O-OD1 3.49Å
159	V	89.3	Confident	87.5	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.067	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-46.7	176.9	173.6	0	0	0	0	110.7	R155 H156 A161 N162 W163 M482 T483 F505 D506	R155-V159 HydrophobicContact CG-CG2 4.49Å; R155-V159 WeakPolarHBondContact O-CG2 3.47Å; R155-V159 PolarHBondContact O-N 2.65Å; H156-V159 PolarHBondContact O-N 3.3Å; V159-A161 VanDerWaalsContact C-N 3.3Å; V159-A161 PolarHBondContact O-N 2.76Å; V159-N162 WeakPolarHBondContact O-CB 3.2Å; V159-N162 PolarHBondContact O-N 2.75Å; V159-N162 VanDerWaalsContact O-N 3.1Å; V159-W163 VanDerWaalsContact O-CD1 3.25Å; V159-W163 PolarHBondContact O-N 2.78Å; V159-M482 WeakPolarHBondContact CG1-O 3.3Å; V159-T483 HydrophobicContact CG1-CG2 4.42Å; V159-F505 HydrophobicContact CG1-CB 4.31Å; V159-D506 HydrophobicContact CG2-CB 3.77Å; V159-D506 VanDerWaalsContact CG2-CG 3.45Å
160	E	89.3	Confident	87.6	Confident	26 Å²	26	59.3 Å²	59.3	12%	0.121	29%	0.288	C	S	.	.	H	α-helix	trans	-57.9	-40.8	175.9	-172.8	-178.6	178.5	0	0	112.1	H156 K157 T158 R164	H156-E160 IonicContact CE1-OE2 3.97Å; H156-E160 IonicContact ND1-OE2 3.96Å; H156-E160 VanDerWaalsContact O-CB 3.32Å; H156-E160 WeakPolarHBondContact O-CB 3.2Å; H156-E160 PolarHBondContact O-N 2.8Å; K157-E160 WeakPolarHBondContact CD-OE2 3.45Å; K157-E160 IonicContact NZ-OE1 3.19Å; K157-E160 IonicContact NZ-OE2 3.94Å; K157-E160 PolarHBondContact NZ-OE2 3.41Å; T158-E160 PolarHBondContact O-N 3.08Å; E160-R164 PolarHBondContact O-N 3.09Å; E160-R164 IonicContact OE1-CZ 3.64Å; E160-R164 IonicContact OE1-NH1 3.84Å; E160-R164 PolarHBondContact OE1-NH1 2.73Å; E160-R164 IonicContact OE1-NH2 2.78Å
161	A	91.1	Very high	87.9	Confident	52 Å²	52	62.4 Å²	62.4	43%	0.43	31%	0.305	S	S	.	.	H	α-helix	trans	-68.4	-38.5	174.5	0	0	0	0	0	112.3	K157 T158 V159 R164 R165 G166	K157-A161 VanDerWaalsContact O-CB 3.32Å; K157-A161 WeakPolarHBondContact O-CB 3.33Å; K157-A161 PolarHBondContact O-N 2.87Å; T158-A161 WeakPolarHBondContact O-CB 3.41Å; T158-A161 PolarHBondContact O-N 3.32Å; V159-A161 VanDerWaalsContact C-N 3.3Å; V159-A161 PolarHBondContact O-N 2.76Å; A161-R164 PolarHBondContact O-N 3.07Å; A161-R165 PolarHBondContact O-N 3.1Å; A161-G166 PolarHBondContact O-N 2.9Å; A161-G166 VanDerWaalsContact O-N 3.1Å
162	N	93	Very high	88.4	Confident	26 Å²	26	60.1 Å²	60.1	14%	0.139	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-45.5	177.4	-71.8	-14.9	0	0	0	111.3	T158 V159 R164 G166 F505	T158-N162 WeakPolarHBondContact O-CB 3.48Å; T158-N162 PolarHBondContact O-N 3.4Å; T158-N162 PolarHBondContact O-OD1 3.49Å; V159-N162 WeakPolarHBondContact O-CB 3.2Å; V159-N162 PolarHBondContact O-N 2.75Å; V159-N162 VanDerWaalsContact O-N 3.1Å; N162-R164 PolarHBondContact O-N 2.78Å; N162-G166 CarbonylContact O-C 3.54Å; N162-G166 WeakPolarHBondContact O-CA 3.46Å; N162-G166 PolarHBondContact O-N 3.44Å; N162-F505 HydrophobicContact CB-CB 4.16Å; N162-F505 HydrophobicContact CB-CD1 4.11Å; N162-F505 PolarHBondContact ND2-O 2.73Å
163	W	93.9	Very high	89	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-56.9	-50.2	172.4	-83.3	100.7	0	0	0	112.1	V159 L435 L439 V441 L451 L463 A480 M482 L485 F505	V159-W163 VanDerWaalsContact O-CD1 3.25Å; V159-W163 PolarHBondContact O-N 2.78Å; W163-L435 HydrophobicContact CH2-CD1 4.11Å; W163-L435 HydrophobicContact CZ2-CD1 4.06Å; W163-L435 HydrophobicContact CZ3-CD1 4.46Å; W163-L439 HydrophobicContact CB-CD1 3.79Å; W163-L439 HydrophobicContact CG-CD1 4.17Å; W163-V441 HydrophobicContact CH2-CG2 4.2Å; W163-V441 HydrophobicContact CZ3-CG2 3.77Å; W163-L451 HydrophobicContact CB-CD2 4.4Å; W163-L451 HydrophobicContact CE3-CD1 4.07Å; W163-L451 HydrophobicContact CZ3-CD1 4.42Å; W163-L451 WeakPolarHBondContact O-CD2 3.39Å; W163-L463 HydrophobicContact CE3-CD1 4.02Å; W163-L463 HydrophobicContact CZ3-CD1 3.7Å; W163-A480 HydrophobicContact CH2-CB 4.18Å; W163-M482 PolarHBondContact NE1-O 2.76Å; W163-L485 HydrophobicContact CH2-CB 3.75Å; W163-L485 HydrophobicContact CZ3-CB 4.25Å; W163-L485 HydrophobicContact CZ3-CD2 4.41Å; W163-F505 AromaticContact CD1-CG 3.95Å; W163-F505 HydrophobicContact CD2-CD1 4.25Å; W163-F505 AromaticContact CD2-CD2 3.72Å; W163-F505 HydrophobicContact CD2-CD2 3.72Å; W163-F505 HydrophobicContact CD2-CE1 4.33Å; W163-F505 AromaticContact CD2-CE2 3.81Å; W163-F505 HydrophobicContact CD2-CE2 3.81Å; W163-F505 AromaticContact CD2-CG 3.94Å; W163-F505 HydrophobicContact CD2-CG 3.94Å; W163-F505 HydrophobicContact CD2-CZ 4.13Å; W163-F505 AromaticContact CE2-CD2 3.35Å; W163-F505 AromaticContact CE2-CE2 3.76Å; W163-F505 AromaticContact CE2-CG 3.82Å; W163-F505 HydrophobicContact CE3-CD2 4.14Å; W163-F505 HydrophobicContact CE3-CE1 4.34Å; W163-F505 AromaticContact CE3-CE2 3.73Å; W163-F505 HydrophobicContact CE3-CE2 3.73Å; W163-F505 AromaticContact CE3-CZ 3.85Å; W163-F505 HydrophobicContact CE3-CZ 3.85Å; W163-F505 HydrophobicContact CG-CB 4.42Å; W163-F505 HydrophobicContact CG-CD1 4.2Å; W163-F505 HydrophobicContact CG-CD2 4.31Å; W163-F505 HydrophobicContact CG-CG 4.05Å; W163-F505 AromaticContact CH2-CD2 3.99Å; W163-F505 HydrophobicContact CH2-CD2 3.99Å; W163-F505 AromaticContact CH2-CE2 3.64Å; W163-F505 HydrophobicContact CH2-CE2 3.64Å; W163-F505 HydrophobicContact CH2-CZ 4.48Å; W163-F505 AromaticContact CZ2-CD2 3.51Å; W163-F505 HydrophobicContact CZ2-CD2 3.51Å; W163-F505 AromaticContact CZ2-CE2 3.68Å; W163-F505 HydrophobicContact CZ2-CE2 3.68Å; W163-F505 HydrophobicContact CZ2-CG 4.41Å; W163-F505 HydrophobicContact CZ3-CD2 4.27Å; W163-F505 AromaticContact CZ3-CE2 3.65Å; W163-F505 HydrophobicContact CZ3-CE2 3.65Å; W163-F505 HydrophobicContact CZ3-CZ 4.04Å; W163-F505 AromaticContact NE1-CD2 3.73Å; W163-F505 AromaticContact NE1-CG 3.79Å
164	R	94	Very high	89.5	Confident	69 Å²	69	61.8 Å²	61.8	26%	0.26	31%	0.308	S	S	.	.	H	α-helix	trans	-74.6	-39.2	-172.7	-72	-169.4	169.7	121.3	-3.2	114	E160 A161 N162 L439 D453 I460	E160-R164 PolarHBondContact O-N 3.09Å; E160-R164 IonicContact OE1-CZ 3.64Å; E160-R164 IonicContact OE1-NH1 3.84Å; E160-R164 PolarHBondContact OE1-NH1 2.73Å; E160-R164 IonicContact OE1-NH2 2.78Å; A161-R164 PolarHBondContact O-N 3.07Å; N162-R164 PolarHBondContact O-N 2.78Å; R164-L439 HydrophobicContact CG-CD2 4.3Å; R164-D453 IonicContact CZ-OD2 2.65Å; R164-D453 IonicContact NH2-OD2 2.79Å; R164-D453 PolarHBondContact NH2-OD2 3.01Å; R164-I460 HydrophobicContact CB-CG2 4.24Å; R164-I460 HydrophobicContact CG-CD1 4.3Å; R164-I460 HydrophobicContact CG-CG2 4.46Å; R164-I460 VanDerWaalsContact O-CG2 3.28Å; R164-I460 WeakPolarHBondContact O-CG2 3.43Å
165	R	91.8	Very high	89.9	Confident	225 Å²	225	64.9 Å²	64.9	85%	0.849	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140	-22.3	-167.8	-59.5	-176.2	-174.9	-172.9	1.1	114.5	A161 R461	A161-R165 PolarHBondContact O-N 3.1Å; R165-R461 VanDerWaalsContact C-NH1 3.32Å; R165-R461 PolarHBondContact O-NH1 2.75Å
166	G	83.2	Confident	90.4	Very high	19 Å²	19	62 Å²	62	20%	0.196	31%	0.306	C	S	.	.	S	Bend	trans	-76.5	-179.2	-179.7	0	0	0	0	0	113.7	A161 N162 R461	A161-G166 PolarHBondContact O-N 2.9Å; A161-G166 VanDerWaalsContact O-N 3.1Å; N162-G166 CarbonylContact O-C 3.54Å; N162-G166 WeakPolarHBondContact O-CA 3.46Å; N162-G166 PolarHBondContact O-N 3.44Å; G166-R461 PolarHBondContact O-NH1 2.73Å
167	C	81.8	Confident	90.9	Very high	94 Å²	94	60 Å²	60	64%	0.635	30%	0.297	S	S	*	.			trans	-96.6	154.7	164.6	-63.4	0	0	0	0	108.4	L169	C167-L169 PolarHBondContact O-N 3.1Å
168	P	81.9	Confident	91.3	Very high	38 Å²	38	61.3 Å²	61.3	25%	0.247	31%	0.308	C	S	.	.			trans	-50.6	134	162.3	-20.3	31	0	0	0	109.1	M503 D504 F505	P168-M503 HydrophobicContact CB-CB 3.94Å; P168-M503 HydrophobicContact CB-CG 4.12Å; P168-M503 HydrophobicContact CG-CB 4Å; P168-M503 HydrophobicContact CG-CG 3.87Å; P168-M503 HydrophobicContact CG-SD 3.67Å; P168-D504 CarbonylContact C-O 3.53Å; P168-D504 WeakPolarHBondContact CA-O 3.45Å; P168-F505 HydrophobicContact CG-CE1 4.13Å; P168-F505 HydrophobicContact CG-CZ 4.28Å
169	L	85.7	Confident	91.6	Very high	79 Å²	79	65.3 Å²	65.3	41%	0.414	32%	0.322	S	S	.	.	S	Bend	trans	-71.9	-27.9	177.5	-67.7	166	0	0	0	110.9	C167 D504 D506 N507	C167-L169 PolarHBondContact O-N 3.1Å; L169-D504 PolarHBondContact N-O 2.82Å; L169-D506 WeakPolarHBondContact CD1-O 3.28Å; L169-N507 HydrophobicContact CD1-CB 4.2Å; L169-N507 WeakPolarHBondContact CD1-OD1 3.46Å
170	R	88.3	Confident	92	Very high	75 Å²	75	68.3 Å²	68.3	28%	0.283	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	139.8	174	179.9	177.1	58.8	-169.4	-6.8	109.7	L172 S207 M503 D504	R170-L172 HydrophobicContact CG-CD1 4.47Å; R170-L172 HydrophobicContact CG-CD2 4.22Å; R170-L172 HydrophobicContact CG-CG 4Å; R170-S207 VanDerWaalsContact CZ-O 3.32Å; R170-S207 PolarHBondContact NH1-O 2.83Å; R170-M503 WeakPolarHBondContact O-CA 3.48Å; R170-D504 HydrophobicContact CB-CB 4.07Å; R170-D504 IonicContact CZ-OD2 3.07Å; R170-D504 IonicContact NE-OD2 2.66Å; R170-D504 IonicContact NH2-OD2 2.7Å; R170-D504 PolarHBondContact NH2-OD2 2.79Å; R170-D504 PolarHBondContact O-N 3.29Å
171	E	92.8	Very high	92.4	Very high	121 Å²	121	68.7 Å²	68.7	57%	0.565	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.7	169.8	-171.9	176.3	163.5	0	0	108.6	V502 M503	E171-V502 CarbonylContact C-O 3.49Å; E171-V502 VanDerWaalsContact CA-O 3.28Å; E171-V502 WeakPolarHBondContact CA-O 3.24Å; E171-M503 HydrophobicContact CG-CG 4.16Å
172	L	94.8	Very high	92.7	Very high	36 Å²	36	66.2 Å²	66.2	19%	0.188	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.7	177.7	-61.5	169.7	0	0	0	109.6	R170 L174 A206 V502	R170-L172 HydrophobicContact CG-CD1 4.47Å; R170-L172 HydrophobicContact CG-CD2 4.22Å; R170-L172 HydrophobicContact CG-CG 4Å; L172-L174 HydrophobicContact CB-CD1 3.89Å; L172-A206 WeakPolarHBondContact CD1-O 3.5Å; L172-V502 HydrophobicContact CB-CB 4.27Å; L172-V502 PolarHBondContact N-O 3.26Å; L172-V502 PolarHBondContact O-N 3.33Å
173	L	95.9	Very high	93	Very high	83 Å²	83	65.6 Å²	65.6	44%	0.435	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	117.1	177.8	-170.7	159	0	0	0	108.9	R175 K499 L501	L173-R175 HydrophobicContact CD2-CB 4.46Å; L173-R175 HydrophobicContact CD2-CG 3.23Å; L173-K499 HydrophobicContact CD1-CD 3.68Å; L173-K499 HydrophobicContact CD2-CB 4.26Å; L173-K499 HydrophobicContact CD2-CD 3.95Å; L173-K499 HydrophobicContact CG-CD 3.74Å; L173-L501 HydrophobicContact CB-CD2 4.34Å; L173-L501 HydrophobicContact CD1-CD2 4.21Å; L173-L501 HydrophobicContact CG-CD2 4.06Å
174	L	97.1	Very high	93.2	Very high	2 Å²	2	65.7 Å²	65.7	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	101.1	-175.8	-62	66.6	0	0	0	107.9	L172 I192 W204 K499 I500 V502	L172-L174 HydrophobicContact CB-CD1 3.89Å; L174-I192 HydrophobicContact CD2-CD1 4.26Å; L174-W204 HydrophobicContact CB-CD2 4.32Å; L174-W204 HydrophobicContact CB-CE3 3.82Å; L174-W204 HydrophobicContact CB-CZ3 3.94Å; L174-W204 HydrophobicContact CD2-CB 3.61Å; L174-W204 HydrophobicContact CD2-CD2 3.89Å; L174-W204 HydrophobicContact CD2-CE3 3.91Å; L174-W204 HydrophobicContact CD2-CG 3.78Å; L174-W204 HydrophobicContact CG-CE3 4.2Å; L174-K499 CarbonylContact O-C 3.51Å; L174-K499 VanDerWaalsContact O-CA 3.32Å; L174-K499 WeakPolarHBondContact O-CA 3.32Å; L174-K499 WeakPolarHBondContact O-CB 3.2Å; L174-I500 HydrophobicContact CB-CB 4.07Å; L174-I500 HydrophobicContact CD2-CB 4.43Å; L174-I500 PolarHBondContact N-O 3.28Å; L174-I500 PolarHBondContact O-N 3.27Å; L174-V502 HydrophobicContact CD1-CB 4.23Å; L174-V502 HydrophobicContact CD1-CG2 3.58Å; L174-V502 HydrophobicContact CD2-CG2 4.2Å
175	R	96.5	Very high	93.4	Very high	147 Å²	147	62.4 Å²	62.4	56%	0.555	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	133.6	179.9	-63.2	-175.4	173.5	-92.8	2	111.2	L173 W204 D497	L173-R175 HydrophobicContact CD2-CB 4.46Å; L173-R175 HydrophobicContact CD2-CG 3.23Å; R175-W204 VanDerWaalsContact O-CH2 3.24Å; R175-W204 WeakPolarHBondContact O-CH2 3.18Å; R175-D497 IonicContact CZ-OD2 3.67Å; R175-D497 IonicContact NH1-OD2 2.79Å; R175-D497 PolarHBondContact NH1-OD2 3.35Å; R175-D497 IonicContact NH2-OD2 3.79Å
176	G	95.6	Very high	93.7	Very high	8 Å²	8	52.9 Å²	52.9	8%	0.082	27%	0.27	C	S	.	.			trans	162.1	170.6	170.8	0	0	0	0	0	111.7	D178 T498	G176-D178 VanDerWaalsContact C-N 3.33Å; G176-T498 WeakPolarHBondContact O-CG2 3.32Å
177	H	97.5	Very high	94.3	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.019	27%	0.271	C	S	.	.	S	Bend	trans	61.5	41.9	-163.7	-53.7	-66.7	0	0	0	111.5	E179 H180 I182 S194 S196 D198 T200 T498	H177-E179 PolarHBondContact O-N 3.2Å; H177-H180 HydrophobicContact CB-CB 4.48Å; H177-H180 WeakPolarHBondContact O-CB 3.27Å; H177-H180 PolarHBondContact O-N 2.93Å; H177-I182 HydrophobicContact CB-CG1 4.32Å; H177-S194 PolarHBondContact CD2-OG 2.91Å; H177-S194 PolarHBondContact NE2-OG 2.79Å; H177-S196 WeakPolarHBondContact ND1-CB 3.17Å; H177-D198 IonicContact CE1-OD1 2.76Å; H177-D198 IonicContact CE1-OD2 3.46Å; H177-D198 IonicContact CG-OD2 3.19Å; H177-D198 IonicContact ND1-OD1 3.87Å; H177-D198 PolarHBondContact ND1-OD1 3.4Å; H177-D198 VanDerWaalsContact ND1-OD1 3.16Å; H177-D198 IonicContact ND1-OD2 3.62Å; H177-D198 PolarHBondContact ND1-OD2 2.89Å; H177-T200 PolarHBondContact CE1-OG1 2.89Å; H177-T200 VanDerWaalsContact CE1-OG1 3.24Å; H177-T200 PolarHBondContact ND1-OG1 3.5Å; H177-T498 HydrophobicContact CB-CG2 3.93Å; H177-T498 WeakPolarHBondContact O-CB 3.33Å; H177-T498 WeakPolarHBondContact O-CG2 3.36Å; H177-T498 PolarHBondContact O-OG1 3.48Å
178	D	95.7	Very high	94.8	Very high	110 Å²	110	52.9 Å²	52.9	59%	0.588	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	135.1	-174.7	-54.6	-21	0	0	0	111.1	G176 H180	G176-D178 VanDerWaalsContact C-N 3.33Å; D178-H180 PolarHBondContact O-CD2 3.18Å; D178-H180 PolarHBondContact O-N 2.76Å
179	E	94.4	Very high	95.2	Very high	146 Å²	146	56.4 Å²	56.4	68%	0.682	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	4.7	-176.4	-55.8	-63.7	164.1	0	0	116.1	H177	H177-E179 PolarHBondContact O-N 3.2Å
180	H	97.6	Very high	95.5	Very high	75 Å²	75	54.6 Å²	54.6	35%	0.347	26%	0.262	S	S	.	.	S	Bend	trans	-117	161.4	-175.7	-78.9	-84.6	0	0	0	112.2	H177 D178 S196 D197 D198 T498	H177-H180 HydrophobicContact CB-CB 4.48Å; H177-H180 WeakPolarHBondContact O-CB 3.27Å; H177-H180 PolarHBondContact O-N 2.93Å; D178-H180 PolarHBondContact O-CD2 3.18Å; D178-H180 PolarHBondContact O-N 2.76Å; H180-S196 WeakPolarHBondContact CB-OG 3.15Å; H180-D197 VanDerWaalsContact CB-OD1 3.24Å; H180-D197 WeakPolarHBondContact CB-OD1 3.37Å; H180-D197 IonicContact CG-OD1 2.7Å; H180-D197 IonicContact ND1-OD1 3.93Å; H180-D197 PolarHBondContact ND1-OD1 3.27Å; H180-D197 VanDerWaalsContact ND1-OD1 3.11Å; H180-D198 HydrophobicContact CB-CB 3.83Å; H180-D198 VanDerWaalsContact CG-CB 3.47Å; H180-D198 PolarHBondContact ND1-N 3.11Å; H180-T498 WeakPolarHBondContact O-CB 3.41Å; H180-T498 VanDerWaalsContact O-CG2 3.27Å; H180-T498 WeakPolarHBondContact O-CG2 3.19Å; H180-T498 PolarHBondContact O-OG1 3.33Å
181	V	97.8	Very high	95.8	Very high	33 Å²	33	53 Å²	53	20%	0.2	26%	0.257	C	S	.	.			trans	-92.6	132.5	-178.6	178.5	0	0	0	0	109.9	T183 S196 D197 W476	V181-T183 HydrophobicContact CG1-CG2 4.38Å; V181-T183 PolarHBondContact O-N 3.05Å; V181-S196 WeakPolarHBondContact O-CA 3.48Å; V181-S196 VanDerWaalsContact O-CB 3.31Å; V181-S196 WeakPolarHBondContact O-CB 3.16Å; V181-S196 PolarHBondContact O-OG 2.83Å; V181-D197 PolarHBondContact N-OD1 3.49Å; V181-D197 PolarHBondContact O-N 2.86Å; V181-W476 HydrophobicContact CB-CH2 4.47Å; V181-W476 HydrophobicContact CB-CZ2 4.35Å; V181-W476 HydrophobicContact CG1-CD2 3.87Å; V181-W476 HydrophobicContact CG1-CE3 4.22Å; V181-W476 HydrophobicContact CG1-CG 4.26Å; V181-W476 HydrophobicContact CG1-CH2 4.49Å; V181-W476 HydrophobicContact CG1-CZ2 4.2Å; V181-W476 HydrophobicContact CG2-CH2 4.47Å; V181-W476 HydrophobicContact CG2-CZ2 4.02Å
182	I	98.5	Very high	96	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	104.8	167.9	-61.8	171.9	0	0	0	108.5	H177 C184 G195 W476 A488 T498 I500	H177-I182 HydrophobicContact CB-CG1 4.32Å; I182-C184 WeakPolarHBondContact CG2-O 3.32Å; I182-G195 CarbonylContact C-O 3.53Å; I182-W476 HydrophobicContact CB-CE3 3.97Å; I182-W476 HydrophobicContact CB-CZ3 4.08Å; I182-W476 HydrophobicContact CG1-CZ3 4.16Å; I182-W476 VanDerWaalsContact N-CZ3 3.33Å; I182-A488 HydrophobicContact CB-CB 3.85Å; I182-A488 HydrophobicContact CD1-CB 4.02Å; I182-A488 HydrophobicContact CG2-CB 3.67Å; I182-T498 HydrophobicContact CD1-CG2 3.85Å; I182-T498 HydrophobicContact CG1-CG2 3.81Å; I182-I500 HydrophobicContact CD1-CD1 4.41Å; I182-I500 HydrophobicContact CD1-CG1 3.74Å
183	T	98.3	Very high	96.2	Very high	13 Å²	13	45.8 Å²	45.8	8%	0.08	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	-27.1	-172.8	67.1	0	0	0	0	112.5	V181 G195 D197 V222 W223 R477	V181-T183 HydrophobicContact CG1-CG2 4.38Å; V181-T183 PolarHBondContact O-N 3.05Å; T183-G195 PolarHBondContact N-O 3.26Å; T183-G195 PolarHBondContact OG1-O 3.27Å; T183-D197 HydrophobicContact CG2-CB 4.39Å; T183-V222 WeakPolarHBondContact CB-O 3.31Å; T183-V222 WeakPolarHBondContact CG2-O 3.42Å; T183-V222 PolarHBondContact OG1-O 2.8Å; T183-W223 HydrophobicContact CG2-CD2 4.19Å; T183-W223 HydrophobicContact CG2-CE3 4.08Å; T183-W223 HydrophobicContact CG2-CH2 4.34Å; T183-W223 HydrophobicContact CG2-CZ2 4.43Å; T183-W223 HydrophobicContact CG2-CZ3 4.16Å; T183-R477 VanDerWaalsContact O-CD 3.23Å; T183-R477 WeakPolarHBondContact O-CD 2.86Å; T183-R477 PolarHBondContact O-NH1 3.15Å
184	C	98.4	Very high	96.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.007	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.5	176.9	61.5	0	0	0	0	113.1	I182 S194 G195 S225	I182-C184 WeakPolarHBondContact CG2-O 3.32Å; C184-S194 WeakPolarHBondContact O-CA 3.39Å; C184-G195 PolarHBondContact N-O 2.91Å; C184-G195 PolarHBondContact O-N 2.66Å; C184-G195 VanDerWaalsContact SG-CA 3.52Å; C184-S225 PolarHBondContact SG-OG 3.04Å
185	L	98.3	Very high	96.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	127.8	-175.7	-174.1	68.1	0	0	0	108.7	I192 V193 R479 I486 A488 I500	L185-I192 HydrophobicContact CD1-CG2 3.65Å; L185-V193 CarbonylContact C-O 3.54Å; L185-V193 WeakPolarHBondContact CA-O 3.45Å; L185-R479 HydrophobicContact CB-CG 4.48Å; L185-R479 HydrophobicContact CD2-CB 4.28Å; L185-R479 HydrophobicContact CD2-CG 3.96Å; L185-R479 HydrophobicContact CG-CG 4Å; L185-R479 PolarHBondContact O-NE 3.33Å; L185-R479 PolarHBondContact O-NH2 3.47Å; L185-I486 HydrophobicContact CD1-CG2 4.26Å; L185-I486 HydrophobicContact CD2-CG2 4.01Å; L185-A488 HydrophobicContact CD2-CB 4.41Å; L185-I500 HydrophobicContact CD1-CD1 4.28Å
186	Q	97.7	Very high	96.5	Very high	26 Å²	26	34.7 Å²	34.7	12%	0.121	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	153	174.1	-58.9	-64.8	2.7	0	0	110.2	I192 V193 S225 V227	Q186-I192 WeakPolarHBondContact O-CA 3.46Å; Q186-V193 HydrophobicContact CB-CB 4.32Å; Q186-V193 PolarHBondContact N-O 2.82Å; Q186-V193 PolarHBondContact O-N 2.84Å; Q186-S225 WeakPolarHBondContact CG-OG 3.08Å; Q186-S225 PolarHBondContact NE2-O 2.84Å; Q186-V227 HydrophobicContact CB-CG2 3.73Å; Q186-V227 HydrophobicContact CG-CG2 4.28Å
187	V	95.2	Very high	96.7	Very high	37 Å²	37	36.9 Å²	36.9	22%	0.224	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.3	177.2	-179.1	0	0	0	0	107.4	K191 I192 R479 T481 I486	V187-K191 WeakPolarHBondContact CA-O 3.37Å; V187-I192 HydrophobicContact CG2-CG1 4.29Å; V187-R479 HydrophobicContact CB-CB 4.48Å; V187-R479 HydrophobicContact CG2-CB 3.57Å; V187-R479 HydrophobicContact CG2-CG 3.97Å; V187-T481 HydrophobicContact CG1-CG2 4.24Å; V187-I486 HydrophobicContact CG1-CD1 4.38Å; V187-I486 HydrophobicContact CG2-CB 4.32Å; V187-I486 HydrophobicContact CG2-CD1 3.94Å; V187-I486 HydrophobicContact CG2-CG1 4.04Å
188	W	93.7	Very high	96.7	Very high	76 Å²	76	38.3 Å²	38.3	29%	0.288	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	114.8	175	179.9	92.4	0	0	0	108.2	D190 K191 V227 E229 D230 G231	W188-D190 PolarHBondContact O-N 2.86Å; W188-K191 PolarHBondContact N-O 2.92Å; W188-K191 PolarHBondContact O-N 2.77Å; W188-V227 HydrophobicContact CB-CB 4.44Å; W188-V227 HydrophobicContact CB-CG1 3.89Å; W188-V227 HydrophobicContact CG-CG1 4.02Å; W188-E229 PolarHBondContact NE1-O 3.48Å; W188-D230 VanDerWaalsContact CZ2-C 3.43Å; W188-D230 VanDerWaalsContact CZ2-O 3.27Å; W188-D230 WeakPolarHBondContact CZ2-O 3.41Å; W188-G231 VanDerWaalsContact CZ2-CA 3.44Å
189	N	89.7	Confident	96.8	Very high	112 Å²	112	35.9 Å²	35.9	60%	0.599	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	-126.5	-169.6	-60	-33	0	0	0	110.7	K191	N189-K191 VanDerWaalsContact C-N 3.32Å; N189-K191 PolarHBondContact O-N 3.3Å
190	D	91.3	Very high	97.1	Very high	40 Å²	40	29.9 Å²	29.9	21%	0.214	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	5.8	177.6	-167.1	44.5	0	0	0	114	W188 C205 A206 S207	W188-D190 PolarHBondContact O-N 2.86Å; D190-C205 CarbonylContact O-C 3.55Å; D190-C205 PolarHBondContact OD2-SG 2.88Å; D190-A206 WeakPolarHBondContact O-CB 3.27Å; D190-A206 PolarHBondContact O-N 3.23Å; D190-A206 WeakPolarHBondContact OD1-CB 3.28Å; D190-A206 PolarHBondContact OD1-N 3.02Å; D190-S207 WeakPolarHBondContact OD1-CB 3.5Å; D190-S207 PolarHBondContact OD1-N 3.18Å; D190-S207 PolarHBondContact OD1-OG 3.05Å; D190-S207 WeakPolarHBondContact OD2-CB 3.42Å; D190-S207 PolarHBondContact OD2-OG 3.45Å
191	K	95	Very high	97.1	Very high	43 Å²	43	26.3 Å²	26.3	19%	0.187	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.5	178.6	-67.7	-175	178.2	-177.5	0	111.1	V187 W188 N189 I203 W204 A248 E249	V187-K191 WeakPolarHBondContact CA-O 3.37Å; W188-K191 PolarHBondContact N-O 2.92Å; W188-K191 PolarHBondContact O-N 2.77Å; N189-K191 VanDerWaalsContact C-N 3.32Å; N189-K191 PolarHBondContact O-N 3.3Å; K191-I203 HydrophobicContact CB-CG2 4.42Å; K191-I203 HydrophobicContact CD-CG2 4.31Å; K191-I203 HydrophobicContact CG-CG2 4.47Å; K191-W204 WeakPolarHBondContact CA-O 3.48Å; K191-A248 PolarHBondContact NZ-O 2.9Å; K191-E249 IonicContact NZ-OE2 3.31Å; K191-E249 PolarHBondContact NZ-OE2 2.87Å
192	I	97.7	Very high	97.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	137.5	168.9	-61.1	161.7	0	0	0	108.1	L174 L185 Q186 V187 I203 W204 A206 I486 I500 V502	L174-I192 HydrophobicContact CD2-CD1 4.26Å; L185-I192 HydrophobicContact CD1-CG2 3.65Å; Q186-I192 WeakPolarHBondContact O-CA 3.46Å; V187-I192 HydrophobicContact CG2-CG1 4.29Å; I192-I203 CarbonylContact O-C 3.54Å; I192-I203 WeakPolarHBondContact O-CA 3.23Å; I192-W204 HydrophobicContact CB-CB 4.21Å; I192-W204 PolarHBondContact N-O 2.62Å; I192-W204 PolarHBondContact O-N 2.89Å; I192-A206 HydrophobicContact CD1-CB 3.64Å; I192-A206 HydrophobicContact CG1-CB 3.94Å; I192-I486 HydrophobicContact CD1-CG1 3.87Å; I192-I486 HydrophobicContact CD1-CG2 3.86Å; I192-I486 HydrophobicContact CG1-CG1 4.23Å; I192-I486 HydrophobicContact CG1-CG2 4.29Å; I192-I486 HydrophobicContact CG2-CG2 4.14Å; I192-I500 HydrophobicContact CG2-CD1 4.15Å; I192-V502 HydrophobicContact CD1-CG2 3.47Å; I192-V502 VanDerWaalsContact CD1-CG2 3.47Å
193	V	98.4	Very high	97.2	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.024	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.6	173.2	-174.1	0	0	0	0	109.1	L185 Q186 L201 K202 I203 V227 I234	L185-V193 CarbonylContact C-O 3.54Å; L185-V193 WeakPolarHBondContact CA-O 3.45Å; Q186-V193 HydrophobicContact CB-CB 4.32Å; Q186-V193 PolarHBondContact N-O 2.82Å; Q186-V193 PolarHBondContact O-N 2.84Å; V193-L201 HydrophobicContact CG1-CD2 4.07Å; V193-K202 WeakPolarHBondContact CA-O 3.39Å; V193-I203 HydrophobicContact CG2-CG1 4.38Å; V193-V227 HydrophobicContact CG2-CG2 4.03Å; V193-I234 HydrophobicContact CG1-CD1 4.28Å; V193-I234 HydrophobicContact CG1-CG2 4.23Å; V193-I234 HydrophobicContact CG2-CD1 3.74Å; V193-I234 HydrophobicContact CG2-CG1 4.35Å
194	S	98.7	Very high	97.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.4	170.8	55.9	0	0	0	0	110.2	H177 C184 L201 K202 W204	H177-S194 PolarHBondContact CD2-OG 2.91Å; H177-S194 PolarHBondContact NE2-OG 2.79Å; C184-S194 WeakPolarHBondContact O-CA 3.39Å; S194-L201 CarbonylContact O-C 3.59Å; S194-L201 WeakPolarHBondContact O-CA 3.27Å; S194-L201 WeakPolarHBondContact O-CB 3.49Å; S194-K202 PolarHBondContact N-O 3.36Å; S194-K202 PolarHBondContact O-N 3.19Å; S194-W204 PolarHBondContact OG-NE1 2.76Å
195	G	98.8	Very high	97	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.9	167.3	0	0	0	0	0	110.1	I182 T183 C184	I182-G195 CarbonylContact C-O 3.53Å; T183-G195 PolarHBondContact N-O 3.26Å; T183-G195 PolarHBondContact OG1-O 3.27Å; C184-G195 PolarHBondContact N-O 2.91Å; C184-G195 PolarHBondContact O-N 2.66Å; C184-G195 VanDerWaalsContact SG-CA 3.52Å
196	S	98.8	Very high	96.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	165.3	-170.1	179.2	0	0	0	0	112.5	H177 H180 V181 D198 T200 V222	H177-S196 WeakPolarHBondContact ND1-CB 3.17Å; H180-S196 WeakPolarHBondContact CB-OG 3.15Å; V181-S196 WeakPolarHBondContact O-CA 3.48Å; V181-S196 VanDerWaalsContact O-CB 3.31Å; V181-S196 WeakPolarHBondContact O-CB 3.16Å; V181-S196 PolarHBondContact O-OG 2.83Å; S196-D198 WeakPolarHBondContact CB-OD1 3.13Å; S196-D198 PolarHBondContact O-N 3.19Å; S196-D198 PolarHBondContact OG-N 2.95Å; S196-T200 PolarHBondContact N-O 2.92Å; S196-T200 VanDerWaalsContact N-O 3.12Å; S196-V222 WeakPolarHBondContact O-CB 3.36Å; S196-V222 PolarHBondContact O-N 2.87Å
197	D	98.5	Very high	96.3	Very high	53 Å²	53	26.9 Å²	26.9	28%	0.283	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	5	169	64.3	-1.4	0	0	0	113.8	H180 V181 T183 D199	H180-D197 VanDerWaalsContact CB-OD1 3.24Å; H180-D197 WeakPolarHBondContact CB-OD1 3.37Å; H180-D197 IonicContact CG-OD1 2.7Å; H180-D197 IonicContact ND1-OD1 3.93Å; H180-D197 PolarHBondContact ND1-OD1 3.27Å; H180-D197 VanDerWaalsContact ND1-OD1 3.11Å; V181-D197 PolarHBondContact N-OD1 3.49Å; V181-D197 PolarHBondContact O-N 2.86Å; T183-D197 HydrophobicContact CG2-CB 4.39Å; D197-D199 PolarHBondContact O-N 3.29Å
198	D	98.4	Very high	96.2	Very high	35 Å²	35	28.7 Å²	28.7	19%	0.187	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	14.8	165.5	80.2	-8.5	0	0	0	114.3	H177 H180 S196 T200	H177-D198 IonicContact CE1-OD1 2.76Å; H177-D198 IonicContact CE1-OD2 3.46Å; H177-D198 IonicContact CG-OD2 3.19Å; H177-D198 IonicContact ND1-OD1 3.87Å; H177-D198 PolarHBondContact ND1-OD1 3.4Å; H177-D198 VanDerWaalsContact ND1-OD1 3.16Å; H177-D198 IonicContact ND1-OD2 3.62Å; H177-D198 PolarHBondContact ND1-OD2 2.89Å; H180-D198 HydrophobicContact CB-CB 3.83Å; H180-D198 VanDerWaalsContact CG-CB 3.47Å; H180-D198 PolarHBondContact ND1-N 3.11Å; S196-D198 WeakPolarHBondContact CB-OD1 3.13Å; S196-D198 PolarHBondContact O-N 3.19Å; S196-D198 PolarHBondContact OG-N 2.95Å; D198-T200 VanDerWaalsContact CG-OG1 3.26Å; D198-T200 PolarHBondContact O-N 2.86Å; D198-T200 VanDerWaalsContact O-N 3.15Å; D198-T200 WeakPolarHBondContact OD1-CA 3.28Å; D198-T200 WeakPolarHBondContact OD1-CB 3.44Å; D198-T200 PolarHBondContact OD1-N 3.44Å; D198-T200 PolarHBondContact OD1-OG1 2.85Å; D198-T200 PolarHBondContact OD2-OG1 2.92Å
199	D	98.7	Very high	96.2	Very high	59 Å²	59	25.9 Å²	25.9	32%	0.316	15%	0.145	S	C	.	.	S	Bend	trans	66.9	0.7	-176.7	-51.8	-16.1	0	0	0	115.5	D197 H218 G220 G221	D197-D199 PolarHBondContact O-N 3.29Å; D199-H218 WeakPolarHBondContact O-CB 3.47Å; D199-G220 VanDerWaalsContact CG-C 3.5Å; D199-G220 WeakPolarHBondContact OD1-CA 3.27Å; D199-G220 PolarHBondContact OD1-N 2.84Å; D199-G220 PolarHBondContact OD2-N 3.13Å; D199-G221 WeakPolarHBondContact OD1-CA 3.34Å; D199-G221 PolarHBondContact OD1-N 3.23Å
200	T	98.8	Very high	96.5	Very high	20 Å²	20	29.1 Å²	29.1	12%	0.123	15%	0.149	C	C	.	.			trans	-110.5	163.3	-176.7	77.6	0	0	0	0	113.8	H177 S196 D198 T214 T216	H177-T200 PolarHBondContact CE1-OG1 2.89Å; H177-T200 VanDerWaalsContact CE1-OG1 3.24Å; H177-T200 PolarHBondContact ND1-OG1 3.5Å; S196-T200 PolarHBondContact N-O 2.92Å; S196-T200 VanDerWaalsContact N-O 3.12Å; D198-T200 VanDerWaalsContact CG-OG1 3.26Å; D198-T200 PolarHBondContact O-N 2.86Å; D198-T200 VanDerWaalsContact O-N 3.15Å; D198-T200 WeakPolarHBondContact OD1-CA 3.28Å; D198-T200 WeakPolarHBondContact OD1-CB 3.44Å; D198-T200 PolarHBondContact OD1-N 3.44Å; D198-T200 PolarHBondContact OD1-OG1 2.85Å; D198-T200 PolarHBondContact OD2-OG1 2.92Å; T200-T214 HydrophobicContact CG2-CG2 4.2Å; T200-T216 HydrophobicContact CG2-CG2 4.26Å
201	L	98.8	Very high	96.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	153.8	156.1	-57.2	91.6	0	0	0	109.5	V193 S194 T214 L215 V222 I234 W246	V193-L201 HydrophobicContact CG1-CD2 4.07Å; S194-L201 CarbonylContact O-C 3.59Å; S194-L201 WeakPolarHBondContact O-CA 3.27Å; S194-L201 WeakPolarHBondContact O-CB 3.49Å; L201-T214 CarbonylContact O-C 3.57Å; L201-T214 WeakPolarHBondContact O-CA 3.48Å; L201-L215 HydrophobicContact CB-CB 4.1Å; L201-L215 HydrophobicContact CB-CD1 4.07Å; L201-L215 HydrophobicContact CB-CG 4.22Å; L201-L215 HydrophobicContact CD1-CB 4.49Å; L201-L215 PolarHBondContact N-O 2.95Å; L201-L215 PolarHBondContact O-N 2.89Å; L201-V222 HydrophobicContact CD1-CB 4.49Å; L201-V222 HydrophobicContact CD1-CG1 4.1Å; L201-V222 HydrophobicContact CD1-CG2 3.7Å; L201-V222 HydrophobicContact CD2-CG1 4.16Å; L201-V222 HydrophobicContact CG-CG1 4.05Å; L201-V222 HydrophobicContact CG-CG2 4.18Å; L201-I234 HydrophobicContact CD2-CG2 4.44Å; L201-W246 HydrophobicContact CD1-CZ2 4.35Å
202	K	98.7	Very high	96.9	Very high	33 Å²	33	32 Å²	32	14%	0.143	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.6	172.2	-67.9	174.7	-174.7	-69.7	0	110.1	V193 S194 W204 L213 T214	V193-K202 WeakPolarHBondContact CA-O 3.39Å; S194-K202 PolarHBondContact N-O 3.36Å; S194-K202 PolarHBondContact O-N 3.19Å; K202-W204 HydrophobicContact CB-CD2 4.48Å; K202-W204 HydrophobicContact CB-CH2 4.47Å; K202-W204 HydrophobicContact CB-CZ2 3.54Å; K202-W204 HydrophobicContact CD-CH2 3.78Å; K202-W204 HydrophobicContact CD-CZ2 3.41Å; K202-W204 VanDerWaalsContact CD-CZ2 3.41Å; K202-W204 HydrophobicContact CG-CZ2 4.09Å; K202-W204 PolarHBondContact O-NE1 2.97Å; K202-L213 WeakPolarHBondContact CA-O 3.26Å; K202-T214 HydrophobicContact CG-CG2 4.2Å; K202-T214 PolarHBondContact NZ-OG1 3.41Å
203	I	98.4	Very high	97	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.7	172.7	-53.8	177	0	0	0	107.6	K191 I192 V193 L212 L213 L215 I234	K191-I203 HydrophobicContact CB-CG2 4.42Å; K191-I203 HydrophobicContact CD-CG2 4.31Å; K191-I203 HydrophobicContact CG-CG2 4.47Å; I192-I203 CarbonylContact O-C 3.54Å; I192-I203 WeakPolarHBondContact O-CA 3.23Å; V193-I203 HydrophobicContact CG2-CG1 4.38Å; I203-L212 HydrophobicContact CG2-CD1 4.4Å; I203-L212 PolarHBondContact O-N 3.24Å; I203-L213 HydrophobicContact CB-CB 4.23Å; I203-L213 HydrophobicContact CD1-CB 4.29Å; I203-L213 HydrophobicContact CD1-CD1 3.89Å; I203-L213 HydrophobicContact CG1-CB 4.42Å; I203-L213 PolarHBondContact N-O 2.74Å; I203-L213 PolarHBondContact O-N 3.44Å; I203-L215 HydrophobicContact CD1-CD1 4.2Å; I203-L215 HydrophobicContact CD1-CD2 4.1Å; I203-L215 HydrophobicContact CD1-CG 4.43Å; I203-L215 HydrophobicContact CG1-CD1 4.35Å; I203-L215 HydrophobicContact CG1-CG 4.44Å; I203-I234 HydrophobicContact CD1-CD1 3.39Å; I203-I234 HydrophobicContact CG1-CD1 3.88Å
204	W	98.1	Very high	97	Very high	7 Å²	7	36.8 Å²	36.8	3%	0.027	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	149.9	-176.8	-40.2	79.1	0	0	0	110.6	L174 R175 K191 I192 S194 K202 R210 C211 I500	L174-W204 HydrophobicContact CB-CD2 4.32Å; L174-W204 HydrophobicContact CB-CE3 3.82Å; L174-W204 HydrophobicContact CB-CZ3 3.94Å; L174-W204 HydrophobicContact CD2-CB 3.61Å; L174-W204 HydrophobicContact CD2-CD2 3.89Å; L174-W204 HydrophobicContact CD2-CE3 3.91Å; L174-W204 HydrophobicContact CD2-CG 3.78Å; L174-W204 HydrophobicContact CG-CE3 4.2Å; R175-W204 VanDerWaalsContact O-CH2 3.24Å; R175-W204 WeakPolarHBondContact O-CH2 3.18Å; K191-W204 WeakPolarHBondContact CA-O 3.48Å; I192-W204 HydrophobicContact CB-CB 4.21Å; I192-W204 PolarHBondContact N-O 2.62Å; I192-W204 PolarHBondContact O-N 2.89Å; S194-W204 PolarHBondContact OG-NE1 2.76Å; K202-W204 HydrophobicContact CB-CD2 4.48Å; K202-W204 HydrophobicContact CB-CH2 4.47Å; K202-W204 HydrophobicContact CB-CZ2 3.54Å; K202-W204 HydrophobicContact CD-CH2 3.78Å; K202-W204 HydrophobicContact CD-CZ2 3.41Å; K202-W204 VanDerWaalsContact CD-CZ2 3.41Å; K202-W204 HydrophobicContact CG-CZ2 4.09Å; K202-W204 PolarHBondContact O-NE1 2.97Å; W204-R210 WeakPolarHBondContact CA-O 3.32Å; W204-C211 HydrophobicContact CD2-CB 4.34Å; W204-C211 HydrophobicContact CE3-CB 3.55Å; W204-C211 HydrophobicContact CH2-CB 4.27Å; W204-C211 HydrophobicContact CZ3-CB 3.52Å; W204-I500 HydrophobicContact CZ2-CD1 4.38Å
205	C	95.4	Very high	97	Very high	15 Å²	15	36.9 Å²	36.9	10%	0.101	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	114.8	167.9	172	0	0	0	0	108.7	D190 S207 T208 G209 R210 L212	D190-C205 CarbonylContact O-C 3.55Å; D190-C205 PolarHBondContact OD2-SG 2.88Å; C205-S207 VanDerWaalsContact C-N 3.28Å; C205-S207 PolarHBondContact O-N 3.1Å; C205-S207 PolarHBondContact SG-OG 2.89Å; C205-T208 VanDerWaalsContact CB-OG1 3.3Å; C205-T208 WeakPolarHBondContact CB-OG1 3.24Å; C205-T208 PolarHBondContact O-N 3.2Å; C205-T208 PolarHBondContact SG-OG1 2.7Å; C205-G209 WeakPolarHBondContact O-CA 3.45Å; C205-G209 PolarHBondContact O-N 2.89Å; C205-R210 PolarHBondContact N-O 2.85Å; C205-L212 HydrophobicContact CB-CD1 4.01Å; C205-L212 HydrophobicContact CB-CD2 3.98Å; C205-L212 HydrophobicContact CB-CG 4.01Å
206	A	92.7	Very high	97	Very high	2 Å²	2	41.7 Å²	41.7	2%	0.017	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-31.4	-175.3	0	0	0	0	0	112	L172 D190 I192 L510	L172-A206 WeakPolarHBondContact CD1-O 3.5Å; D190-A206 WeakPolarHBondContact O-CB 3.27Å; D190-A206 PolarHBondContact O-N 3.23Å; D190-A206 WeakPolarHBondContact OD1-CB 3.28Å; D190-A206 PolarHBondContact OD1-N 3.02Å; I192-A206 HydrophobicContact CD1-CB 3.64Å; I192-A206 HydrophobicContact CG1-CB 3.94Å; A206-L510 HydrophobicContact CB-CD1 3.79Å
207	S	89.4	Confident	96.9	Very high	28 Å²	28	43.1 Å²	43.1	20%	0.196	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-31.1	178.9	63.9	0	0	0	0	113.9	R170 D190 C205	R170-S207 VanDerWaalsContact CZ-O 3.32Å; R170-S207 PolarHBondContact NH1-O 2.83Å; D190-S207 WeakPolarHBondContact OD1-CB 3.5Å; D190-S207 PolarHBondContact OD1-N 3.18Å; D190-S207 PolarHBondContact OD1-OG 3.05Å; D190-S207 WeakPolarHBondContact OD2-CB 3.42Å; D190-S207 PolarHBondContact OD2-OG 3.45Å; C205-S207 VanDerWaalsContact C-N 3.28Å; C205-S207 PolarHBondContact O-N 3.1Å; C205-S207 PolarHBondContact SG-OG 2.89Å
208	T	92.4	Very high	96.9	Very high	76 Å²	76	41.2 Å²	41.2	47%	0.466	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-15.6	-178.4	65.8	0	0	0	0	113.8	C205 R210	C205-T208 VanDerWaalsContact CB-OG1 3.3Å; C205-T208 WeakPolarHBondContact CB-OG1 3.24Å; C205-T208 PolarHBondContact O-N 3.2Å; C205-T208 PolarHBondContact SG-OG1 2.7Å; T208-R210 PolarHBondContact O-N 2.96Å; T208-R210 WeakPolarHBondContact OG1-CG 3.33Å; T208-R210 PolarHBondContact OG1-N 2.83Å
209	G	93.3	Very high	96.9	Very high	16 Å²	16	45 Å²	45	17%	0.165	26%	0.256	C	S	.	.			trans	72	4.4	-173.3	0	0	0	0	0	113.9	C205	C205-G209 WeakPolarHBondContact O-CA 3.45Å; C205-G209 PolarHBondContact O-N 2.89Å
210	R	96.5	Very high	96.9	Very high	181 Å²	181	42.6 Å²	42.6	68%	0.683	25%	0.245	S	C	*	.			trans	-77.4	136	-177.8	-62.7	-176.3	76.8	-176.2	3.4	111	W204 C205 T208 L212	W204-R210 WeakPolarHBondContact CA-O 3.32Å; C205-R210 PolarHBondContact N-O 2.85Å; T208-R210 PolarHBondContact O-N 2.96Å; T208-R210 WeakPolarHBondContact OG1-CG 3.33Å; T208-R210 PolarHBondContact OG1-N 2.83Å; R210-L212 PolarHBondContact O-N 2.78Å
211	C	97.8	Very high	96.9	Very high	55 Å²	55	42 Å²	42	37%	0.372	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	115.3	162.9	-167	0	0	0	0	108.1	W204	W204-C211 HydrophobicContact CD2-CB 4.34Å; W204-C211 HydrophobicContact CE3-CB 3.55Å; W204-C211 HydrophobicContact CH2-CB 4.27Å; W204-C211 HydrophobicContact CZ3-CB 3.52Å
212	L	97.7	Very high	96.9	Very high	88 Å²	88	42 Å²	42	46%	0.461	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-45.3	178.8	-61	178.2	0	0	0	110.7	I203 C205 R210	I203-L212 HydrophobicContact CG2-CD1 4.4Å; I203-L212 PolarHBondContact O-N 3.24Å; C205-L212 HydrophobicContact CB-CD1 4.01Å; C205-L212 HydrophobicContact CB-CD2 3.98Å; C205-L212 HydrophobicContact CB-CG 4.01Å; R210-L212 PolarHBondContact O-N 2.78Å
213	L	98.2	Very high	96.9	Very high	44 Å²	44	44.3 Å²	44.3	23%	0.23	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	144.9	-173.1	-62.8	168.7	0	0	0	110.7	K202 I203 L215	K202-L213 WeakPolarHBondContact CA-O 3.26Å; I203-L213 HydrophobicContact CB-CB 4.23Å; I203-L213 HydrophobicContact CD1-CB 4.29Å; I203-L213 HydrophobicContact CD1-CD1 3.89Å; I203-L213 HydrophobicContact CG1-CB 4.42Å; I203-L213 PolarHBondContact N-O 2.74Å; I203-L213 PolarHBondContact O-N 3.44Å; L213-L215 HydrophobicContact CB-CD2 4.2Å
214	T	98.5	Very high	97	Very high	61 Å²	61	44.7 Å²	44.7	37%	0.374	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118.9	163.2	-61.6	0	0	0	0	108.1	T200 L201 K202 T216	T200-T214 HydrophobicContact CG2-CG2 4.2Å; L201-T214 CarbonylContact O-C 3.57Å; L201-T214 WeakPolarHBondContact O-CA 3.48Å; K202-T214 HydrophobicContact CG-CG2 4.2Å; K202-T214 PolarHBondContact NZ-OG1 3.41Å; T214-T216 HydrophobicContact CG2-CG2 4.02Å; T214-T216 PolarHBondContact O-N 2.88Å
215	L	98.6	Very high	97	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	102.2	-179.1	-47.4	-172.3	0	0	0	108.8	L201 I203 L213 I234 W246 G251	L201-L215 HydrophobicContact CB-CB 4.1Å; L201-L215 HydrophobicContact CB-CD1 4.07Å; L201-L215 HydrophobicContact CB-CG 4.22Å; L201-L215 HydrophobicContact CD1-CB 4.49Å; L201-L215 PolarHBondContact N-O 2.95Å; L201-L215 PolarHBondContact O-N 2.89Å; I203-L215 HydrophobicContact CD1-CD1 4.2Å; I203-L215 HydrophobicContact CD1-CD2 4.1Å; I203-L215 HydrophobicContact CD1-CG 4.43Å; I203-L215 HydrophobicContact CG1-CD1 4.35Å; I203-L215 HydrophobicContact CG1-CG 4.44Å; L213-L215 HydrophobicContact CB-CD2 4.2Å; L215-I234 HydrophobicContact CD1-CD1 4.3Å; L215-W246 HydrophobicContact CB-CD2 4.08Å; L215-W246 HydrophobicContact CB-CE3 3.87Å; L215-W246 HydrophobicContact CB-CH2 4.25Å; L215-W246 HydrophobicContact CB-CZ2 4.43Å; L215-W246 HydrophobicContact CB-CZ3 3.96Å; L215-W246 HydrophobicContact CD1-CB 3.92Å; L215-W246 HydrophobicContact CD1-CD2 3.92Å; L215-W246 HydrophobicContact CD1-CE3 4.34Å; L215-W246 HydrophobicContact CD1-CG 3.72Å; L215-W246 HydrophobicContact CG-CE3 4.47Å; L215-G251 VanDerWaalsContact CD2-CA 3.4Å
216	T	98.4	Very high	97.1	Very high	101 Å²	101	46.3 Å²	46.3	62%	0.62	26%	0.26	S	S	*	.			trans	-103.1	140.3	178.3	56.9	0	0	0	0	110.7	T200 T214 W246	T200-T216 HydrophobicContact CG2-CG2 4.26Å; T214-T216 HydrophobicContact CG2-CG2 4.02Å; T214-T216 PolarHBondContact O-N 2.88Å; T216-W246 WeakPolarHBondContact O-CH2 3.36Å; T216-W246 WeakPolarHBondContact O-CZ3 3.32Å
217	G	98	Very high	97.4	Very high	31 Å²	31	47.6 Å²	47.6	32%	0.32	27%	0.268	S	S	.	.			trans	155.6	-26.3	171.7	0	0	0	0	0	114.3	R244	G217-R244 VanDerWaalsContact C-CZ 3.43Å; G217-R244 PolarHBondContact O-NE 2.82Å; G217-R244 PolarHBondContact O-NH2 2.86Å
218	H	98.7	Very high	97.8	Very high	12 Å²	12	46.4 Å²	46.4	6%	0.056	26%	0.26	C	S	.	.			trans	-62.1	147.4	166.7	-81.8	-60.3	0	0	0	110.3	D199 S236 S238 D240 T242 W246	D199-H218 WeakPolarHBondContact O-CB 3.47Å; H218-S236 PolarHBondContact CD2-OG 2.95Å; H218-S236 PolarHBondContact NE2-OG 2.83Å; H218-S238 VanDerWaalsContact CE1-CB 3.41Å; H218-S238 WeakPolarHBondContact CE1-CB 3.34Å; H218-S238 WeakPolarHBondContact ND1-CB 3.46Å; H218-D240 VanDerWaalsContact CA-OD2 3.23Å; H218-D240 WeakPolarHBondContact CA-OD2 3.36Å; H218-D240 WeakPolarHBondContact CB-OD2 3.22Å; H218-D240 IonicContact CE1-OD1 2.69Å; H218-D240 IonicContact CE1-OD2 3.86Å; H218-D240 IonicContact CG-OD2 2.67Å; H218-D240 IonicContact ND1-OD1 3.34Å; H218-D240 PolarHBondContact ND1-OD1 2.8Å; H218-D240 IonicContact ND1-OD2 2.64Å; H218-D240 PolarHBondContact ND1-OD2 3.47Å; H218-T242 PolarHBondContact CE1-OG1 2.82Å; H218-T242 VanDerWaalsContact CE1-OG1 3.27Å; H218-T242 PolarHBondContact ND1-OG1 2.9Å; H218-W246 AromaticContact CD2-CZ2 3.97Å
219	T	98.7	Very high	97.9	Very high	116 Å²	116	48.2 Å²	48.2	71%	0.712	26%	0.263	S	S	*	.	S	Bend	trans	-112.3	33.6	177.4	64.6	0	0	0	0	110.8	D240	T219-D240 PolarHBondContact N-OD2 2.88Å; T219-D240 WeakPolarHBondContact OG1-CB 3.35Å
220	G	98.6	Very high	97.9	Very high	8 Å²	8	51.3 Å²	51.3	8%	0.082	28%	0.276	C	S	.	.	S	Bend	trans	179.6	155.2	-177.4	0	0	0	0	0	110.7	D199 V222 S238 T239	D199-G220 VanDerWaalsContact CG-C 3.5Å; D199-G220 WeakPolarHBondContact OD1-CA 3.27Å; D199-G220 PolarHBondContact OD1-N 2.84Å; D199-G220 PolarHBondContact OD2-N 3.13Å; G220-V222 PolarHBondContact O-N 2.74Å; G220-S238 PolarHBondContact O-OG 3.24Å; G220-T239 VanDerWaalsContact C-OG1 3.27Å; G220-T239 WeakPolarHBondContact CA-OG1 3.45Å
221	G	98.7	Very high	97.8	Very high	7 Å²	7	42.9 Å²	42.9	7%	0.072	25%	0.245	C	C	.	.			trans	-52.5	137.8	-173	0	0	0	0	0	114	D199 W223 S238 T239	D199-G221 WeakPolarHBondContact OD1-CA 3.34Å; D199-G221 PolarHBondContact OD1-N 3.23Å; G221-W223 VanDerWaalsContact O-CD1 3.27Å; G221-S238 CarbonylContact O-C 3.59Å; G221-S238 VanDerWaalsContact O-CA 3.27Å; G221-S238 WeakPolarHBondContact O-CA 3.39Å; G221-S238 PolarHBondContact O-OG 2.88Å; G221-T239 PolarHBondContact N-OG1 2.64Å; G221-T239 PolarHBondContact O-N 2.87Å
222	V	98.9	Very high	97.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	135.8	175	-177.2	0	0	0	0	108.2	T183 S196 L201 G220	T183-V222 WeakPolarHBondContact CB-O 3.31Å; T183-V222 WeakPolarHBondContact CG2-O 3.42Å; T183-V222 PolarHBondContact OG1-O 2.8Å; S196-V222 WeakPolarHBondContact O-CB 3.36Å; S196-V222 PolarHBondContact O-N 2.87Å; L201-V222 HydrophobicContact CD1-CB 4.49Å; L201-V222 HydrophobicContact CD1-CG1 4.1Å; L201-V222 HydrophobicContact CD1-CG2 3.7Å; L201-V222 HydrophobicContact CD2-CG1 4.16Å; L201-V222 HydrophobicContact CG-CG1 4.05Å; L201-V222 HydrophobicContact CG-CG2 4.18Å; G220-V222 PolarHBondContact O-N 2.74Å
223	W	98.8	Very high	97.7	Very high	82 Å²	82	47.2 Å²	47.2	31%	0.311	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	-11.4	-177.3	-79.9	87.9	0	0	0	114.7	T183 G221 G237 R265	T183-W223 HydrophobicContact CG2-CD2 4.19Å; T183-W223 HydrophobicContact CG2-CE3 4.08Å; T183-W223 HydrophobicContact CG2-CH2 4.34Å; T183-W223 HydrophobicContact CG2-CZ2 4.43Å; T183-W223 HydrophobicContact CG2-CZ3 4.16Å; G221-W223 VanDerWaalsContact O-CD1 3.27Å; W223-G237 PolarHBondContact N-O 3.44Å; W223-R265 PolarHBondContact O-NH1 2.99Å
224	S	98.6	Very high	97.7	Very high	8 Å²	8	45.2 Å²	45.2	6%	0.056	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	145.5	-179.2	54.9	0	0	0	0	109.8	S236 G237 L267	S224-S236 WeakPolarHBondContact O-CA 3.46Å; S224-G237 PolarHBondContact N-O 3.25Å; S224-G237 PolarHBondContact O-N 2.88Å; S224-L267 WeakPolarHBondContact OG-CG 3.42Å
225	S	98.7	Very high	97.7	Very high	4 Å²	4	42.4 Å²	42.4	3%	0.028	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	153.6	174.7	60.7	0	0	0	0	110.5	C184 Q186 A235	C184-S225 PolarHBondContact SG-OG 3.04Å; Q186-S225 WeakPolarHBondContact CG-OG 3.08Å; Q186-S225 PolarHBondContact NE2-O 2.84Å; S225-A235 CarbonylContact C-O 3.54Å; S225-A235 WeakPolarHBondContact CA-O 3.43Å
226	Q	98.6	Very high	97.7	Very high	52 Å²	52	42.3 Å²	42.3	24%	0.243	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	149.6	169.6	-67	-63.5	-9	0	0	109.2	I234 A235 L267 L269	Q226-I234 CarbonylContact O-C 3.52Å; Q226-I234 WeakPolarHBondContact O-CA 3.32Å; Q226-A235 PolarHBondContact N-O 3.04Å; Q226-A235 PolarHBondContact O-N 3.35Å; Q226-L267 HydrophobicContact CG-CB 3.74Å; Q226-L267 PolarHBondContact NE2-O 2.71Å; Q226-L269 HydrophobicContact CB-CB 3.82Å; Q226-L269 HydrophobicContact CB-CD2 4.08Å; Q226-L269 HydrophobicContact CG-CB 4.1Å
227	V	97.9	Very high	97.8	Very high	29 Å²	29	37.5 Å²	37.5	18%	0.176	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	132	171.7	-175	0	0	0	0	106.9	Q186 W188 V193 I234	Q186-V227 HydrophobicContact CB-CG2 3.73Å; Q186-V227 HydrophobicContact CG-CG2 4.28Å; W188-V227 HydrophobicContact CB-CB 4.44Å; W188-V227 HydrophobicContact CB-CG1 3.89Å; W188-V227 HydrophobicContact CG-CG1 4.02Å; V193-V227 HydrophobicContact CG2-CG2 4.03Å; V227-I234 HydrophobicContact CG2-CG1 4.37Å
228	A	97.3	Very high	97.8	Very high	3 Å²	3	36 Å²	36	3%	0.025	18%	0.175	C	C	.	.			trans	-63.2	155.1	175.3	0	0	0	0	0	110.9	D230 G231 R233 L269 I288	A228-D230 WeakPolarHBondContact CB-OD1 3.49Å; A228-D230 PolarHBondContact O-N 3.12Å; A228-G231 WeakPolarHBondContact O-CA 3.16Å; A228-G231 PolarHBondContact O-N 2.87Å; A228-R233 HydrophobicContact CB-CB 3.91Å; A228-R233 PolarHBondContact N-O 2.87Å; A228-L269 HydrophobicContact CB-CD2 3.97Å; A228-I288 HydrophobicContact CB-CD1 4.29Å
229	E	94.8	Very high	97.8	Very high	114 Å²	114	37.9 Å²	37.9	53%	0.533	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.1	-174.7	-63.1	-175.2	166.2	0	0	112.5	W188 G231 K270	W188-E229 PolarHBondContact NE1-O 3.48Å; E229-G231 VanDerWaalsContact C-N 3.27Å; E229-G231 PolarHBondContact O-N 3.37Å; E229-K270 VanDerWaalsContact OE1-CD 3.32Å; E229-K270 WeakPolarHBondContact OE1-CD 3.5Å; E229-K270 WeakPolarHBondContact OE1-CE 3.37Å; E229-K270 IonicContact OE1-NZ 3.48Å; E229-K270 PolarHBondContact OE1-NZ 2.89Å; E229-K270 IonicContact OE2-NZ 3.84Å
230	D	93.3	Very high	97.8	Very high	81 Å²	81	33.6 Å²	33.6	43%	0.433	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-6.8	175.5	73.6	-7.2	0	0	0	114.3	W188 A228 R232	W188-D230 VanDerWaalsContact CZ2-C 3.43Å; W188-D230 VanDerWaalsContact CZ2-O 3.27Å; W188-D230 WeakPolarHBondContact CZ2-O 3.41Å; A228-D230 WeakPolarHBondContact CB-OD1 3.49Å; A228-D230 PolarHBondContact O-N 3.12Å; D230-R232 HydrophobicContact CB-CG 4.36Å; D230-R232 PolarHBondContact O-N 3.02Å; D230-R232 WeakPolarHBondContact OD1-CB 3.3Å; D230-R232 PolarHBondContact OD1-N 2.93Å; D230-R232 WeakPolarHBondContact OD2-CD 3.4Å
231	G	94.6	Very high	97.8	Very high	4 Å²	4	40.1 Å²	40.1	4%	0.041	18%	0.182	C	C	.	.	S	Bend	trans	68.8	5.4	-177.8	0	0	0	0	0	115.7	W188 A228 E229 A248	W188-G231 VanDerWaalsContact CZ2-CA 3.44Å; A228-G231 WeakPolarHBondContact O-CA 3.16Å; A228-G231 PolarHBondContact O-N 2.87Å; E229-G231 VanDerWaalsContact C-N 3.27Å; E229-G231 PolarHBondContact O-N 3.37Å; G231-A248 VanDerWaalsContact O-CB 3.23Å; G231-A248 WeakPolarHBondContact O-CB 3.46Å
232	R	96.1	Very high	97.8	Very high	172 Å²	172	40.2 Å²	40.2	65%	0.649	18%	0.181	S	C	*	.	S	Bend	trans	-88.6	-22	-175	-62.5	-176.2	176.5	174.4	-3	113.3	D230 A248	D230-R232 HydrophobicContact CB-CG 4.36Å; D230-R232 PolarHBondContact O-N 3.02Å; D230-R232 WeakPolarHBondContact OD1-CB 3.3Å; D230-R232 PolarHBondContact OD1-N 2.93Å; D230-R232 WeakPolarHBondContact OD2-CD 3.4Å; R232-A248 PolarHBondContact O-N 3.16Å
233	R	97.6	Very high	97.8	Very high	61 Å²	61	40.2 Å²	40.2	23%	0.23	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.5	-178.3	-62.6	-69.5	-179.4	-109.3	7.3	111.1	A228 I245 W246 D247 I288	A228-R233 HydrophobicContact CB-CB 3.91Å; A228-R233 PolarHBondContact N-O 2.87Å; R233-I245 HydrophobicContact CB-CG2 4.36Å; R233-I245 HydrophobicContact CG-CG2 4.47Å; R233-W246 VanDerWaalsContact CA-O 3.31Å; R233-W246 WeakPolarHBondContact CA-O 3.22Å; R233-D247 IonicContact CZ-OD2 3.82Å; R233-D247 IonicContact NH1-OD2 3.88Å; R233-D247 PolarHBondContact NH1-OD2 2.87Å; R233-I288 HydrophobicContact CB-CD1 4.25Å; R233-I288 HydrophobicContact CG-CD1 4.44Å
234	I	98.6	Very high	97.8	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.6	169.3	-63	164.1	0	0	0	107.3	V193 L201 I203 L215 Q226 V227 I245 W246 A248	V193-I234 HydrophobicContact CG1-CD1 4.28Å; V193-I234 HydrophobicContact CG1-CG2 4.23Å; V193-I234 HydrophobicContact CG2-CD1 3.74Å; V193-I234 HydrophobicContact CG2-CG1 4.35Å; L201-I234 HydrophobicContact CD2-CG2 4.44Å; I203-I234 HydrophobicContact CD1-CD1 3.39Å; I203-I234 HydrophobicContact CG1-CD1 3.88Å; L215-I234 HydrophobicContact CD1-CD1 4.3Å; Q226-I234 CarbonylContact O-C 3.52Å; Q226-I234 WeakPolarHBondContact O-CA 3.32Å; V227-I234 HydrophobicContact CG2-CG1 4.37Å; I234-I245 CarbonylContact O-C 3.58Å; I234-I245 WeakPolarHBondContact O-CA 3.38Å; I234-W246 HydrophobicContact CB-CB 4.32Å; I234-W246 PolarHBondContact N-O 3.24Å; I234-W246 VanDerWaalsContact O-CD1 3.3Å; I234-W246 PolarHBondContact O-N 2.68Å; I234-A248 HydrophobicContact CD1-CB 3.91Å; I234-A248 HydrophobicContact CG1-CB 4.07Å
235	A	98.8	Very high	97.9	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.8	169.8	0	0	0	0	0	109.6	S225 Q226 R244 I245 L267 L274	S225-A235 CarbonylContact C-O 3.54Å; S225-A235 WeakPolarHBondContact CA-O 3.43Å; Q226-A235 PolarHBondContact N-O 3.04Å; Q226-A235 PolarHBondContact O-N 3.35Å; A235-R244 CarbonylContact C-O 3.58Å; A235-R244 WeakPolarHBondContact CA-O 3.35Å; A235-I245 HydrophobicContact CB-CD1 3.75Å; A235-L267 HydrophobicContact CB-CD1 4.28Å; A235-L274 HydrophobicContact CB-CD1 3.95Å; A235-L274 HydrophobicContact CB-CD2 3.75Å
236	S	98.9	Very high	97.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	143.1	174.2	60.1	0	0	0	0	111.8	H218 S224 V243 R244 W246	H218-S236 PolarHBondContact CD2-OG 2.95Å; H218-S236 PolarHBondContact NE2-OG 2.83Å; S224-S236 WeakPolarHBondContact O-CA 3.46Å; S236-V243 CarbonylContact O-C 3.55Å; S236-V243 WeakPolarHBondContact O-CA 3.46Å; S236-V243 WeakPolarHBondContact O-CG1 3.36Å; S236-R244 PolarHBondContact N-O 3.17Å; S236-R244 PolarHBondContact O-N 3.21Å; S236-W246 PolarHBondContact OG-NE1 3.41Å
237	G	98.9	Very high	97.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	133	176.2	0	0	0	0	0	111	W223 S224	W223-G237 PolarHBondContact N-O 3.44Å; S224-G237 PolarHBondContact N-O 3.25Å; S224-G237 PolarHBondContact O-N 2.88Å
238	S	98.9	Very high	97.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	165.6	-168.4	165.3	0	0	0	0	113.7	H218 G220 G221 D240 R241 T242 V264	H218-S238 VanDerWaalsContact CE1-CB 3.41Å; H218-S238 WeakPolarHBondContact CE1-CB 3.34Å; H218-S238 WeakPolarHBondContact ND1-CB 3.46Å; G220-S238 PolarHBondContact O-OG 3.24Å; G221-S238 CarbonylContact O-C 3.59Å; G221-S238 VanDerWaalsContact O-CA 3.27Å; G221-S238 WeakPolarHBondContact O-CA 3.39Å; G221-S238 PolarHBondContact O-OG 2.88Å; S238-D240 VanDerWaalsContact CB-OD1 3.31Å; S238-D240 WeakPolarHBondContact CB-OD1 3.28Å; S238-D240 PolarHBondContact O-N 2.5Å; S238-D240 PolarHBondContact OG-N 3.06Å; S238-D240 PolarHBondContact OG-OD1 3.05Å; S238-R241 PolarHBondContact O-N 3.49Å; S238-T242 PolarHBondContact N-O 2.69Å; S238-V264 PolarHBondContact O-N 3.36Å
239	T	98.9	Very high	97.8	Very high	51 Å²	51	42 Å²	42	31%	0.313	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.4	165.7	56.1	0	0	0	0	113.5	G220 G221 R241 T263	G220-T239 VanDerWaalsContact C-OG1 3.27Å; G220-T239 WeakPolarHBondContact CA-OG1 3.45Å; G221-T239 PolarHBondContact N-OG1 2.64Å; G221-T239 PolarHBondContact O-N 2.87Å; T239-R241 PolarHBondContact O-N 3.35Å; T239-R241 VanDerWaalsContact O-N 3.14Å; T239-T263 HydrophobicContact CG2-CG2 3.76Å
240	D	98.8	Very high	97.9	Very high	25 Å²	25	40.2 Å²	40.2	13%	0.134	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	1	172.1	76.5	8.5	0	0	0	113.8	H218 T219 S238 T242	H218-D240 VanDerWaalsContact CA-OD2 3.23Å; H218-D240 WeakPolarHBondContact CA-OD2 3.36Å; H218-D240 WeakPolarHBondContact CB-OD2 3.22Å; H218-D240 IonicContact CE1-OD1 2.69Å; H218-D240 IonicContact CE1-OD2 3.86Å; H218-D240 IonicContact CG-OD2 2.67Å; H218-D240 IonicContact ND1-OD1 3.34Å; H218-D240 PolarHBondContact ND1-OD1 2.8Å; H218-D240 IonicContact ND1-OD2 2.64Å; H218-D240 PolarHBondContact ND1-OD2 3.47Å; T219-D240 PolarHBondContact N-OD2 2.88Å; T219-D240 WeakPolarHBondContact OG1-CB 3.35Å; S238-D240 VanDerWaalsContact CB-OD1 3.31Å; S238-D240 WeakPolarHBondContact CB-OD1 3.28Å; S238-D240 PolarHBondContact O-N 2.5Å; S238-D240 PolarHBondContact OG-N 3.06Å; S238-D240 PolarHBondContact OG-OD1 3.05Å; D240-T242 VanDerWaalsContact CG-OG1 3.31Å; D240-T242 PolarHBondContact O-N 3.19Å; D240-T242 WeakPolarHBondContact OD1-CB 3.28Å; D240-T242 PolarHBondContact OD1-N 3.49Å; D240-T242 PolarHBondContact OD1-OG1 2.89Å; D240-T242 PolarHBondContact OD2-OG1 2.67Å
241	R	98.9	Very high	98.1	Very high	145 Å²	145	37 Å²	37	55%	0.547	17%	0.172	S	C	.	.	S	Bend	trans	74.5	6.5	174.7	-41.5	162.7	-171.7	171.2	1.9	113.9	S238 T239 H260 T261 S262	S238-R241 PolarHBondContact O-N 3.49Å; T239-R241 PolarHBondContact O-N 3.35Å; T239-R241 VanDerWaalsContact O-N 3.14Å; R241-H260 WeakPolarHBondContact CB-O 3.5Å; R241-H260 WeakPolarHBondContact O-CB 3.22Å; R241-T261 WeakPolarHBondContact CD-O 3.16Å; R241-S262 WeakPolarHBondContact CA-O 3.44Å
242	T	98.9	Very high	98.3	Very high	10 Å²	10	45.8 Å²	45.8	6%	0.061	20%	0.204	C	C	.	.			trans	-100.6	153.9	176.4	71.5	0	0	0	0	111.6	H218 S238 D240 Y258	H218-T242 PolarHBondContact CE1-OG1 2.82Å; H218-T242 VanDerWaalsContact CE1-OG1 3.27Å; H218-T242 PolarHBondContact ND1-OG1 2.9Å; S238-T242 PolarHBondContact N-O 2.69Å; D240-T242 VanDerWaalsContact CG-OG1 3.31Å; D240-T242 PolarHBondContact O-N 3.19Å; D240-T242 WeakPolarHBondContact OD1-CB 3.28Å; D240-T242 PolarHBondContact OD1-N 3.49Å; D240-T242 PolarHBondContact OD1-OG1 2.89Å; D240-T242 PolarHBondContact OD2-OG1 2.67Å; T242-Y258 HydrophobicContact CG2-CD1 3.88Å; T242-Y258 HydrophobicContact CG2-CE1 3.68Å
243	V	98.9	Very high	98.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	134	156.9	176.1	0	0	0	0	107.5	S236 I245 L257 V264 L267 L274	S236-V243 CarbonylContact O-C 3.55Å; S236-V243 WeakPolarHBondContact O-CA 3.46Å; S236-V243 WeakPolarHBondContact O-CG1 3.36Å; V243-I245 HydrophobicContact CG1-CD1 4.37Å; V243-L257 HydrophobicContact CB-CB 4.04Å; V243-L257 HydrophobicContact CB-CD1 4.03Å; V243-L257 HydrophobicContact CB-CG 4.29Å; V243-L257 HydrophobicContact CG1-CD1 3.85Å; V243-L257 HydrophobicContact CG1-CG 4.46Å; V243-L257 PolarHBondContact N-O 2.79Å; V243-L257 WeakPolarHBondContact O-CA 3.27Å; V243-L257 WeakPolarHBondContact O-CB 3.46Å; V243-L257 WeakPolarHBondContact O-CG 3.3Å; V243-L257 PolarHBondContact O-N 3.33Å; V243-V264 HydrophobicContact CG2-CB 4.39Å; V243-V264 HydrophobicContact CG2-CG1 3.82Å; V243-V264 HydrophobicContact CG2-CG2 3.97Å; V243-L267 HydrophobicContact CG1-CD2 4.43Å; V243-L267 HydrophobicContact CG2-CD2 4.13Å; V243-L274 HydrophobicContact CG1-CD2 3.57Å
244	R	98.8	Very high	98.4	Very high	37 Å²	37	39.7 Å²	39.7	14%	0.14	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	139.9	174	-71.3	178.9	178.1	-102.8	-0.5	110.8	G217 A235 S236 W246 C253 H255 A256	G217-R244 VanDerWaalsContact C-CZ 3.43Å; G217-R244 PolarHBondContact O-NE 2.82Å; G217-R244 PolarHBondContact O-NH2 2.86Å; A235-R244 CarbonylContact C-O 3.58Å; A235-R244 WeakPolarHBondContact CA-O 3.35Å; S236-R244 PolarHBondContact N-O 3.17Å; S236-R244 PolarHBondContact O-N 3.21Å; R244-W246 HydrophobicContact CB-CZ2 3.67Å; R244-W246 HydrophobicContact CG-CZ2 4.18Å; R244-C253 PolarHBondContact NH1-SG 2.94Å; R244-C253 VanDerWaalsContact NH1-SG 3.41Å; R244-H255 WeakPolarHBondContact CA-O 3.41Å; R244-A256 HydrophobicContact CG-CB 4.49Å
245	I	98.8	Very high	98.4	Very high	1 Å²	1	42 Å²	42	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	126.4	172.3	-52.3	-57	0	0	0	107.9	R233 I234 A235 V243 C253 V254 H255 L257 L274 I288	R233-I245 HydrophobicContact CB-CG2 4.36Å; R233-I245 HydrophobicContact CG-CG2 4.47Å; I234-I245 CarbonylContact O-C 3.58Å; I234-I245 WeakPolarHBondContact O-CA 3.38Å; A235-I245 HydrophobicContact CB-CD1 3.75Å; V243-I245 HydrophobicContact CG1-CD1 4.37Å; I245-C253 CarbonylContact O-C 3.57Å; I245-V254 PolarHBondContact O-N 2.95Å; I245-H255 HydrophobicContact CB-CB 4.11Å; I245-H255 HydrophobicContact CG1-CB 4.17Å; I245-H255 PolarHBondContact N-O 2.9Å; I245-H255 PolarHBondContact O-N 2.85Å; I245-L257 HydrophobicContact CD1-CD1 4.17Å; I245-L257 HydrophobicContact CG1-CD1 4.05Å; I245-L257 HydrophobicContact CG1-CG 4.4Å; I245-L274 HydrophobicContact CD1-CD2 3.99Å; I245-I288 HydrophobicContact CD1-CB 4.2Å; I245-I288 HydrophobicContact CD1-CG2 3.91Å; I245-I288 HydrophobicContact CG1-CB 4.43Å; I245-I288 HydrophobicContact CG2-CB 4.46Å
246	W	98.7	Very high	98.4	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145	-175.9	-46.6	85.4	0	0	0	110.6	L201 L215 T216 H218 R233 I234 S236 R244 R252 C253	L201-W246 HydrophobicContact CD1-CZ2 4.35Å; L215-W246 HydrophobicContact CB-CD2 4.08Å; L215-W246 HydrophobicContact CB-CE3 3.87Å; L215-W246 HydrophobicContact CB-CH2 4.25Å; L215-W246 HydrophobicContact CB-CZ2 4.43Å; L215-W246 HydrophobicContact CB-CZ3 3.96Å; L215-W246 HydrophobicContact CD1-CB 3.92Å; L215-W246 HydrophobicContact CD1-CD2 3.92Å; L215-W246 HydrophobicContact CD1-CE3 4.34Å; L215-W246 HydrophobicContact CD1-CG 3.72Å; L215-W246 HydrophobicContact CG-CE3 4.47Å; T216-W246 WeakPolarHBondContact O-CH2 3.36Å; T216-W246 WeakPolarHBondContact O-CZ3 3.32Å; H218-W246 AromaticContact CD2-CZ2 3.97Å; R233-W246 VanDerWaalsContact CA-O 3.31Å; R233-W246 WeakPolarHBondContact CA-O 3.22Å; I234-W246 HydrophobicContact CB-CB 4.32Å; I234-W246 PolarHBondContact N-O 3.24Å; I234-W246 VanDerWaalsContact O-CD1 3.3Å; I234-W246 PolarHBondContact O-N 2.68Å; S236-W246 PolarHBondContact OG-NE1 3.41Å; R244-W246 HydrophobicContact CB-CZ2 3.67Å; R244-W246 HydrophobicContact CG-CZ2 4.18Å; W246-R252 CarbonylContact C-O 3.58Å; W246-R252 WeakPolarHBondContact CA-O 3.48Å; W246-C253 HydrophobicContact CD2-CB 4.47Å; W246-C253 HydrophobicContact CE3-CB 3.76Å; W246-C253 HydrophobicContact CH2-CB 4.34Å; W246-C253 HydrophobicContact CZ3-CB 3.69Å
247	D	98.2	Very high	98.4	Very high	34 Å²	34	43.8 Å²	43.8	18%	0.182	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.1	165.5	-177.1	-78.9	0	0	0	109.2	R233 E249 T250 G251 R252 V254	R233-D247 IonicContact CZ-OD2 3.82Å; R233-D247 IonicContact NH1-OD2 3.88Å; R233-D247 PolarHBondContact NH1-OD2 2.87Å; D247-E249 PolarHBondContact O-N 2.72Å; D247-E249 PolarHBondContact OD1-N 3.44Å; D247-E249 VanDerWaalsContact OD1-N 3.13Å; D247-T250 WeakPolarHBondContact CB-OG1 3.24Å; D247-T250 VanDerWaalsContact CG-OG1 3.29Å; D247-T250 PolarHBondContact OD1-N 2.94Å; D247-T250 PolarHBondContact OD1-OG1 2.89Å; D247-G251 VanDerWaalsContact O-CA 3.27Å; D247-G251 WeakPolarHBondContact O-CA 3.21Å; D247-G251 PolarHBondContact O-N 2.9Å; D247-R252 PolarHBondContact N-O 3.24Å; D247-V254 HydrophobicContact CB-CG2 3.88Å
248	A	96.8	Very high	98.4	Very high	3 Å²	3	51.6 Å²	51.6	3%	0.025	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.6	-170.8	0	0	0	0	0	114.5	K191 G231 R232 I234	K191-A248 PolarHBondContact NZ-O 2.9Å; G231-A248 VanDerWaalsContact O-CB 3.23Å; G231-A248 WeakPolarHBondContact O-CB 3.46Å; R232-A248 PolarHBondContact O-N 3.16Å; I234-A248 HydrophobicContact CD1-CB 3.91Å; I234-A248 HydrophobicContact CG1-CB 4.07Å
249	E	96.7	Very high	98.3	Very high	139 Å²	139	53 Å²	53	65%	0.65	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-38.7	179.8	-168	58.6	-153.1	0	0	111.8	K191 D247	K191-E249 IonicContact NZ-OE2 3.31Å; K191-E249 PolarHBondContact NZ-OE2 2.87Å; D247-E249 PolarHBondContact O-N 2.72Å; D247-E249 PolarHBondContact OD1-N 3.44Å; D247-E249 VanDerWaalsContact OD1-N 3.13Å
250	T	97.7	Very high	98.3	Very high	76 Å²	76	51 Å²	51	47%	0.466	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-17.2	-179.8	63.9	0	0	0	0	113.5	D247 R252	D247-T250 WeakPolarHBondContact CB-OG1 3.24Å; D247-T250 VanDerWaalsContact CG-OG1 3.29Å; D247-T250 PolarHBondContact OD1-N 2.94Å; D247-T250 PolarHBondContact OD1-OG1 2.89Å; T250-R252 PolarHBondContact O-N 2.88Å; T250-R252 PolarHBondContact OG1-N 2.73Å
251	G	97.4	Very high	98.3	Very high	14 Å²	14	54.9 Å²	54.9	14%	0.144	28%	0.276	C	S	.	.			trans	72.1	5.1	-174.7	0	0	0	0	0	114.7	L215 D247	L215-G251 VanDerWaalsContact CD2-CA 3.4Å; D247-G251 VanDerWaalsContact O-CA 3.27Å; D247-G251 WeakPolarHBondContact O-CA 3.21Å; D247-G251 PolarHBondContact O-N 2.9Å
252	R	98.2	Very high	98.3	Very high	188 Å²	188	49.8 Å²	49.8	71%	0.709	26%	0.262	S	S	*	.			trans	-74.7	138.7	-179.1	-66.8	-178.9	177.7	179.2	0.1	111.1	W246 D247 T250 V254	W246-R252 CarbonylContact C-O 3.58Å; W246-R252 WeakPolarHBondContact CA-O 3.48Å; D247-R252 PolarHBondContact N-O 3.24Å; T250-R252 PolarHBondContact O-N 2.88Å; T250-R252 PolarHBondContact OG1-N 2.73Å; R252-V254 PolarHBondContact O-N 3.12Å
253	C	98.5	Very high	98.3	Very high	47 Å²	47	50 Å²	50	32%	0.318	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	110.6	167.7	-172.1	0	0	0	0	108.6	R244 I245 W246 H255	R244-C253 PolarHBondContact NH1-SG 2.94Å; R244-C253 VanDerWaalsContact NH1-SG 3.41Å; I245-C253 CarbonylContact O-C 3.57Å; W246-C253 HydrophobicContact CD2-CB 4.47Å; W246-C253 HydrophobicContact CE3-CB 3.76Å; W246-C253 HydrophobicContact CH2-CB 4.34Å; W246-C253 HydrophobicContact CZ3-CB 3.69Å; C253-H255 PolarHBondContact SG-O 3.43Å; C253-H255 VanDerWaalsContact SG-O 3.33Å
254	V	98.3	Very high	98.3	Very high	58 Å²	58	50 Å²	50	35%	0.352	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-45.1	177.4	-176.7	0	0	0	0	110	I245 D247 R252	I245-V254 PolarHBondContact O-N 2.95Å; D247-V254 HydrophobicContact CB-CG2 3.88Å; R252-V254 PolarHBondContact O-N 3.12Å
255	H	98.6	Very high	98.3	Very high	50 Å²	50	50.2 Å²	50.2	23%	0.231	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	141.7	-179.5	-63.1	-60.9	0	0	0	111.6	R244 I245 C253 L257 I288 D289 T290	R244-H255 WeakPolarHBondContact CA-O 3.41Å; I245-H255 HydrophobicContact CB-CB 4.11Å; I245-H255 HydrophobicContact CG1-CB 4.17Å; I245-H255 PolarHBondContact N-O 2.9Å; I245-H255 PolarHBondContact O-N 2.85Å; C253-H255 PolarHBondContact SG-O 3.43Å; C253-H255 VanDerWaalsContact SG-O 3.33Å; H255-L257 HydrophobicContact CB-CD2 3.7Å; H255-I288 PolarHBondContact CD2-O 3.34Å; H255-D289 PolarHBondContact NE2-O 3.41Å; H255-T290 PolarHBondContact CE1-O 2.85Å
256	A	98.6	Very high	98.3	Very high	35 Å²	35	50.7 Å²	50.7	29%	0.289	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	114.5	163.6	0	0	0	0	0	108.1	R244 Y258	R244-A256 HydrophobicContact CG-CB 4.49Å; A256-Y258 HydrophobicContact CB-CE2 3.74Å; A256-Y258 VanDerWaalsContact O-CD2 3.26Å; A256-Y258 WeakPolarHBondContact O-CD2 3.41Å; A256-Y258 WeakPolarHBondContact O-CE2 3.43Å
257	L	98.7	Very high	98.3	Very high	5 Å²	5	51 Å²	51	3%	0.026	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	113.9	-171.9	-46.2	-176.4	0	0	0	109.5	V243 I245 H255 W286 G291	V243-L257 HydrophobicContact CB-CB 4.04Å; V243-L257 HydrophobicContact CB-CD1 4.03Å; V243-L257 HydrophobicContact CB-CG 4.29Å; V243-L257 HydrophobicContact CG1-CD1 3.85Å; V243-L257 HydrophobicContact CG1-CG 4.46Å; V243-L257 PolarHBondContact N-O 2.79Å; V243-L257 WeakPolarHBondContact O-CA 3.27Å; V243-L257 WeakPolarHBondContact O-CB 3.46Å; V243-L257 WeakPolarHBondContact O-CG 3.3Å; V243-L257 PolarHBondContact O-N 3.33Å; I245-L257 HydrophobicContact CD1-CD1 4.17Å; I245-L257 HydrophobicContact CG1-CD1 4.05Å; I245-L257 HydrophobicContact CG1-CG 4.4Å; H255-L257 HydrophobicContact CB-CD2 3.7Å; L257-W286 HydrophobicContact CB-CD2 4.19Å; L257-W286 HydrophobicContact CB-CE3 3.77Å; L257-W286 HydrophobicContact CB-CH2 4Å; L257-W286 HydrophobicContact CB-CZ2 4.38Å; L257-W286 HydrophobicContact CB-CZ3 3.67Å; L257-W286 HydrophobicContact CD1-CB 3.9Å; L257-W286 HydrophobicContact CD1-CD2 3.76Å; L257-W286 HydrophobicContact CD1-CE3 3.9Å; L257-W286 HydrophobicContact CD1-CG 3.77Å; L257-W286 HydrophobicContact CD2-CE3 4.44Å; L257-W286 HydrophobicContact CG-CE3 4.26Å; L257-G291 VanDerWaalsContact CD2-O 3.28Å; L257-G291 WeakPolarHBondContact CD2-O 3.43Å
258	Y	98.7	Very high	98.4	Very high	163 Å²	163	49.6 Å²	49.6	64%	0.639	26%	0.263	S	S	*	.			trans	-102.8	145.5	-177.1	-63.5	-88.4	0	0	0	111.7	T242 A256 W286	T242-Y258 HydrophobicContact CG2-CD1 3.88Å; T242-Y258 HydrophobicContact CG2-CE1 3.68Å; A256-Y258 HydrophobicContact CB-CE2 3.74Å; A256-Y258 VanDerWaalsContact O-CD2 3.26Å; A256-Y258 WeakPolarHBondContact O-CD2 3.41Å; A256-Y258 WeakPolarHBondContact O-CE2 3.43Å; Y258-W286 WeakPolarHBondContact O-CH2 3.36Å
259	G	98.4	Very high	98.4	Very high	29 Å²	29	50.9 Å²	50.9	30%	0.299	27%	0.269	S	S	.	.			trans	148.8	-27.9	169.5	0	0	0	0	0	114.2	R284	G259-R284 VanDerWaalsContact C-NH2 3.25Å; G259-R284 VanDerWaalsContact CA-CZ 3.49Å; G259-R284 VanDerWaalsContact O-CZ 3.24Å; G259-R284 PolarHBondContact O-NE 3.4Å; G259-R284 PolarHBondContact O-NH2 2.6Å
260	H	98.8	Very high	98.5	Very high	11 Å²	11	47.4 Å²	47.4	5%	0.051	25%	0.251	C	S	.	.			trans	-64.9	143.6	167.7	-81.4	-54.9	0	0	0	109.9	R241 V264 S276 S278 D280 T282	R241-H260 WeakPolarHBondContact CB-O 3.5Å; R241-H260 WeakPolarHBondContact O-CB 3.22Å; H260-V264 HydrophobicContact CB-CG2 4.18Å; H260-S276 PolarHBondContact CD2-OG 2.94Å; H260-S276 PolarHBondContact NE2-O 2.74Å; H260-S276 PolarHBondContact NE2-OG 2.8Å; H260-S278 WeakPolarHBondContact CE1-CB 3.3Å; H260-S278 WeakPolarHBondContact ND1-CB 3.44Å; H260-D280 VanDerWaalsContact CA-OD2 3.27Å; H260-D280 WeakPolarHBondContact CA-OD2 3.26Å; H260-D280 WeakPolarHBondContact CB-OD2 3.44Å; H260-D280 IonicContact CE1-OD1 3.92Å; H260-D280 IonicContact CE1-OD2 3.98Å; H260-D280 IonicContact CG-OD2 3.66Å; H260-D280 IonicContact ND1-OD1 3.36Å; H260-D280 PolarHBondContact ND1-OD1 3.01Å; H260-D280 IonicContact ND1-OD2 3.45Å; H260-D280 PolarHBondContact ND1-OD2 2.93Å; H260-T282 PolarHBondContact CE1-OG1 3.35Å; H260-T282 PolarHBondContact ND1-OG1 3.43Å
261	T	98.7	Very high	98.4	Very high	105 Å²	105	49.8 Å²	49.8	64%	0.644	26%	0.257	S	S	*	.	S	Bend	trans	-108.2	0.3	-177.3	57.9	0	0	0	0	112.4	R241 D280	R241-T261 WeakPolarHBondContact CD-O 3.16Å; T261-D280 PolarHBondContact N-OD2 3.45Å; T261-D280 WeakPolarHBondContact OG1-CB 3.33Å
262	S	98.8	Very high	98.4	Very high	38 Å²	38	51.5 Å²	51.5	27%	0.266	26%	0.263	S	S	.	.	S	Bend	trans	-144.7	-175.8	175.1	-158.5	0	0	0	0	110.6	R241 V264 S278 R279	R241-S262 WeakPolarHBondContact CA-O 3.44Å; S262-V264 PolarHBondContact O-N 3.31Å; S262-S278 PolarHBondContact O-OG 3.46Å; S262-R279 VanDerWaalsContact OG-CB 3.31Å; S262-R279 WeakPolarHBondContact OG-CB 3.09Å
263	T	98.9	Very high	98.4	Very high	15 Å²	15	44 Å²	44	9%	0.092	24%	0.237	C	C	.	.			trans	-53.9	128.9	-178.1	-53.6	0	0	0	0	112.3	T239 R265 S278 R279	T239-T263 HydrophobicContact CG2-CG2 3.76Å; T263-R265 PolarHBondContact O-N 3.04Å; T263-S278 VanDerWaalsContact O-CA 3.3Å; T263-S278 WeakPolarHBondContact O-CA 3.42Å; T263-S278 PolarHBondContact O-OG 2.95Å; T263-R279 PolarHBondContact O-N 3.23Å
264	V	98.9	Very high	98.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	105.9	169.6	-174.3	0	0	0	0	109	S238 V243 H260 S262 L267	S238-V264 PolarHBondContact O-N 3.36Å; V243-V264 HydrophobicContact CG2-CB 4.39Å; V243-V264 HydrophobicContact CG2-CG1 3.82Å; V243-V264 HydrophobicContact CG2-CG2 3.97Å; H260-V264 HydrophobicContact CB-CG2 4.18Å; S262-V264 PolarHBondContact O-N 3.31Å; V264-L267 HydrophobicContact CG1-CD2 4.03Å
265	R	98.9	Very high	98.4	Very high	42 Å²	42	39 Å²	39	16%	0.158	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-33.1	-167.4	-178.1	59.1	-167.4	101.9	-18.8	113.4	W223 T263 G277 R305	W223-R265 PolarHBondContact O-NH1 2.99Å; T263-R265 PolarHBondContact O-N 3.04Å; R265-G277 PolarHBondContact N-O 2.84Å; R265-R305 VanDerWaalsContact CZ-CZ 3.44Å; R265-R305 VanDerWaalsContact NH2-NH2 3.2Å
266	C	98.8	Very high	98.5	Very high	11 Å²	11	36.6 Å²	36.6	7%	0.074	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	152.3	-176.4	57.3	0	0	0	0	111.2	S276 G277 V307	C266-S276 WeakPolarHBondContact O-CA 3.47Å; C266-G277 PolarHBondContact N-O 2.89Å; C266-G277 PolarHBondContact O-N 2.85Å; C266-V307 HydrophobicContact CB-CG1 3.92Å
267	L	98.9	Very high	98.5	Very high	9 Å²	9	34.9 Å²	34.9	5%	0.047	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142	180	-67.1	175.1	0	0	0	108.9	S224 Q226 A235 V243 V264 L274 I275	S224-L267 WeakPolarHBondContact OG-CG 3.42Å; Q226-L267 HydrophobicContact CG-CB 3.74Å; Q226-L267 PolarHBondContact NE2-O 2.71Å; A235-L267 HydrophobicContact CB-CD1 4.28Å; V243-L267 HydrophobicContact CG1-CD2 4.43Å; V243-L267 HydrophobicContact CG2-CD2 4.13Å; V264-L267 HydrophobicContact CG1-CD2 4.03Å; L267-L274 HydrophobicContact CB-CD1 4.25Å; L267-L274 HydrophobicContact CD2-CD1 4.2Å; L267-L274 HydrophobicContact CD2-CD2 4.21Å; L267-L274 HydrophobicContact CD2-CG 4.3Å; L267-I275 CarbonylContact C-O 3.57Å; L267-I275 VanDerWaalsContact CA-O 3.28Å; L267-I275 WeakPolarHBondContact CA-O 3.45Å
268	A	98.7	Very high	98.5	Very high	4 Å²	4	34.7 Å²	34.7	3%	0.033	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133.6	164.8	0	0	0	0	0	108.8	I275 V307 F309	A268-I275 PolarHBondContact N-O 2.91Å; A268-I275 PolarHBondContact O-N 2.9Å; A268-V307 HydrophobicContact CB-CG1 3.88Å; A268-V307 HydrophobicContact CB-CG2 4.27Å; A268-F309 HydrophobicContact CB-CB 3.75Å
269	L	98.4	Very high	98.5	Very high	29 Å²	29	33.4 Å²	33.4	15%	0.152	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131.5	-175	177.5	58.5	0	0	0	108.7	Q226 A228 I273 L274 I288	Q226-L269 HydrophobicContact CB-CB 3.82Å; Q226-L269 HydrophobicContact CB-CD2 4.08Å; Q226-L269 HydrophobicContact CG-CB 4.1Å; A228-L269 HydrophobicContact CB-CD2 3.97Å; L269-I273 WeakPolarHBondContact CD1-O 3.49Å; L269-L274 HydrophobicContact CB-CD1 3.85Å; L269-L274 HydrophobicContact CD1-CB 4.1Å; L269-L274 HydrophobicContact CD1-CD1 4.16Å; L269-L274 HydrophobicContact CG-CD1 4.47Å; L269-I288 HydrophobicContact CD1-CD1 4.16Å; L269-I288 HydrophobicContact CD1-CG2 4.07Å
270	K	97.7	Very high	98.5	Very high	66 Å²	66	33.5 Å²	33.5	29%	0.287	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	129	169.3	-177	68.9	-174.4	163.7	0	107.7	E229 N272 I273 F309	E229-K270 VanDerWaalsContact OE1-CD 3.32Å; E229-K270 WeakPolarHBondContact OE1-CD 3.5Å; E229-K270 WeakPolarHBondContact OE1-CE 3.37Å; E229-K270 IonicContact OE1-NZ 3.48Å; E229-K270 PolarHBondContact OE1-NZ 2.89Å; E229-K270 IonicContact OE2-NZ 3.84Å; K270-N272 PolarHBondContact O-N 2.99Å; K270-I273 PolarHBondContact N-O 3.26Å; K270-I273 VanDerWaalsContact N-O 3.14Å; K270-I273 PolarHBondContact O-N 3.45Å; K270-F309 HydrophobicContact CB-CD1 3.48Å; K270-F309 VanDerWaalsContact CB-CD1 3.48Å; K270-F309 HydrophobicContact CB-CE1 3.62Å; K270-F309 HydrophobicContact CB-CG 4.47Å
271	E	96.2	Very high	98.5	Very high	127 Å²	127	33.8 Å²	33.8	59%	0.593	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	-123.5	-172.9	-60.7	171.1	-175.2	0	0	110.5
272	N	97	Very high	98.5	Very high	49 Å²	49	30 Å²	30	26%	0.262	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	6.1	176.8	67.8	-14.3	0	0	0	114.4	K270 N287 I288 D289	K270-N272 PolarHBondContact O-N 2.99Å; N272-N287 PolarHBondContact ND2-ND2 3.43Å; N272-N287 WeakPolarHBondContact O-CA 3.33Å; N272-I288 HydrophobicContact CB-CD1 4.48Å; N272-I288 HydrophobicContact CB-CG1 4.01Å; N272-I288 PolarHBondContact O-N 3.28Å; N272-D289 WeakPolarHBondContact CB-OD2 3.34Å; N272-D289 PolarHBondContact ND2-OD2 3.49Å
273	I	98.3	Very high	98.5	Very high	30 Å²	30	28.2 Å²	28.2	15%	0.154	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116.5	-178.4	-57.2	-57.9	0	0	0	110.3	L269 K270 V285 W286 L294 F309	L269-I273 WeakPolarHBondContact CD1-O 3.49Å; K270-I273 PolarHBondContact N-O 3.26Å; K270-I273 VanDerWaalsContact N-O 3.14Å; K270-I273 PolarHBondContact O-N 3.45Å; I273-V285 HydrophobicContact CG2-CG1 3.64Å; I273-W286 WeakPolarHBondContact CA-O 3.13Å; I273-L294 HydrophobicContact CD1-CD1 3.59Å; I273-F309 HydrophobicContact CB-CE1 3.79Å; I273-F309 HydrophobicContact CB-CZ 4.14Å; I273-F309 HydrophobicContact CG2-CE1 3.69Å; I273-F309 HydrophobicContact CG2-CZ 3.78Å
274	L	98.8	Very high	98.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134	176.6	-177.2	72.3	0	0	0	110.2	A235 V243 I245 L267 L269 V285 W286 I288	A235-L274 HydrophobicContact CB-CD1 3.95Å; A235-L274 HydrophobicContact CB-CD2 3.75Å; V243-L274 HydrophobicContact CG1-CD2 3.57Å; I245-L274 HydrophobicContact CD1-CD2 3.99Å; L267-L274 HydrophobicContact CB-CD1 4.25Å; L267-L274 HydrophobicContact CD2-CD1 4.2Å; L267-L274 HydrophobicContact CD2-CD2 4.21Å; L267-L274 HydrophobicContact CD2-CG 4.3Å; L269-L274 HydrophobicContact CB-CD1 3.85Å; L269-L274 HydrophobicContact CD1-CB 4.1Å; L269-L274 HydrophobicContact CD1-CD1 4.16Å; L269-L274 HydrophobicContact CG-CD1 4.47Å; L274-V285 CarbonylContact O-C 3.56Å; L274-V285 WeakPolarHBondContact O-CA 3.33Å; L274-W286 HydrophobicContact CB-CB 4.34Å; L274-W286 PolarHBondContact N-O 2.96Å; L274-W286 PolarHBondContact O-N 2.94Å; L274-I288 HydrophobicContact CB-CG2 3.66Å; L274-I288 HydrophobicContact CD2-CG2 4.39Å
275	I	98.8	Very high	98.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125	170.4	-53.4	-171.3	0	0	0	108.9	L267 A268 L283 R284 V285 V307 F309 A314 V328	L267-I275 CarbonylContact C-O 3.57Å; L267-I275 VanDerWaalsContact CA-O 3.28Å; L267-I275 WeakPolarHBondContact CA-O 3.45Å; A268-I275 PolarHBondContact N-O 2.91Å; A268-I275 PolarHBondContact O-N 2.9Å; I275-L283 HydrophobicContact CG2-CB 4.15Å; I275-L283 HydrophobicContact CG2-CD2 3.77Å; I275-R284 CarbonylContact C-O 3.53Å; I275-R284 VanDerWaalsContact CA-O 3.31Å; I275-R284 WeakPolarHBondContact CA-O 3.44Å; I275-V285 HydrophobicContact CG1-CG2 4.5Å; I275-V307 HydrophobicContact CB-CG2 4.41Å; I275-V307 HydrophobicContact CG2-CG2 3.9Å; I275-F309 HydrophobicContact CD1-CB 3.96Å; I275-F309 HydrophobicContact CD1-CD1 4.16Å; I275-F309 HydrophobicContact CD1-CD2 3.43Å; I275-F309 VanDerWaalsContact CD1-CD2 3.43Å; I275-F309 HydrophobicContact CD1-CE2 3.93Å; I275-F309 HydrophobicContact CD1-CG 3.58Å; I275-F309 HydrophobicContact CD1-CZ 4.45Å; I275-F309 HydrophobicContact CG1-CB 4.49Å; I275-F309 HydrophobicContact CG1-CD1 4.28Å; I275-F309 HydrophobicContact CG1-CD2 4.39Å; I275-F309 HydrophobicContact CG1-CG 4.15Å; I275-A314 HydrophobicContact CD1-CB 3.33Å; I275-V328 HydrophobicContact CD1-CG2 3.78Å
276	S	98.9	Very high	98.5	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.4	173.8	60.3	0	0	0	0	111.2	H260 C266 L283 R284 W286	H260-S276 PolarHBondContact CD2-OG 2.94Å; H260-S276 PolarHBondContact NE2-O 2.74Å; H260-S276 PolarHBondContact NE2-OG 2.8Å; C266-S276 WeakPolarHBondContact O-CA 3.47Å; S276-L283 CarbonylContact O-C 3.56Å; S276-L283 WeakPolarHBondContact O-CA 3.16Å; S276-L283 WeakPolarHBondContact O-CB 3.47Å; S276-R284 PolarHBondContact N-O 2.89Å; S276-R284 PolarHBondContact O-N 2.84Å; S276-W286 PolarHBondContact OG-NE1 2.7Å
277	G	98.9	Very high	98.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.4	170.8	0	0	0	0	0	110.8	R265 C266	R265-G277 PolarHBondContact N-O 2.84Å; C266-G277 PolarHBondContact N-O 2.89Å; C266-G277 PolarHBondContact O-N 2.85Å
278	S	98.9	Very high	98.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	162.2	-170.7	170	0	0	0	0	113.2	H260 S262 T263 D280 A281 T282 V304	H260-S278 WeakPolarHBondContact CE1-CB 3.3Å; H260-S278 WeakPolarHBondContact ND1-CB 3.44Å; S262-S278 PolarHBondContact O-OG 3.46Å; T263-S278 VanDerWaalsContact O-CA 3.3Å; T263-S278 WeakPolarHBondContact O-CA 3.42Å; T263-S278 PolarHBondContact O-OG 2.95Å; S278-D280 VanDerWaalsContact CB-CG 3.47Å; S278-D280 VanDerWaalsContact CB-OD1 3.24Å; S278-D280 WeakPolarHBondContact CB-OD1 3.44Å; S278-D280 WeakPolarHBondContact CB-OD2 3.41Å; S278-D280 PolarHBondContact O-N 3.42Å; S278-D280 PolarHBondContact OG-N 3.32Å; S278-D280 VanDerWaalsContact OG-N 3.11Å; S278-D280 PolarHBondContact OG-OD1 3.08Å; S278-D280 PolarHBondContact OG-OD2 2.9Å; S278-A281 PolarHBondContact O-N 3.3Å; S278-T282 PolarHBondContact N-O 2.66Å; S278-T282 VanDerWaalsContact N-O 3.14Å; S278-V304 PolarHBondContact O-N 2.85Å
279	R	98.9	Very high	98.4	Very high	136 Å²	136	33 Å²	33	51%	0.513	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-10.7	168.2	-75.7	-170.6	177.8	179.9	0.1	113.6	S262 T263 A281 A303	S262-R279 VanDerWaalsContact OG-CB 3.31Å; S262-R279 WeakPolarHBondContact OG-CB 3.09Å; T263-R279 PolarHBondContact O-N 3.23Å; R279-A281 PolarHBondContact O-N 2.92Å; R279-A303 HydrophobicContact CB-CB 4.21Å; R279-A303 HydrophobicContact CG-CB 3.99Å
280	D	98.7	Very high	98.4	Very high	31 Å²	31	34.8 Å²	34.8	17%	0.166	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	9	172.1	64	30.4	0	0	0	114.2	H260 T261 S278 T282	H260-D280 VanDerWaalsContact CA-OD2 3.27Å; H260-D280 WeakPolarHBondContact CA-OD2 3.26Å; H260-D280 WeakPolarHBondContact CB-OD2 3.44Å; H260-D280 IonicContact CE1-OD1 3.92Å; H260-D280 IonicContact CE1-OD2 3.98Å; H260-D280 IonicContact CG-OD2 3.66Å; H260-D280 IonicContact ND1-OD1 3.36Å; H260-D280 PolarHBondContact ND1-OD1 3.01Å; H260-D280 IonicContact ND1-OD2 3.45Å; H260-D280 PolarHBondContact ND1-OD2 2.93Å; T261-D280 PolarHBondContact N-OD2 3.45Å; T261-D280 WeakPolarHBondContact OG1-CB 3.33Å; S278-D280 VanDerWaalsContact CB-CG 3.47Å; S278-D280 VanDerWaalsContact CB-OD1 3.24Å; S278-D280 WeakPolarHBondContact CB-OD1 3.44Å; S278-D280 WeakPolarHBondContact CB-OD2 3.41Å; S278-D280 PolarHBondContact O-N 3.42Å; S278-D280 PolarHBondContact OG-N 3.32Å; S278-D280 VanDerWaalsContact OG-N 3.11Å; S278-D280 PolarHBondContact OG-OD1 3.08Å; S278-D280 PolarHBondContact OG-OD2 2.9Å; D280-T282 PolarHBondContact O-N 3.01Å; D280-T282 WeakPolarHBondContact OD1-CB 3.38Å; D280-T282 PolarHBondContact OD1-N 3.14Å; D280-T282 PolarHBondContact OD1-OG1 3.06Å
281	A	98.8	Very high	98.4	Very high	17 Å²	17	32.6 Å²	32.6	14%	0.14	17%	0.167	C	C	.	.	S	Bend	trans	65.9	11.5	-179.5	0	0	0	0	0	115.4	S278 R279 H300 A302	S278-A281 PolarHBondContact O-N 3.3Å; R279-A281 PolarHBondContact O-N 2.92Å; A281-H300 HydrophobicContact CB-CB 4.47Å; A281-H300 WeakPolarHBondContact O-CB 3.39Å; A281-A302 WeakPolarHBondContact CA-O 3.46Å; A281-A302 VanDerWaalsContact CB-O 3.27Å; A281-A302 WeakPolarHBondContact CB-O 3.08Å
282	T	98.8	Very high	98.5	Very high	26 Å²	26	32.1 Å²	32.1	16%	0.16	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	158	173.9	71.3	0	0	0	0	112	H260 S278 D280 V296	H260-T282 PolarHBondContact CE1-OG1 3.35Å; H260-T282 PolarHBondContact ND1-OG1 3.43Å; S278-T282 PolarHBondContact N-O 2.66Å; S278-T282 VanDerWaalsContact N-O 3.14Å; D280-T282 PolarHBondContact O-N 3.01Å; D280-T282 WeakPolarHBondContact OD1-CB 3.38Å; D280-T282 PolarHBondContact OD1-N 3.14Å; D280-T282 PolarHBondContact OD1-OG1 3.06Å; T282-V296 HydrophobicContact CG2-CG1 4.31Å
283	L	98.9	Very high	98.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	150.8	155.1	-55.4	92.5	0	0	0	110.1	I275 S276 L297 V304 V307 W326	I275-L283 HydrophobicContact CG2-CB 4.15Å; I275-L283 HydrophobicContact CG2-CD2 3.77Å; S276-L283 CarbonylContact O-C 3.56Å; S276-L283 WeakPolarHBondContact O-CA 3.16Å; S276-L283 WeakPolarHBondContact O-CB 3.47Å; L283-L297 HydrophobicContact CB-CB 4.14Å; L283-L297 HydrophobicContact CB-CD1 4.37Å; L283-L297 PolarHBondContact N-O 3.14Å; L283-L297 PolarHBondContact O-N 3.13Å; L283-V304 HydrophobicContact CD1-CG1 4.22Å; L283-V304 HydrophobicContact CD1-CG2 3.94Å; L283-V304 HydrophobicContact CD2-CG1 4.12Å; L283-V304 HydrophobicContact CG-CG1 4.07Å; L283-V304 HydrophobicContact CG-CG2 4.23Å; L283-V307 HydrophobicContact CD2-CB 4.19Å; L283-V307 HydrophobicContact CD2-CG2 3.66Å; L283-W326 HydrophobicContact CD1-CZ2 3.92Å
284	R	98.8	Very high	98.5	Very high	47 Å²	47	33.9 Å²	33.9	18%	0.177	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.9	172.8	-69.8	178.6	170.8	-98	0.2	110.2	G259 I275 S276 W286 C293 A295 V296	G259-R284 VanDerWaalsContact C-NH2 3.25Å; G259-R284 VanDerWaalsContact CA-CZ 3.49Å; G259-R284 VanDerWaalsContact O-CZ 3.24Å; G259-R284 PolarHBondContact O-NE 3.4Å; G259-R284 PolarHBondContact O-NH2 2.6Å; I275-R284 CarbonylContact C-O 3.53Å; I275-R284 VanDerWaalsContact CA-O 3.31Å; I275-R284 WeakPolarHBondContact CA-O 3.44Å; S276-R284 PolarHBondContact N-O 2.89Å; S276-R284 PolarHBondContact O-N 2.84Å; R284-W286 HydrophobicContact CB-CD2 4.47Å; R284-W286 HydrophobicContact CB-CH2 4.41Å; R284-W286 HydrophobicContact CB-CZ2 3.49Å; R284-W286 VanDerWaalsContact CB-CZ2 3.49Å; R284-W286 HydrophobicContact CG-CZ2 4.04Å; R284-C293 PolarHBondContact NH1-SG 2.96Å; R284-C293 VanDerWaalsContact NH1-SG 3.39Å; R284-A295 WeakPolarHBondContact CA-O 3.36Å; R284-V296 HydrophobicContact CG-CG1 4.42Å; R284-V296 HydrophobicContact CG-CG2 4.26Å
285	V	98.8	Very high	98.5	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127	179	-174.9	0	0	0	0	107.6	I273 L274 I275 C293 L294 A295 L297 V328	I273-V285 HydrophobicContact CG2-CG1 3.64Å; L274-V285 CarbonylContact O-C 3.56Å; L274-V285 WeakPolarHBondContact O-CA 3.33Å; I275-V285 HydrophobicContact CG1-CG2 4.5Å; V285-C293 CarbonylContact O-C 3.55Å; V285-L294 HydrophobicContact CB-CB 4.45Å; V285-L294 HydrophobicContact CG1-CB 4.27Å; V285-L294 HydrophobicContact CG1-CD1 4.31Å; V285-L294 PolarHBondContact O-N 3.42Å; V285-A295 HydrophobicContact CB-CB 4.08Å; V285-A295 HydrophobicContact CG2-CB 4.06Å; V285-A295 PolarHBondContact N-O 3.17Å; V285-A295 PolarHBondContact O-N 2.88Å; V285-L297 HydrophobicContact CG2-CD1 4.01Å; V285-L297 HydrophobicContact CG2-CG 4.1Å; V285-V328 HydrophobicContact CB-CG1 4.48Å; V285-V328 HydrophobicContact CG1-CG1 3.68Å; V285-V328 HydrophobicContact CG2-CG1 4Å
286	W	98.7	Very high	98.5	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.015	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.5	-175.1	-43.6	87.6	0	0	0	110.7	L257 Y258 I273 L274 S276 R284 E292 C293	L257-W286 HydrophobicContact CB-CD2 4.19Å; L257-W286 HydrophobicContact CB-CE3 3.77Å; L257-W286 HydrophobicContact CB-CH2 4Å; L257-W286 HydrophobicContact CB-CZ2 4.38Å; L257-W286 HydrophobicContact CB-CZ3 3.67Å; L257-W286 HydrophobicContact CD1-CB 3.9Å; L257-W286 HydrophobicContact CD1-CD2 3.76Å; L257-W286 HydrophobicContact CD1-CE3 3.9Å; L257-W286 HydrophobicContact CD1-CG 3.77Å; L257-W286 HydrophobicContact CD2-CE3 4.44Å; L257-W286 HydrophobicContact CG-CE3 4.26Å; Y258-W286 WeakPolarHBondContact O-CH2 3.36Å; I273-W286 WeakPolarHBondContact CA-O 3.13Å; L274-W286 HydrophobicContact CB-CB 4.34Å; L274-W286 PolarHBondContact N-O 2.96Å; L274-W286 PolarHBondContact O-N 2.94Å; S276-W286 PolarHBondContact OG-NE1 2.7Å; R284-W286 HydrophobicContact CB-CD2 4.47Å; R284-W286 HydrophobicContact CB-CH2 4.41Å; R284-W286 HydrophobicContact CB-CZ2 3.49Å; R284-W286 VanDerWaalsContact CB-CZ2 3.49Å; R284-W286 HydrophobicContact CG-CZ2 4.04Å; W286-E292 VanDerWaalsContact CA-O 3.28Å; W286-E292 WeakPolarHBondContact CA-O 3.32Å; W286-C293 HydrophobicContact CD2-CB 4.49Å; W286-C293 HydrophobicContact CE3-CB 3.59Å; W286-C293 HydrophobicContact CH2-CB 4.23Å; W286-C293 HydrophobicContact CZ3-CB 3.44Å; W286-C293 VanDerWaalsContact CZ3-CB 3.44Å
287	N	98.3	Very high	98.4	Very high	25 Å²	25	37.4 Å²	37.4	13%	0.134	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	120.5	161.6	-175.3	-53.9	0	0	0	108.6	N272 D289 T290 G291 E292 L294	N272-N287 PolarHBondContact ND2-ND2 3.43Å; N272-N287 WeakPolarHBondContact O-CA 3.33Å; N287-D289 VanDerWaalsContact C-N 3.29Å; N287-D289 PolarHBondContact O-N 3.5Å; N287-D289 WeakPolarHBondContact OD1-CA 3.48Å; N287-D289 VanDerWaalsContact OD1-CB 3.3Å; N287-D289 WeakPolarHBondContact OD1-CB 3.36Å; N287-D289 PolarHBondContact OD1-N 3.02Å; N287-T290 WeakPolarHBondContact CB-OG1 3.4Å; N287-T290 PolarHBondContact OD1-N 3.03Å; N287-G291 WeakPolarHBondContact O-CA 3.49Å; N287-G291 PolarHBondContact O-N 2.83Å; N287-E292 PolarHBondContact N-O 2.75Å; N287-L294 HydrophobicContact CB-CD1 4.13Å; N287-L294 HydrophobicContact CB-CD2 4.26Å; N287-L294 HydrophobicContact CB-CG 4.27Å
288	I	98.1	Very high	98.4	Very high	7 Å²	7	41.3 Å²	41.3	4%	0.036	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-19	-177	71	177.6	0	0	0	113.5	A228 R233 I245 H255 L269 N272 L274	A228-I288 HydrophobicContact CB-CD1 4.29Å; R233-I288 HydrophobicContact CB-CD1 4.25Å; R233-I288 HydrophobicContact CG-CD1 4.44Å; I245-I288 HydrophobicContact CD1-CB 4.2Å; I245-I288 HydrophobicContact CD1-CG2 3.91Å; I245-I288 HydrophobicContact CG1-CB 4.43Å; I245-I288 HydrophobicContact CG2-CB 4.46Å; H255-I288 PolarHBondContact CD2-O 3.34Å; L269-I288 HydrophobicContact CD1-CD1 4.16Å; L269-I288 HydrophobicContact CD1-CG2 4.07Å; N272-I288 HydrophobicContact CB-CD1 4.48Å; N272-I288 HydrophobicContact CB-CG1 4.01Å; N272-I288 PolarHBondContact O-N 3.28Å; L274-I288 HydrophobicContact CB-CG2 3.66Å; L274-I288 HydrophobicContact CD2-CG2 4.39Å
289	D	97.3	Very high	98.3	Very high	95 Å²	95	43.1 Å²	43.1	51%	0.508	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-46.8	179.3	-56.4	-44	0	0	0	110.3	H255 N272 N287	H255-D289 PolarHBondContact NE2-O 3.41Å; N272-D289 WeakPolarHBondContact CB-OD2 3.34Å; N272-D289 PolarHBondContact ND2-OD2 3.49Å; N287-D289 VanDerWaalsContact C-N 3.29Å; N287-D289 PolarHBondContact O-N 3.5Å; N287-D289 WeakPolarHBondContact OD1-CA 3.48Å; N287-D289 VanDerWaalsContact OD1-CB 3.3Å; N287-D289 WeakPolarHBondContact OD1-CB 3.36Å; N287-D289 PolarHBondContact OD1-N 3.02Å
290	T	97.9	Very high	98.3	Very high	68 Å²	68	37.2 Å²	37.2	42%	0.417	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-22.7	-178.2	69.5	0	0	0	0	113.5	H255 N287 E292	H255-T290 PolarHBondContact CE1-O 2.85Å; N287-T290 WeakPolarHBondContact CB-OG1 3.4Å; N287-T290 PolarHBondContact OD1-N 3.03Å; T290-E292 VanDerWaalsContact C-N 3.25Å; T290-E292 WeakPolarHBondContact OG1-CB 3.42Å; T290-E292 WeakPolarHBondContact OG1-CG 3.27Å; T290-E292 PolarHBondContact OG1-N 3.19Å; T290-E292 PolarHBondContact OG1-OE2 3.27Å; T290-E292 VanDerWaalsContact OG1-OE2 3.08Å
291	G	97.9	Very high	98.3	Very high	20 Å²	20	41.8 Å²	41.8	21%	0.206	25%	0.253	C	S	.	.			trans	76.4	10.2	-173.4	0	0	0	0	0	113.8	L257 N287	L257-G291 VanDerWaalsContact CD2-O 3.28Å; L257-G291 WeakPolarHBondContact CD2-O 3.43Å; N287-G291 WeakPolarHBondContact O-CA 3.49Å; N287-G291 PolarHBondContact O-N 2.83Å
292	E	98.3	Very high	98.3	Very high	116 Å²	116	42.4 Å²	42.4	54%	0.542	26%	0.257	S	S	.	.			trans	-84	142.5	-176.7	-66.3	173.1	144.7	0	0	112.6	W286 N287 T290 L294	W286-E292 VanDerWaalsContact CA-O 3.28Å; W286-E292 WeakPolarHBondContact CA-O 3.32Å; N287-E292 PolarHBondContact N-O 2.75Å; T290-E292 VanDerWaalsContact C-N 3.25Å; T290-E292 WeakPolarHBondContact OG1-CB 3.42Å; T290-E292 WeakPolarHBondContact OG1-CG 3.27Å; T290-E292 PolarHBondContact OG1-N 3.19Å; T290-E292 PolarHBondContact OG1-OE2 3.27Å; T290-E292 VanDerWaalsContact OG1-OE2 3.08Å; E292-L294 HydrophobicContact CB-CD2 4.48Å; E292-L294 PolarHBondContact O-N 3.27Å
293	C	98.4	Very high	98.3	Very high	51 Å²	51	41.9 Å²	41.9	35%	0.345	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	104.2	168.2	-170.4	0	0	0	0	109.7	R284 V285 W286	R284-C293 PolarHBondContact NH1-SG 2.96Å; R284-C293 VanDerWaalsContact NH1-SG 3.39Å; V285-C293 CarbonylContact O-C 3.55Å; W286-C293 HydrophobicContact CD2-CB 4.49Å; W286-C293 HydrophobicContact CE3-CB 3.59Å; W286-C293 HydrophobicContact CH2-CB 4.23Å; W286-C293 HydrophobicContact CZ3-CB 3.44Å; W286-C293 VanDerWaalsContact CZ3-CB 3.44Å
294	L	98.1	Very high	98.3	Very high	65 Å²	65	41.9 Å²	41.9	34%	0.34	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-32.9	-177.1	-56.9	179.9	0	0	0	113.2	I273 V285 N287 E292 K331	I273-L294 HydrophobicContact CD1-CD1 3.59Å; V285-L294 HydrophobicContact CB-CB 4.45Å; V285-L294 HydrophobicContact CG1-CB 4.27Å; V285-L294 HydrophobicContact CG1-CD1 4.31Å; V285-L294 PolarHBondContact O-N 3.42Å; N287-L294 HydrophobicContact CB-CD1 4.13Å; N287-L294 HydrophobicContact CB-CD2 4.26Å; N287-L294 HydrophobicContact CB-CG 4.27Å; E292-L294 HydrophobicContact CB-CD2 4.48Å; E292-L294 PolarHBondContact O-N 3.27Å; L294-K331 WeakPolarHBondContact O-CE 3.49Å; L294-K331 PolarHBondContact O-NZ 3.04Å
295	A	97.9	Very high	98.3	Very high	10 Å²	10	42 Å²	42	8%	0.083	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	156	-178.9	0	0	0	0	0	112.6	R284 V285 L297 K331	R284-A295 WeakPolarHBondContact CA-O 3.36Å; V285-A295 HydrophobicContact CB-CB 4.08Å; V285-A295 HydrophobicContact CG2-CB 4.06Å; V285-A295 PolarHBondContact N-O 3.17Å; V285-A295 PolarHBondContact O-N 2.88Å; A295-L297 HydrophobicContact CB-CD2 4.45Å; A295-K331 HydrophobicContact CB-CB 4.38Å; A295-K331 HydrophobicContact CB-CD 3.77Å; A295-K331 HydrophobicContact CB-CG 3.83Å
296	V	98.4	Very high	98.3	Very high	63 Å²	63	42.5 Å²	42.5	38%	0.382	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.1	164.7	-174.8	0	0	0	0	107.4	T282 R284	T282-V296 HydrophobicContact CG2-CG1 4.31Å; R284-V296 HydrophobicContact CG-CG1 4.42Å; R284-V296 HydrophobicContact CG-CG2 4.26Å
297	L	98.4	Very high	98.3	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	100.4	177.6	-51.6	179.5	0	0	0	108.4	L283 V285 A295 W326	L283-L297 HydrophobicContact CB-CB 4.14Å; L283-L297 HydrophobicContact CB-CD1 4.37Å; L283-L297 PolarHBondContact N-O 3.14Å; L283-L297 PolarHBondContact O-N 3.13Å; V285-L297 HydrophobicContact CG2-CD1 4.01Å; V285-L297 HydrophobicContact CG2-CG 4.1Å; A295-L297 HydrophobicContact CB-CD2 4.45Å; L297-W326 HydrophobicContact CB-CD2 4.14Å; L297-W326 HydrophobicContact CB-CE3 3.81Å; L297-W326 HydrophobicContact CB-CH2 4.3Å; L297-W326 HydrophobicContact CB-CZ3 3.9Å; L297-W326 HydrophobicContact CD1-CB 3.96Å; L297-W326 HydrophobicContact CD1-CD2 4.07Å; L297-W326 HydrophobicContact CD1-CE3 4.32Å; L297-W326 HydrophobicContact CD1-CG 3.91Å; L297-W326 HydrophobicContact CD2-CE3 4.4Å; L297-W326 HydrophobicContact CG-CE3 4.4Å
298	S	97.7	Very high	98.3	Very high	81 Å²	81	45 Å²	45	57%	0.566	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	141.4	179.9	-60.8	0	0	0	0	110.6
299	G	97.5	Very high	98.3	Very high	39 Å²	39	45.6 Å²	45.6	40%	0.402	27%	0.274	S	S	.	.			trans	155.1	-17.2	174.7	0	0	0	0	0	115	K324	G299-K324 VanDerWaalsContact C-CE 3.47Å; G299-K324 WeakPolarHBondContact O-CE 3.41Å; G299-K324 PolarHBondContact O-NZ 2.87Å
300	H	98.6	Very high	98.3	Very high	12 Å²	12	43 Å²	43	6%	0.056	26%	0.26	C	S	.	.			trans	-71.9	149.6	163.6	-80.4	-60.9	0	0	0	110.1	A281 V304 S316 A318 D320 S322	A281-H300 HydrophobicContact CB-CB 4.47Å; A281-H300 WeakPolarHBondContact O-CB 3.39Å; H300-V304 HydrophobicContact CB-CG2 4.27Å; H300-S316 PolarHBondContact CD2-OG 3.31Å; H300-S316 PolarHBondContact NE2-OG 2.81Å; H300-A318 HydrophobicContact CB-CB 4.26Å; H300-A318 VanDerWaalsContact CE1-CB 3.42Å; H300-A318 WeakPolarHBondContact CE1-CB 3.17Å; H300-A318 WeakPolarHBondContact ND1-CB 3.23Å; H300-D320 VanDerWaalsContact CA-OD2 3.24Å; H300-D320 WeakPolarHBondContact CA-OD2 3.44Å; H300-D320 WeakPolarHBondContact CB-OD2 3.24Å; H300-D320 IonicContact CE1-OD1 2.82Å; H300-D320 IonicContact CG-OD2 3.5Å; H300-D320 IonicContact ND1-OD1 3.35Å; H300-D320 PolarHBondContact ND1-OD1 2.59Å; H300-D320 IonicContact ND1-OD2 2.87Å; H300-D320 PolarHBondContact ND1-OD2 3.22Å; H300-S322 PolarHBondContact CE1-OG 2.89Å; H300-S322 PolarHBondContact ND1-OG 2.99Å
301	V	98.3	Very high	98.2	Very high	127 Å²	127	41.4 Å²	41.4	77%	0.77	26%	0.257	S	S	*	.	S	Bend	trans	-110.8	1.8	-179.7	-60.4	0	0	0	0	112.8	D320	V301-D320 HydrophobicContact CG2-CB 3.34Å; V301-D320 PolarHBondContact N-OD2 2.89Å
302	A	98.7	Very high	98.1	Very high	29 Å²	29	48.7 Å²	48.7	24%	0.24	28%	0.279	C	S	.	.	S	Bend	trans	-147.1	175.4	172.2	0	0	0	0	0	110.6	A281 V304 D320	A281-A302 WeakPolarHBondContact CA-O 3.46Å; A281-A302 VanDerWaalsContact CB-O 3.27Å; A281-A302 WeakPolarHBondContact CB-O 3.08Å; A302-V304 PolarHBondContact O-N 3.16Å; A302-D320 HydrophobicContact CB-CB 3.99Å
303	A	98.8	Very high	98.1	Very high	15 Å²	15	44.9 Å²	44.9	12%	0.124	26%	0.259	C	S	.	.			trans	-49.1	131.3	-176.1	0	0	0	0	0	113.8	R279 R305 A318 Y319	R279-A303 HydrophobicContact CB-CB 4.21Å; R279-A303 HydrophobicContact CG-CB 3.99Å; A303-R305 PolarHBondContact O-N 3.11Å; A303-A318 VanDerWaalsContact O-CA 3.31Å; A303-A318 WeakPolarHBondContact O-CA 3.38Å; A303-A318 WeakPolarHBondContact O-CB 3.46Å; A303-Y319 HydrophobicContact CB-CD2 3.84Å; A303-Y319 HydrophobicContact CB-CE2 4.36Å; A303-Y319 HydrophobicContact CB-CG 4.32Å; A303-Y319 PolarHBondContact O-N 3.12Å
304	V	98.9	Very high	98.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	117.1	173.4	-174.5	0	0	0	0	108.6	S278 L283 H300 A302	S278-V304 PolarHBondContact O-N 2.85Å; L283-V304 HydrophobicContact CD1-CG1 4.22Å; L283-V304 HydrophobicContact CD1-CG2 3.94Å; L283-V304 HydrophobicContact CD2-CG1 4.12Å; L283-V304 HydrophobicContact CG-CG1 4.07Å; L283-V304 HydrophobicContact CG-CG2 4.23Å; H300-V304 HydrophobicContact CB-CG2 4.27Å; A302-V304 PolarHBondContact O-N 3.16Å
305	R	98.8	Very high	98.1	Very high	51 Å²	51	39.3 Å²	39.3	19%	0.192	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-34.7	-172.4	176.7	56.8	-172.6	83.1	6.3	113	R265 A303 G317 Y319 Y345	R265-R305 VanDerWaalsContact CZ-CZ 3.44Å; R265-R305 VanDerWaalsContact NH2-NH2 3.2Å; A303-R305 PolarHBondContact O-N 3.11Å; R305-G317 PolarHBondContact N-O 3.48Å; R305-Y319 HydrophobicContact CB-CD1 4.04Å; R305-Y319 HydrophobicContact CB-CE1 3.63Å; R305-Y319 HydrophobicContact CG-CE1 3.74Å; R305-Y345 HydrophobicContact CG-CD1 4.01Å; R305-Y345 HydrophobicContact CG-CG 4.45Å
306	C	98.6	Very high	98.1	Very high	13 Å²	13	38.9 Å²	38.9	9%	0.088	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	148.3	-175.3	52.4	0	0	0	0	110.6	S316 G317 L347	C306-S316 WeakPolarHBondContact O-CA 3.42Å; C306-G317 PolarHBondContact N-O 3.04Å; C306-G317 PolarHBondContact O-N 2.68Å; C306-L347 HydrophobicContact CB-CB 4.39Å; C306-L347 HydrophobicContact CB-CD1 4.34Å; C306-L347 HydrophobicContact CB-CG 4.46Å; C306-L347 VanDerWaalsContact SG-CD1 3.54Å; C306-L347 VanDerWaalsContact SG-CG 3.54Å
307	V	98.8	Very high	98.2	Very high	10 Å²	10	35.9 Å²	35.9	6%	0.061	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	144.4	-179.7	64.5	0	0	0	0	109.9	C266 A268 I275 L283 V315	C266-V307 HydrophobicContact CB-CG1 3.92Å; A268-V307 HydrophobicContact CB-CG1 3.88Å; A268-V307 HydrophobicContact CB-CG2 4.27Å; I275-V307 HydrophobicContact CB-CG2 4.41Å; I275-V307 HydrophobicContact CG2-CG2 3.9Å; L283-V307 HydrophobicContact CD2-CB 4.19Å; L283-V307 HydrophobicContact CD2-CG2 3.66Å; V307-V315 CarbonylContact C-O 3.59Å; V307-V315 VanDerWaalsContact CA-O 3.25Å; V307-V315 WeakPolarHBondContact CA-O 3.36Å
308	Q	98.6	Very high	98.2	Very high	71 Å²	71	35.8 Å²	35.8	33%	0.332	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.7	169.8	-70.3	-66.7	-20.9	0	0	109.1	A314 V315 L347 F349	Q308-A314 CarbonylContact O-C 3.59Å; Q308-A314 WeakPolarHBondContact O-CA 3.31Å; Q308-V315 PolarHBondContact N-O 3.1Å; Q308-V315 PolarHBondContact O-N 2.85Å; Q308-L347 HydrophobicContact CG-CB 4.3Å; Q308-F349 HydrophobicContact CB-CB 3.65Å; Q308-F349 HydrophobicContact CB-CD1 4.24Å; Q308-F349 HydrophobicContact CB-CG 4.46Å; Q308-F349 HydrophobicContact CG-CB 4.13Å
309	F	98.4	Very high	98.2	Very high	19 Å²	19	34.4 Å²	34.4	8%	0.083	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	131.9	-176.3	179	-130	0	0	0	110.8	A268 K270 I273 I275 G311 R313 A314 V328	A268-F309 HydrophobicContact CB-CB 3.75Å; K270-F309 HydrophobicContact CB-CD1 3.48Å; K270-F309 VanDerWaalsContact CB-CD1 3.48Å; K270-F309 HydrophobicContact CB-CE1 3.62Å; K270-F309 HydrophobicContact CB-CG 4.47Å; I273-F309 HydrophobicContact CB-CE1 3.79Å; I273-F309 HydrophobicContact CB-CZ 4.14Å; I273-F309 HydrophobicContact CG2-CE1 3.69Å; I273-F309 HydrophobicContact CG2-CZ 3.78Å; I275-F309 HydrophobicContact CD1-CB 3.96Å; I275-F309 HydrophobicContact CD1-CD1 4.16Å; I275-F309 HydrophobicContact CD1-CD2 3.43Å; I275-F309 VanDerWaalsContact CD1-CD2 3.43Å; I275-F309 HydrophobicContact CD1-CE2 3.93Å; I275-F309 HydrophobicContact CD1-CG 3.58Å; I275-F309 HydrophobicContact CD1-CZ 4.45Å; I275-F309 HydrophobicContact CG1-CB 4.49Å; I275-F309 HydrophobicContact CG1-CD1 4.28Å; I275-F309 HydrophobicContact CG1-CD2 4.39Å; I275-F309 HydrophobicContact CG1-CG 4.15Å; F309-G311 VanDerWaalsContact CZ-O 3.32Å; F309-G311 WeakPolarHBondContact CZ-O 3.41Å; F309-R313 WeakPolarHBondContact CA-O 3.2Å; F309-R313 VanDerWaalsContact CD2-O 3.28Å; F309-R313 WeakPolarHBondContact CD2-O 3.23Å; F309-A314 HydrophobicContact CD2-CB 4.42Å; F309-V328 HydrophobicContact CD2-CG2 4.12Å; F309-V328 HydrophobicContact CE2-CB 4.2Å; F309-V328 HydrophobicContact CE2-CG1 4.43Å; F309-V328 HydrophobicContact CE2-CG2 3.66Å
310	D	97	Very high	98.3	Very high	40 Å²	40	34.1 Å²	34.1	21%	0.214	18%	0.176	C	C	.	.			trans	-104.9	6.2	-179.3	71.3	-2.5	0	0	0	114.1	R312 R313 F349 S351	D310-R312 PolarHBondContact OD1-N 3.25Å; D310-R313 PolarHBondContact N-O 3.36Å; D310-R313 PolarHBondContact OD1-N 3.34Å; D310-R313 IonicContact OD2-CZ 3.43Å; D310-R313 IonicContact OD2-NE 3.74Å; D310-R313 PolarHBondContact OD2-NE 3.15Å; D310-R313 IonicContact OD2-NH2 3.13Å; D310-R313 PolarHBondContact OD2-NH2 3.37Å; D310-F349 HydrophobicContact CB-CD1 4.2Å; D310-F349 HydrophobicContact CB-CE1 3.51Å; D310-F349 HydrophobicContact CB-CZ 4.04Å; D310-F349 VanDerWaalsContact CG-CE1 3.43Å; D310-F349 WeakPolarHBondContact OD2-CE1 3.49Å; D310-F349 WeakPolarHBondContact OD2-CZ 3.2Å; D310-S351 VanDerWaalsContact OD2-CB 3.27Å; D310-S351 WeakPolarHBondContact OD2-CB 3.46Å
311	G	95.9	Very high	98.3	Very high	36 Å²	36	37.4 Å²	37.4	37%	0.371	19%	0.19	S	C	.	.	S	Bend	trans	99.8	-20.8	-173.1	0	0	0	0	0	113.5	F309	F309-G311 VanDerWaalsContact CZ-O 3.32Å; F309-G311 WeakPolarHBondContact CZ-O 3.41Å
312	R	96.2	Very high	98.3	Very high	172 Å²	172	31.8 Å²	31.8	65%	0.649	16%	0.157	S	C	*	.	S	Bend	trans	-124.5	-43.6	179.4	-177.7	-179.4	175.3	-175.2	-0.5	113	D310 V328	D310-R312 PolarHBondContact OD1-N 3.25Å; R312-V328 WeakPolarHBondContact O-CB 3.4Å; R312-V328 PolarHBondContact O-N 3.31Å; R312-V328 VanDerWaalsContact O-N 3.12Å
313	R	97.5	Very high	98.3	Very high	36 Å²	36	30.4 Å²	30.4	14%	0.136	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.1	-174.4	-64.6	173.8	-66.2	-174.5	1.9	110.4	F309 D310 W326 F349 S351 D354	F309-R313 WeakPolarHBondContact CA-O 3.2Å; F309-R313 VanDerWaalsContact CD2-O 3.28Å; F309-R313 WeakPolarHBondContact CD2-O 3.23Å; D310-R313 PolarHBondContact N-O 3.36Å; D310-R313 PolarHBondContact OD1-N 3.34Å; D310-R313 IonicContact OD2-CZ 3.43Å; D310-R313 IonicContact OD2-NE 3.74Å; D310-R313 PolarHBondContact OD2-NE 3.15Å; D310-R313 IonicContact OD2-NH2 3.13Å; D310-R313 PolarHBondContact OD2-NH2 3.37Å; R313-W326 WeakPolarHBondContact CA-O 3.19Å; R313-F349 HydrophobicContact CB-CE1 4.22Å; R313-F349 HydrophobicContact CB-CZ 4.17Å; R313-S351 PolarHBondContact NH2-O 3.27Å; R313-D354 IonicContact CZ-OD1 3.21Å; R313-D354 IonicContact NH1-OD1 2.72Å; R313-D354 PolarHBondContact NH1-OD1 2.86Å; R313-D354 IonicContact NH1-OD2 3.75Å; R313-D354 IonicContact NH2-OD1 3.81Å; R313-D354 PolarHBondContact NH2-OD1 3.15Å
314	A	98.5	Very high	98.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	145.7	168.9	0	0	0	0	0	109.4	I275 Q308 F309 V325 W326 V328	I275-A314 HydrophobicContact CD1-CB 3.33Å; Q308-A314 CarbonylContact O-C 3.59Å; Q308-A314 WeakPolarHBondContact O-CA 3.31Å; F309-A314 HydrophobicContact CD2-CB 4.42Å; A314-V325 CarbonylContact O-C 3.42Å; A314-V325 WeakPolarHBondContact O-CA 3.27Å; A314-W326 HydrophobicContact CB-CB 4.1Å; A314-W326 HydrophobicContact CB-CG 4.36Å; A314-W326 PolarHBondContact N-O 3.01Å; A314-W326 VanDerWaalsContact N-O 3.09Å; A314-W326 PolarHBondContact O-N 3.47Å; A314-V328 HydrophobicContact CB-CG2 3.87Å
315	V	98.7	Very high	98.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.4	171.1	-176.6	0	0	0	0	107.9	V307 Q308 V323 K324 V325 L347 F349 V356	V307-V315 CarbonylContact C-O 3.59Å; V307-V315 VanDerWaalsContact CA-O 3.25Å; V307-V315 WeakPolarHBondContact CA-O 3.36Å; Q308-V315 PolarHBondContact N-O 3.1Å; Q308-V315 PolarHBondContact O-N 2.85Å; V315-V323 HydrophobicContact CG1-CG1 3.61Å; V315-K324 CarbonylContact C-O 3.59Å; V315-K324 WeakPolarHBondContact CA-O 3.11Å; V315-V325 HydrophobicContact CG2-CG1 4.38Å; V315-V325 HydrophobicContact CG2-CG2 4.4Å; V315-L347 HydrophobicContact CG1-CD1 4.11Å; V315-L347 HydrophobicContact CG1-CD2 4.19Å; V315-F349 HydrophobicContact CG2-CD1 3.91Å; V315-F349 HydrophobicContact CG2-CD2 4.25Å; V315-F349 HydrophobicContact CG2-CE1 4.11Å; V315-F349 HydrophobicContact CG2-CG 3.98Å; V315-F349 HydrophobicContact CG2-CZ 4.42Å; V315-V356 HydrophobicContact CB-CG2 4.39Å; V315-V356 HydrophobicContact CG1-CB 4.36Å; V315-V356 HydrophobicContact CG1-CG1 3.63Å; V315-V356 HydrophobicContact CG1-CG2 3.73Å; V315-V356 HydrophobicContact CG2-CG2 3.81Å
316	S	98.9	Very high	98.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	140	-176.4	62.3	0	0	0	0	112.2	H300 C306 V323 K324 W326	H300-S316 PolarHBondContact CD2-OG 3.31Å; H300-S316 PolarHBondContact NE2-OG 2.81Å; C306-S316 WeakPolarHBondContact O-CA 3.42Å; S316-V323 CarbonylContact O-C 3.51Å; S316-V323 VanDerWaalsContact O-CA 3.22Å; S316-V323 WeakPolarHBondContact O-CA 3.25Å; S316-V323 WeakPolarHBondContact O-CG1 3.49Å; S316-K324 PolarHBondContact N-O 3.39Å; S316-K324 PolarHBondContact O-N 3.14Å; S316-W326 PolarHBondContact OG-NE1 3.48Å
317	G	98.8	Very high	98.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.2	178.1	0	0	0	0	0	109.6	R305 C306	R305-G317 PolarHBondContact N-O 3.48Å; C306-G317 PolarHBondContact N-O 3.04Å; C306-G317 PolarHBondContact O-N 2.68Å
318	A	98.9	Very high	98.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	172.9	-169.6	0	0	0	0	0	113.5	H300 A303 D320 F321 S322 V344	H300-A318 HydrophobicContact CB-CB 4.26Å; H300-A318 VanDerWaalsContact CE1-CB 3.42Å; H300-A318 WeakPolarHBondContact CE1-CB 3.17Å; H300-A318 WeakPolarHBondContact ND1-CB 3.23Å; A303-A318 VanDerWaalsContact O-CA 3.31Å; A303-A318 WeakPolarHBondContact O-CA 3.38Å; A303-A318 WeakPolarHBondContact O-CB 3.46Å; A318-D320 WeakPolarHBondContact CB-OD1 3.23Å; A318-D320 PolarHBondContact O-N 3.27Å; A318-F321 PolarHBondContact O-N 2.87Å; A318-S322 PolarHBondContact N-O 3.25Å; A318-V344 PolarHBondContact O-N 2.9Å; A318-V344 VanDerWaalsContact O-N 3.09Å
319	Y	98.8	Very high	98	Very high	52 Å²	52	29.9 Å²	29.9	20%	0.204	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	0.6	177.2	-71.4	-4.2	0	0	0	114.1	A303 R305 F321 R343 Y345	A303-Y319 HydrophobicContact CB-CD2 3.84Å; A303-Y319 HydrophobicContact CB-CE2 4.36Å; A303-Y319 HydrophobicContact CB-CG 4.32Å; A303-Y319 PolarHBondContact O-N 3.12Å; R305-Y319 HydrophobicContact CB-CD1 4.04Å; R305-Y319 HydrophobicContact CB-CE1 3.63Å; R305-Y319 HydrophobicContact CG-CE1 3.74Å; Y319-F321 VanDerWaalsContact O-CD1 3.28Å; Y319-F321 WeakPolarHBondContact O-CD1 3.32Å; Y319-F321 VanDerWaalsContact O-CE1 3.23Å; Y319-F321 WeakPolarHBondContact O-CE1 3.45Å; Y319-R343 HydrophobicContact CD1-CB 3.64Å; Y319-R343 HydrophobicContact CD1-CG 3.81Å; Y319-R343 HydrophobicContact CE1-CB 4.12Å; Y319-R343 HydrophobicContact CE1-CG 4.47Å; Y319-R343 HydrophobicContact CG-CB 4.27Å; Y319-R343 HydrophobicContact CG-CG 3.91Å; Y319-Y345 HydrophobicContact CE1-CD1 4.39Å; Y319-Y345 HydrophobicContact CE1-CD2 4.45Å; Y319-Y345 AromaticContact CE1-CE1 3.93Å; Y319-Y345 HydrophobicContact CE1-CE1 3.93Å; Y319-Y345 HydrophobicContact CE1-CE2 4.01Å; Y319-Y345 AromaticContact CE1-CZ 3.72Å; Y319-Y345 AromaticContact CZ-CE1 4Å; Y319-Y345 AromaticContact CZ-CZ 3.9Å; Y319-Y345 VanDerWaalsContact OH-CE1 3.25Å; Y319-Y345 WeakPolarHBondContact OH-CE1 3.48Å; Y319-Y345 PolarHBondContact OH-OH 2.78Å
320	D	98.5	Very high	97.9	Very high	33 Å²	33	31.5 Å²	31.5	18%	0.176	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	9.1	170.4	63.5	17.4	0	0	0	112.8	H300 V301 A302 A318 S322	H300-D320 VanDerWaalsContact CA-OD2 3.24Å; H300-D320 WeakPolarHBondContact CA-OD2 3.44Å; H300-D320 WeakPolarHBondContact CB-OD2 3.24Å; H300-D320 IonicContact CE1-OD1 2.82Å; H300-D320 IonicContact CG-OD2 3.5Å; H300-D320 IonicContact ND1-OD1 3.35Å; H300-D320 PolarHBondContact ND1-OD1 2.59Å; H300-D320 IonicContact ND1-OD2 2.87Å; H300-D320 PolarHBondContact ND1-OD2 3.22Å; V301-D320 HydrophobicContact CG2-CB 3.34Å; V301-D320 PolarHBondContact N-OD2 2.89Å; A302-D320 HydrophobicContact CB-CB 3.99Å; A318-D320 WeakPolarHBondContact CB-OD1 3.23Å; A318-D320 PolarHBondContact O-N 3.27Å; D320-S322 VanDerWaalsContact CG-OG 3.29Å; D320-S322 PolarHBondContact O-N 3.01Å; D320-S322 VanDerWaalsContact O-N 3.15Å; D320-S322 WeakPolarHBondContact OD1-CB 3.47Å; D320-S322 PolarHBondContact OD1-N 3.4Å; D320-S322 PolarHBondContact OD1-OG 3.27Å; D320-S322 PolarHBondContact OD2-OG 3.31Å
321	F	98.6	Very high	97.9	Very high	82 Å²	82	35.7 Å²	35.7	36%	0.36	19%	0.19	S	C	.	.	S	Bend	trans	72.1	0.4	176.5	-37.1	-24.1	0	0	0	113.4	A318 Y319 H340 N342 R343	A318-F321 PolarHBondContact O-N 2.87Å; Y319-F321 VanDerWaalsContact O-CD1 3.28Å; Y319-F321 WeakPolarHBondContact O-CD1 3.32Å; Y319-F321 VanDerWaalsContact O-CE1 3.23Å; Y319-F321 WeakPolarHBondContact O-CE1 3.45Å; F321-H340 HydrophobicContact CB-CB 4.45Å; F321-H340 WeakPolarHBondContact CB-O 3.49Å; F321-H340 WeakPolarHBondContact O-CB 3.43Å; F321-N342 WeakPolarHBondContact CA-O 3.23Å; F321-N342 WeakPolarHBondContact CB-O 3.38Å; F321-N342 VanDerWaalsContact CD1-CA 3.45Å; F321-N342 VanDerWaalsContact CD1-O 3.32Å; F321-N342 WeakPolarHBondContact CD1-O 3.4Å; F321-N342 WeakPolarHBondContact CG-O 3.46Å; F321-R343 HydrophobicContact CD1-CG 4.28Å; F321-R343 HydrophobicContact CE1-CG 3.94Å
322	S	98.5	Very high	97.9	Very high	9 Å²	9	40.2 Å²	40.2	6%	0.063	20%	0.196	C	C	.	.			trans	-94.1	153.6	178.3	75.1	0	0	0	0	112.2	H300 A318 D320	H300-S322 PolarHBondContact CE1-OG 2.89Å; H300-S322 PolarHBondContact ND1-OG 2.99Å; A318-S322 PolarHBondContact N-O 3.25Å; D320-S322 VanDerWaalsContact CG-OG 3.29Å; D320-S322 PolarHBondContact O-N 3.01Å; D320-S322 VanDerWaalsContact O-N 3.15Å; D320-S322 WeakPolarHBondContact OD1-CB 3.47Å; D320-S322 PolarHBondContact OD1-N 3.4Å; D320-S322 PolarHBondContact OD1-OG 3.27Å; D320-S322 PolarHBondContact OD2-OG 3.31Å
323	V	98.8	Very high	98	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.7	161.7	-179.9	0	0	0	0	107.8	V315 S316 L337 V344 L347 V356	V315-V323 HydrophobicContact CG1-CG1 3.61Å; S316-V323 CarbonylContact O-C 3.51Å; S316-V323 VanDerWaalsContact O-CA 3.22Å; S316-V323 WeakPolarHBondContact O-CA 3.25Å; S316-V323 WeakPolarHBondContact O-CG1 3.49Å; V323-L337 HydrophobicContact CB-CB 4.11Å; V323-L337 HydrophobicContact CB-CD1 4.16Å; V323-L337 HydrophobicContact CB-CG 4.5Å; V323-L337 HydrophobicContact CG1-CD1 4Å; V323-L337 PolarHBondContact N-O 3Å; V323-L337 VanDerWaalsContact N-O 3.11Å; V323-L337 WeakPolarHBondContact O-CA 3.23Å; V323-L337 WeakPolarHBondContact O-CB 3.33Å; V323-L337 PolarHBondContact O-N 2.97Å; V323-V344 HydrophobicContact CG2-CG1 4.06Å; V323-V344 HydrophobicContact CG2-CG2 4.06Å; V323-L347 HydrophobicContact CG1-CD2 3.95Å; V323-L347 HydrophobicContact CG2-CD2 4.27Å; V323-V356 HydrophobicContact CG1-CG1 4.02Å
324	K	98.7	Very high	98	Very high	21 Å²	21	35 Å²	35	9%	0.091	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.3	178.7	-71.3	176.3	-172.7	-84.3	0	110.8	G299 V315 S316 W326 H335 T336	G299-K324 VanDerWaalsContact C-CE 3.47Å; G299-K324 WeakPolarHBondContact O-CE 3.41Å; G299-K324 PolarHBondContact O-NZ 2.87Å; V315-K324 CarbonylContact C-O 3.59Å; V315-K324 WeakPolarHBondContact CA-O 3.11Å; S316-K324 PolarHBondContact N-O 3.39Å; S316-K324 PolarHBondContact O-N 3.14Å; K324-W326 HydrophobicContact CB-CD2 4.47Å; K324-W326 HydrophobicContact CB-CH2 4.47Å; K324-W326 HydrophobicContact CB-CZ2 3.57Å; K324-W326 HydrophobicContact CD-CH2 3.76Å; K324-W326 HydrophobicContact CD-CZ2 3.45Å; K324-W326 VanDerWaalsContact CD-CZ2 3.45Å; K324-W326 HydrophobicContact CG-CZ2 4.13Å; K324-W326 PolarHBondContact O-NE1 2.83Å; K324-H335 WeakPolarHBondContact CA-O 3.26Å; K324-T336 HydrophobicContact CG-CG2 4.18Å; K324-T336 PolarHBondContact NZ-OG1 2.81Å
325	V	98.5	Very high	97.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.9	172.7	-173	0	0	0	0	107.9	A314 V315 I334 H335 L337 V356 I370	A314-V325 CarbonylContact O-C 3.42Å; A314-V325 WeakPolarHBondContact O-CA 3.27Å; V315-V325 HydrophobicContact CG2-CG1 4.38Å; V315-V325 HydrophobicContact CG2-CG2 4.4Å; V325-I334 HydrophobicContact CG1-CD1 4.3Å; V325-I334 PolarHBondContact O-N 3.14Å; V325-H335 HydrophobicContact CB-CB 4.27Å; V325-H335 HydrophobicContact CG2-CB 4.32Å; V325-H335 PolarHBondContact N-O 3.16Å; V325-H335 PolarHBondContact O-N 2.77Å; V325-L337 HydrophobicContact CG2-CD1 4.06Å; V325-L337 HydrophobicContact CG2-CG 4.44Å; V325-V356 HydrophobicContact CG2-CG2 4.5Å; V325-I370 HydrophobicContact CG1-CG2 3.99Å; V325-I370 HydrophobicContact CG2-CG1 4.45Å
326	W	98.5	Very high	97.9	Very high	3 Å²	3	40.1 Å²	40.1	1%	0.011	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.2	-173.3	-47.7	85.8	0	0	0	110.5	L283 L297 R313 A314 S316 K324 R332 C333	L283-W326 HydrophobicContact CD1-CZ2 3.92Å; L297-W326 HydrophobicContact CB-CD2 4.14Å; L297-W326 HydrophobicContact CB-CE3 3.81Å; L297-W326 HydrophobicContact CB-CH2 4.3Å; L297-W326 HydrophobicContact CB-CZ3 3.9Å; L297-W326 HydrophobicContact CD1-CB 3.96Å; L297-W326 HydrophobicContact CD1-CD2 4.07Å; L297-W326 HydrophobicContact CD1-CE3 4.32Å; L297-W326 HydrophobicContact CD1-CG 3.91Å; L297-W326 HydrophobicContact CD2-CE3 4.4Å; L297-W326 HydrophobicContact CG-CE3 4.4Å; R313-W326 WeakPolarHBondContact CA-O 3.19Å; A314-W326 HydrophobicContact CB-CB 4.1Å; A314-W326 HydrophobicContact CB-CG 4.36Å; A314-W326 PolarHBondContact N-O 3.01Å; A314-W326 VanDerWaalsContact N-O 3.09Å; A314-W326 PolarHBondContact O-N 3.47Å; S316-W326 PolarHBondContact OG-NE1 3.48Å; K324-W326 HydrophobicContact CB-CD2 4.47Å; K324-W326 HydrophobicContact CB-CH2 4.47Å; K324-W326 HydrophobicContact CB-CZ2 3.57Å; K324-W326 HydrophobicContact CD-CH2 3.76Å; K324-W326 HydrophobicContact CD-CZ2 3.45Å; K324-W326 VanDerWaalsContact CD-CZ2 3.45Å; K324-W326 HydrophobicContact CG-CZ2 4.13Å; K324-W326 PolarHBondContact O-NE1 2.83Å; W326-R332 WeakPolarHBondContact CA-O 3.22Å; W326-C333 HydrophobicContact CE3-CB 3.8Å; W326-C333 HydrophobicContact CH2-CB 4.46Å; W326-C333 HydrophobicContact CZ3-CB 3.74Å
327	D	97.6	Very high	97.8	Very high	21 Å²	21	40.2 Å²	40.2	11%	0.112	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	113	160.5	-170	-44.5	0	0	0	107.4	A329 A330 K331 R332 I334	D327-A329 PolarHBondContact OD1-N 3.25Å; D327-A329 VanDerWaalsContact OD1-N 3.13Å; D327-A330 HydrophobicContact CB-CB 3.96Å; D327-A330 PolarHBondContact OD1-N 2.87Å; D327-K331 WeakPolarHBondContact O-CA 3.47Å; D327-K331 PolarHBondContact O-N 3.48Å; D327-R332 HydrophobicContact CB-CG 4.22Å; D327-R332 PolarHBondContact N-O 2.54Å; D327-R332 PolarHBondContact O-N 3.26Å; D327-I334 HydrophobicContact CB-CD1 3.89Å; D327-I334 HydrophobicContact CB-CG1 3.91Å
328	V	97.4	Very high	97.8	Very high	17 Å²	17	46.7 Å²	46.7	10%	0.103	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-38.1	-174	175.1	0	0	0	0	111.2	I275 V285 F309 R312 A314 K331	I275-V328 HydrophobicContact CD1-CG2 3.78Å; V285-V328 HydrophobicContact CB-CG1 4.48Å; V285-V328 HydrophobicContact CG1-CG1 3.68Å; V285-V328 HydrophobicContact CG2-CG1 4Å; F309-V328 HydrophobicContact CD2-CG2 4.12Å; F309-V328 HydrophobicContact CE2-CB 4.2Å; F309-V328 HydrophobicContact CE2-CG1 4.43Å; F309-V328 HydrophobicContact CE2-CG2 3.66Å; R312-V328 WeakPolarHBondContact O-CB 3.4Å; R312-V328 PolarHBondContact O-N 3.31Å; R312-V328 VanDerWaalsContact O-N 3.12Å; A314-V328 HydrophobicContact CB-CG2 3.87Å; V328-K331 PolarHBondContact O-N 3.18Å
329	A	95.4	Very high	97.7	Very high	87 Å²	87	47.6 Å²	47.6	72%	0.719	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-43.6	179.1	0	0	0	0	0	111.4	D327 K331	D327-A329 PolarHBondContact OD1-N 3.25Å; D327-A329 VanDerWaalsContact OD1-N 3.13Å; A329-K331 VanDerWaalsContact C-N 3.26Å; A329-K331 PolarHBondContact O-N 2.79Å
330	A	96.8	Very high	97.7	Very high	52 Å²	52	45.5 Å²	45.5	43%	0.43	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-2.7	177.4	0	0	0	0	0	113.8	D327 R332	D327-A330 HydrophobicContact CB-CB 3.96Å; D327-A330 PolarHBondContact OD1-N 2.87Å; A330-R332 HydrophobicContact CB-CG 4Å; A330-R332 PolarHBondContact O-N 2.79Å
331	K	96.4	Very high	97.7	Very high	128 Å²	128	50.2 Å²	50.2	56%	0.557	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	35.8	176.7	-48.8	-177.9	-171.7	-167.8	0	113.6	L294 A295 D327 V328 A329	L294-K331 WeakPolarHBondContact O-CE 3.49Å; L294-K331 PolarHBondContact O-NZ 3.04Å; A295-K331 HydrophobicContact CB-CB 4.38Å; A295-K331 HydrophobicContact CB-CD 3.77Å; A295-K331 HydrophobicContact CB-CG 3.83Å; D327-K331 WeakPolarHBondContact O-CA 3.47Å; D327-K331 PolarHBondContact O-N 3.48Å; V328-K331 PolarHBondContact O-N 3.18Å; A329-K331 VanDerWaalsContact C-N 3.26Å; A329-K331 PolarHBondContact O-N 2.79Å
332	R	96.6	Very high	97.6	Very high	132 Å²	132	48.9 Å²	48.9	50%	0.498	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.7	-174.1	69.1	-178.9	-178.2	86	2.5	112.6	W326 D327 A330 I334	W326-R332 WeakPolarHBondContact CA-O 3.22Å; D327-R332 HydrophobicContact CB-CG 4.22Å; D327-R332 PolarHBondContact N-O 2.54Å; D327-R332 PolarHBondContact O-N 3.26Å; A330-R332 HydrophobicContact CB-CG 4Å; A330-R332 PolarHBondContact O-N 2.79Å; R332-I334 PolarHBondContact O-N 3.28Å
333	C	97.6	Very high	97.6	Very high	45 Å²	45	53.7 Å²	53.7	30%	0.304	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	123.8	167.2	-168	0	0	0	0	108.8	W326 H335	W326-C333 HydrophobicContact CE3-CB 3.8Å; W326-C333 HydrophobicContact CH2-CB 4.46Å; W326-C333 HydrophobicContact CZ3-CB 3.74Å; C333-H335 PolarHBondContact SG-O 2.87Å
334	I	96.6	Very high	97.6	Very high	54 Å²	54	53.7 Å²	53.7	28%	0.277	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-50	172.3	-53.9	175.7	0	0	0	109	V325 D327 R332	V325-I334 HydrophobicContact CG1-CD1 4.3Å; V325-I334 PolarHBondContact O-N 3.14Å; D327-I334 HydrophobicContact CB-CD1 3.89Å; D327-I334 HydrophobicContact CB-CG1 3.91Å; R332-I334 PolarHBondContact O-N 3.28Å
335	H	97.3	Very high	97.6	Very high	46 Å²	46	54.6 Å²	54.6	21%	0.213	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	144.5	-176.3	-73.9	-60.4	0	0	0	111.7	K324 V325 C333 L337 I370 V371	K324-H335 WeakPolarHBondContact CA-O 3.26Å; V325-H335 HydrophobicContact CB-CB 4.27Å; V325-H335 HydrophobicContact CG2-CB 4.32Å; V325-H335 PolarHBondContact N-O 3.16Å; V325-H335 PolarHBondContact O-N 2.77Å; C333-H335 PolarHBondContact SG-O 2.87Å; H335-L337 HydrophobicContact CB-CD2 3.9Å; H335-I370 PolarHBondContact CD2-O 2.8Å; H335-I370 PolarHBondContact NE2-O 3.47Å; H335-V371 PolarHBondContact NE2-O 2.88Å
336	T	98.3	Very high	97.6	Very high	60 Å²	60	55 Å²	55	37%	0.368	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	106.6	160.7	-59.6	0	0	0	0	107.5	K324 I338	K324-T336 HydrophobicContact CG-CG2 4.18Å; K324-T336 PolarHBondContact NZ-OG1 2.81Å; T336-I338 HydrophobicContact CG2-CD1 4.19Å; T336-I338 HydrophobicContact CG2-CG1 3.92Å
337	L	98.2	Very high	97.6	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.016	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	112.2	-179.2	-48.1	176.8	0	0	0	108.5	V323 V325 H335 V356 W368 G373	V323-L337 HydrophobicContact CB-CB 4.11Å; V323-L337 HydrophobicContact CB-CD1 4.16Å; V323-L337 HydrophobicContact CB-CG 4.5Å; V323-L337 HydrophobicContact CG1-CD1 4Å; V323-L337 PolarHBondContact N-O 3Å; V323-L337 VanDerWaalsContact N-O 3.11Å; V323-L337 WeakPolarHBondContact O-CA 3.23Å; V323-L337 WeakPolarHBondContact O-CB 3.33Å; V323-L337 PolarHBondContact O-N 2.97Å; V325-L337 HydrophobicContact CG2-CD1 4.06Å; V325-L337 HydrophobicContact CG2-CG 4.44Å; H335-L337 HydrophobicContact CB-CD2 3.9Å; L337-V356 HydrophobicContact CD1-CB 4.48Å; L337-W368 HydrophobicContact CB-CD2 3.97Å; L337-W368 HydrophobicContact CB-CE3 3.78Å; L337-W368 HydrophobicContact CB-CH2 4.17Å; L337-W368 HydrophobicContact CB-CZ2 4.32Å; L337-W368 HydrophobicContact CB-CZ3 3.9Å; L337-W368 HydrophobicContact CD1-CB 3.8Å; L337-W368 HydrophobicContact CD1-CD2 3.96Å; L337-W368 HydrophobicContact CD1-CE3 4.37Å; L337-W368 HydrophobicContact CD1-CG 3.72Å; L337-W368 HydrophobicContact CD2-CE3 4.33Å; L337-W368 HydrophobicContact CG-CD2 4.43Å; L337-W368 HydrophobicContact CG-CE3 4.38Å; L337-G373 WeakPolarHBondContact CD2-O 3.41Å
338	I	97.4	Very high	97.6	Very high	135 Å²	135	55.8 Å²	55.8	69%	0.692	30%	0.297	S	S	*	.			trans	-113.6	136.3	-175.5	-59.5	175.6	0	0	0	108.8	T336 W368	T336-I338 HydrophobicContact CG2-CD1 4.19Å; T336-I338 HydrophobicContact CG2-CG1 3.92Å; I338-W368 WeakPolarHBondContact O-CH2 3.28Å
339	G	97.1	Very high	97.6	Very high	19 Å²	19	56.4 Å²	56.4	20%	0.196	30%	0.298	C	S	.	.			trans	161.6	-21.5	175.9	0	0	0	0	0	114.1	R366	G339-R366 VanDerWaalsContact C-NE 3.29Å; G339-R366 PolarHBondContact O-NE 3.08Å; G339-R366 PolarHBondContact O-NH2 3.12Å
340	H	98.5	Very high	97.7	Very high	8 Å²	8	53.6 Å²	53.6	4%	0.037	27%	0.271	C	S	.	.			trans	-69.9	143	167.8	-76.9	-60.2	0	0	0	110.5	F321 V344 S358 S360 D362 S364	F321-H340 HydrophobicContact CB-CB 4.45Å; F321-H340 WeakPolarHBondContact CB-O 3.49Å; F321-H340 WeakPolarHBondContact O-CB 3.43Å; H340-V344 HydrophobicContact CB-CG2 4.3Å; H340-S358 PolarHBondContact CD2-OG 3.27Å; H340-S358 PolarHBondContact NE2-O 2.75Å; H340-S358 PolarHBondContact NE2-OG 2.75Å; H340-S360 VanDerWaalsContact CE1-CB 3.41Å; H340-S360 WeakPolarHBondContact CE1-CB 3.31Å; H340-S360 WeakPolarHBondContact ND1-CB 3.42Å; H340-D362 WeakPolarHBondContact CA-OD2 3.37Å; H340-D362 WeakPolarHBondContact CB-OD2 3.36Å; H340-D362 IonicContact CE1-OD1 3.16Å; H340-D362 IonicContact CG-OD2 3.33Å; H340-D362 IonicContact ND1-OD1 2.73Å; H340-D362 PolarHBondContact ND1-OD1 3.28Å; H340-D362 IonicContact ND1-OD2 3.95Å; H340-D362 PolarHBondContact ND1-OD2 3.37Å; H340-S364 PolarHBondContact CE1-OG 2.64Å; H340-S364 VanDerWaalsContact CE1-OG 3.29Å; H340-S364 PolarHBondContact ND1-OG 3.33Å; H340-S364 VanDerWaalsContact ND1-OG 3.15Å
341	N	98	Very high	97.6	Very high	133 Å²	133	53.8 Å²	53.8	71%	0.711	27%	0.269	S	S	*	.	S	Bend	trans	-103.7	5.3	-179.3	-67.1	-26.4	0	0	0	112.3	D362	N341-D362 HydrophobicContact CB-CB 4.37Å; N341-D362 PolarHBondContact N-OD2 2.58Å
342	N	98.4	Very high	97.5	Very high	54 Å²	54	52.1 Å²	52.1	29%	0.289	28%	0.28	S	S	.	.	S	Bend	trans	-154.9	179	177.1	-149.1	-34.1	0	0	0	109.9	F321 V344 S360 L361 D362	F321-N342 WeakPolarHBondContact CA-O 3.23Å; F321-N342 WeakPolarHBondContact CB-O 3.38Å; F321-N342 VanDerWaalsContact CD1-CA 3.45Å; F321-N342 VanDerWaalsContact CD1-O 3.32Å; F321-N342 WeakPolarHBondContact CD1-O 3.4Å; F321-N342 WeakPolarHBondContact CG-O 3.46Å; N342-V344 PolarHBondContact O-N 2.94Å; N342-S360 PolarHBondContact O-OG 2.89Å; N342-S360 VanDerWaalsContact O-OG 3.1Å; N342-L361 HydrophobicContact CB-CB 4.11Å; N342-D362 HydrophobicContact CB-CB 3.79Å
343	R	98.6	Very high	97.5	Very high	109 Å²	109	49.6 Å²	49.6	41%	0.411	27%	0.27	S	S	.	.			trans	-56	132.1	-173.3	-64.2	178.9	179.2	169.4	3.5	112.4	Y319 F321 Y345 S360 L361	Y319-R343 HydrophobicContact CD1-CB 3.64Å; Y319-R343 HydrophobicContact CD1-CG 3.81Å; Y319-R343 HydrophobicContact CE1-CB 4.12Å; Y319-R343 HydrophobicContact CE1-CG 4.47Å; Y319-R343 HydrophobicContact CG-CB 4.27Å; Y319-R343 HydrophobicContact CG-CG 3.91Å; F321-R343 HydrophobicContact CD1-CG 4.28Å; F321-R343 HydrophobicContact CE1-CG 3.94Å; R343-Y345 HydrophobicContact CB-CD2 4.07Å; R343-Y345 HydrophobicContact CB-CE2 3.62Å; R343-Y345 WeakPolarHBondContact O-CD2 3.38Å; R343-S360 WeakPolarHBondContact O-CA 3.28Å; R343-S360 PolarHBondContact O-OG 3.3Å; R343-L361 HydrophobicContact CB-CB 4.42Å; R343-L361 PolarHBondContact O-N 3.39Å
344	V	98.7	Very high	97.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	128	172.4	-177.3	0	0	0	0	109.8	A318 V323 H340 N342	A318-V344 PolarHBondContact O-N 2.9Å; A318-V344 VanDerWaalsContact O-N 3.09Å; V323-V344 HydrophobicContact CG2-CG1 4.06Å; V323-V344 HydrophobicContact CG2-CG2 4.06Å; H340-V344 HydrophobicContact CB-CG2 4.3Å; N342-V344 PolarHBondContact O-N 2.94Å
345	Y	98.6	Very high	97.4	Very high	40 Å²	40	47.9 Å²	47.9	16%	0.157	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-31.9	-174	-88.9	-91.7	0	0	0	114.5	R305 Y319 R343 G359 L361 L385	R305-Y345 HydrophobicContact CG-CD1 4.01Å; R305-Y345 HydrophobicContact CG-CG 4.45Å; Y319-Y345 HydrophobicContact CE1-CD1 4.39Å; Y319-Y345 HydrophobicContact CE1-CD2 4.45Å; Y319-Y345 AromaticContact CE1-CE1 3.93Å; Y319-Y345 HydrophobicContact CE1-CE1 3.93Å; Y319-Y345 HydrophobicContact CE1-CE2 4.01Å; Y319-Y345 AromaticContact CE1-CZ 3.72Å; Y319-Y345 AromaticContact CZ-CE1 4Å; Y319-Y345 AromaticContact CZ-CZ 3.9Å; Y319-Y345 VanDerWaalsContact OH-CE1 3.25Å; Y319-Y345 WeakPolarHBondContact OH-CE1 3.48Å; Y319-Y345 PolarHBondContact OH-OH 2.78Å; R343-Y345 HydrophobicContact CB-CD2 4.07Å; R343-Y345 HydrophobicContact CB-CE2 3.62Å; R343-Y345 WeakPolarHBondContact O-CD2 3.38Å; Y345-G359 PolarHBondContact N-O 3.37Å; Y345-L361 HydrophobicContact CD2-CB 4.14Å; Y345-L361 HydrophobicContact CE2-CB 3.95Å; Y345-L361 HydrophobicContact CE2-CD2 4.25Å; Y345-L385 HydrophobicContact CD1-CD1 3.82Å; Y345-L385 HydrophobicContact CD2-CD1 3.51Å; Y345-L385 HydrophobicContact CD2-CG 4.08Å; Y345-L385 HydrophobicContact CE1-CD1 3.79Å; Y345-L385 HydrophobicContact CE2-CD1 3.46Å; Y345-L385 VanDerWaalsContact CE2-CD1 3.46Å; Y345-L385 HydrophobicContact CE2-CG 4.46Å; Y345-L385 HydrophobicContact CG-CD1 3.68Å; Y345-L385 HydrophobicContact CG-CD2 4.35Å; Y345-L385 HydrophobicContact CG-CG 4.12Å
346	S	98	Very high	97.5	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.063	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.4	-175	52.7	0	0	0	0	111.2	S358 G359 T386 M389	S346-S358 WeakPolarHBondContact O-CA 3.26Å; S346-G359 PolarHBondContact N-O 2.77Å; S346-G359 PolarHBondContact O-N 3.18Å; S346-G359 WeakPolarHBondContact OG-CA 3.42Å; S346-T386 PolarHBondContact OG-O 2.75Å; S346-M389 WeakPolarHBondContact O-CE 3.35Å
347	L	98	Very high	97.5	Very high	8 Å²	8	42.9 Å²	42.9	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	143	-179	-85.4	174.6	0	0	0	110.7	C306 Q308 V315 V323 V356 I357	C306-L347 HydrophobicContact CB-CB 4.39Å; C306-L347 HydrophobicContact CB-CD1 4.34Å; C306-L347 HydrophobicContact CB-CG 4.46Å; C306-L347 VanDerWaalsContact SG-CD1 3.54Å; C306-L347 VanDerWaalsContact SG-CG 3.54Å; Q308-L347 HydrophobicContact CG-CB 4.3Å; V315-L347 HydrophobicContact CG1-CD1 4.11Å; V315-L347 HydrophobicContact CG1-CD2 4.19Å; V323-L347 HydrophobicContact CG1-CD2 3.95Å; V323-L347 HydrophobicContact CG2-CD2 4.27Å; L347-V356 HydrophobicContact CD2-CG1 3.69Å; L347-I357 CarbonylContact C-O 3.5Å; L347-I357 VanDerWaalsContact CA-O 3.3Å; L347-I357 WeakPolarHBondContact CA-O 3.32Å
348	Q	98.2	Very high	97.5	Very high	32 Å²	32	42.7 Å²	42.7	15%	0.15	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.3	160.1	-65.7	-66.9	-77	0	0	108.6	I357 M389 L391 L396	Q348-I357 HydrophobicContact CB-CB 4.25Å; Q348-I357 HydrophobicContact CB-CD1 4.3Å; Q348-I357 PolarHBondContact N-O 2.83Å; Q348-I357 PolarHBondContact O-N 2.83Å; Q348-M389 HydrophobicContact CG-CB 3.92Å; Q348-M389 PolarHBondContact NE2-O 3.35Å; Q348-L391 HydrophobicContact CB-CB 4.3Å; Q348-L391 HydrophobicContact CG-CB 4.29Å; Q348-L396 HydrophobicContact CG-CD1 4.4Å
349	F	97.5	Very high	97.6	Very high	31 Å²	31	36.3 Å²	36.3	14%	0.136	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	114.6	179.6	177.3	-159.3	0	0	0	108.7	Q308 D310 R313 V315 V356 I370	Q308-F349 HydrophobicContact CB-CB 3.65Å; Q308-F349 HydrophobicContact CB-CD1 4.24Å; Q308-F349 HydrophobicContact CB-CG 4.46Å; Q308-F349 HydrophobicContact CG-CB 4.13Å; D310-F349 HydrophobicContact CB-CD1 4.2Å; D310-F349 HydrophobicContact CB-CE1 3.51Å; D310-F349 HydrophobicContact CB-CZ 4.04Å; D310-F349 VanDerWaalsContact CG-CE1 3.43Å; D310-F349 WeakPolarHBondContact OD2-CE1 3.49Å; D310-F349 WeakPolarHBondContact OD2-CZ 3.2Å; R313-F349 HydrophobicContact CB-CE1 4.22Å; R313-F349 HydrophobicContact CB-CZ 4.17Å; V315-F349 HydrophobicContact CG2-CD1 3.91Å; V315-F349 HydrophobicContact CG2-CD2 4.25Å; V315-F349 HydrophobicContact CG2-CE1 4.11Å; V315-F349 HydrophobicContact CG2-CG 3.98Å; V315-F349 HydrophobicContact CG2-CZ 4.42Å; F349-V356 HydrophobicContact CD2-CG2 4.46Å; F349-I370 HydrophobicContact CD2-CD1 3.81Å; F349-I370 HydrophobicContact CE2-CD1 3.17Å; F349-I370 HydrophobicContact CZ-CD1 3.87Å
350	D	96.8	Very high	97.7	Very high	27 Å²	27	35.4 Å²	35.4	14%	0.144	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	99.9	168.3	-169.5	-41	0	0	0	109.2	A352 R353 D354 L355 L391	D350-A352 VanDerWaalsContact C-N 3.33Å; D350-A352 WeakPolarHBondContact OD1-CB 3.25Å; D350-A352 PolarHBondContact OD1-N 2.92Å; D350-R353 PolarHBondContact OD1-N 2.89Å; D350-R353 IonicContact OD1-NE 3.13Å; D350-R353 IonicContact OD2-CZ 3.05Å; D350-R353 IonicContact OD2-NE 3.75Å; D350-R353 PolarHBondContact OD2-NE 3.18Å; D350-R353 IonicContact OD2-NH2 3.88Å; D350-R353 PolarHBondContact OD2-NH2 2.91Å; D350-D354 WeakPolarHBondContact O-CA 3.45Å; D350-D354 PolarHBondContact O-N 2.93Å; D350-D354 VanDerWaalsContact O-N 3.08Å; D350-L355 HydrophobicContact CB-CB 4.22Å; D350-L355 PolarHBondContact N-O 2.88Å; D350-L355 PolarHBondContact O-N 2.86Å; D350-L391 HydrophobicContact CB-CD2 3.84Å
351	S	95.2	Very high	97.7	Very high	56 Å²	56	37.7 Å²	37.7	39%	0.392	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.9	179.9	55.5	0	0	0	0	113.6	D310 R313	D310-S351 VanDerWaalsContact OD2-CB 3.27Å; D310-S351 WeakPolarHBondContact OD2-CB 3.46Å; R313-S351 PolarHBondContact NH2-O 3.27Å
352	A	94.9	Very high	97.7	Very high	94 Å²	94	32.9 Å²	32.9	78%	0.777	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-31.4	-178.7	0	0	0	0	0	112.1	D350	D350-A352 VanDerWaalsContact C-N 3.33Å; D350-A352 WeakPolarHBondContact OD1-CB 3.25Å; D350-A352 PolarHBondContact OD1-N 2.92Å
353	R	95	Very high	97.7	Very high	79 Å²	79	32.5 Å²	32.5	30%	0.298	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	5.1	178.6	-64.8	178.9	-68.7	172.3	2.3	113.8	D350 L355 G393 N394	D350-R353 PolarHBondContact OD1-N 2.89Å; D350-R353 IonicContact OD1-NE 3.13Å; D350-R353 IonicContact OD2-CZ 3.05Å; D350-R353 IonicContact OD2-NE 3.75Å; D350-R353 PolarHBondContact OD2-NE 3.18Å; D350-R353 IonicContact OD2-NH2 3.88Å; D350-R353 PolarHBondContact OD2-NH2 2.91Å; R353-L355 VanDerWaalsContact C-N 3.28Å; R353-L355 HydrophobicContact CB-CD1 4.16Å; R353-L355 HydrophobicContact CB-CG 4.08Å; R353-L355 PolarHBondContact O-N 2.95Å; R353-G393 PolarHBondContact NH1-O 2.96Å; R353-G393 PolarHBondContact NH2-O 3.45Å; R353-N394 PolarHBondContact NH1-OD1 2.78Å
354	D	96.2	Very high	97.6	Very high	46 Å²	46	27.8 Å²	27.8	25%	0.246	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	41.6	-177.2	-73.2	-22.8	0	0	0	113.5	R313 D350 I370 V371	R313-D354 IonicContact CZ-OD1 3.21Å; R313-D354 IonicContact NH1-OD1 2.72Å; R313-D354 PolarHBondContact NH1-OD1 2.86Å; R313-D354 IonicContact NH1-OD2 3.75Å; R313-D354 IonicContact NH2-OD1 3.81Å; R313-D354 PolarHBondContact NH2-OD1 3.15Å; D350-D354 WeakPolarHBondContact O-CA 3.45Å; D350-D354 PolarHBondContact O-N 2.93Å; D350-D354 VanDerWaalsContact O-N 3.08Å; D354-I370 HydrophobicContact CB-CB 4.16Å; D354-I370 WeakPolarHBondContact O-CB 3.36Å; D354-I370 WeakPolarHBondContact O-CG1 3.42Å; D354-I370 PolarHBondContact O-N 2.8Å; D354-V371 HydrophobicContact CB-CG2 4.06Å; D354-V371 WeakPolarHBondContact OD2-CG2 3.38Å
355	L	97.4	Very high	97.6	Very high	17 Å²	17	27.8 Å²	27.8	9%	0.089	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.6	180	-60.8	178.1	0	0	0	112.4	D350 R353 I357 V367 W368 L376	D350-L355 HydrophobicContact CB-CB 4.22Å; D350-L355 PolarHBondContact N-O 2.88Å; D350-L355 PolarHBondContact O-N 2.86Å; R353-L355 VanDerWaalsContact C-N 3.28Å; R353-L355 HydrophobicContact CB-CD1 4.16Å; R353-L355 HydrophobicContact CB-CG 4.08Å; R353-L355 PolarHBondContact O-N 2.95Å; L355-I357 HydrophobicContact CB-CD1 4.39Å; L355-V367 HydrophobicContact CD2-CG1 4.41Å; L355-W368 CarbonylContact C-O 3.48Å; L355-W368 VanDerWaalsContact CA-O 3.3Å; L355-W368 WeakPolarHBondContact CA-O 3.44Å; L355-L376 HydrophobicContact CD2-CD1 3.61Å
356	V	98.3	Very high	97.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.8	165.7	176.4	0	0	0	0	109	V315 V323 V325 L337 L347 F349 V367 W368 I370	V315-V356 HydrophobicContact CB-CG2 4.39Å; V315-V356 HydrophobicContact CG1-CB 4.36Å; V315-V356 HydrophobicContact CG1-CG1 3.63Å; V315-V356 HydrophobicContact CG1-CG2 3.73Å; V315-V356 HydrophobicContact CG2-CG2 3.81Å; V323-V356 HydrophobicContact CG1-CG1 4.02Å; V325-V356 HydrophobicContact CG2-CG2 4.5Å; L337-V356 HydrophobicContact CD1-CB 4.48Å; L347-V356 HydrophobicContact CD2-CG1 3.69Å; F349-V356 HydrophobicContact CD2-CG2 4.46Å; V356-V367 CarbonylContact O-C 3.49Å; V356-V367 WeakPolarHBondContact O-CA 3.28Å; V356-W368 HydrophobicContact CB-CB 4.26Å; V356-W368 PolarHBondContact N-O 2.63Å; V356-W368 VanDerWaalsContact O-CD1 3.31Å; V356-W368 PolarHBondContact O-N 2.91Å; V356-I370 HydrophobicContact CG2-CD1 3.7Å; V356-I370 HydrophobicContact CG2-CG1 3.62Å
357	I	98.6	Very high	97.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124	171.7	-55.9	83.7	0	0	0	108.4	L347 Q348 L355 I365 R366 V367 M389 L391 L396 V410	L347-I357 CarbonylContact C-O 3.5Å; L347-I357 VanDerWaalsContact CA-O 3.3Å; L347-I357 WeakPolarHBondContact CA-O 3.32Å; Q348-I357 HydrophobicContact CB-CB 4.25Å; Q348-I357 HydrophobicContact CB-CD1 4.3Å; Q348-I357 PolarHBondContact N-O 2.83Å; Q348-I357 PolarHBondContact O-N 2.83Å; L355-I357 HydrophobicContact CB-CD1 4.39Å; I357-I365 HydrophobicContact CG2-CG2 3.43Å; I357-I365 VanDerWaalsContact CG2-CG2 3.43Å; I357-R366 CarbonylContact C-O 3.48Å; I357-R366 VanDerWaalsContact CA-O 3.27Å; I357-R366 WeakPolarHBondContact CA-O 3.28Å; I357-V367 HydrophobicContact CG1-CG1 4.4Å; I357-V367 HydrophobicContact CG1-CG2 4.19Å; I357-M389 HydrophobicContact CG2-CE 4.05Å; I357-M389 HydrophobicContact CG2-SD 3.93Å; I357-M389 WeakPolarHBondContact O-CE 3.35Å; I357-L391 HydrophobicContact CD1-CD2 3.82Å; I357-L396 HydrophobicContact CG2-CD1 4.09Å; I357-L396 HydrophobicContact CG2-CD2 3.7Å; I357-V410 HydrophobicContact CG1-CG1 4.45Å
358	S	98.7	Very high	97.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.3	-178	58.2	0	0	0	0	112.4	H340 S346 I365 R366 W368	H340-S358 PolarHBondContact CD2-OG 3.27Å; H340-S358 PolarHBondContact NE2-O 2.75Å; H340-S358 PolarHBondContact NE2-OG 2.75Å; S346-S358 WeakPolarHBondContact O-CA 3.26Å; S358-I365 CarbonylContact O-C 3.55Å; S358-I365 VanDerWaalsContact O-CA 3.22Å; S358-I365 WeakPolarHBondContact O-CA 3.24Å; S358-R366 PolarHBondContact N-O 3.41Å; S358-R366 PolarHBondContact O-N 3.42Å; S358-W368 PolarHBondContact OG-NE1 2.85Å
359	G	98.6	Very high	97.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.1	175.6	0	0	0	0	0	110.7	Y345 S346 M389	Y345-G359 PolarHBondContact N-O 3.37Å; S346-G359 PolarHBondContact N-O 2.77Å; S346-G359 PolarHBondContact O-N 3.18Å; S346-G359 WeakPolarHBondContact OG-CA 3.42Å; G359-M389 VanDerWaalsContact N-CE 3.28Å
360	S	98.7	Very high	97.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	166.4	-170	174	0	0	0	0	112.7	H340 N342 R343 D362 S364 T386	H340-S360 VanDerWaalsContact CE1-CB 3.41Å; H340-S360 WeakPolarHBondContact CE1-CB 3.31Å; H340-S360 WeakPolarHBondContact ND1-CB 3.42Å; N342-S360 PolarHBondContact O-OG 2.89Å; N342-S360 VanDerWaalsContact O-OG 3.1Å; R343-S360 WeakPolarHBondContact O-CA 3.28Å; R343-S360 PolarHBondContact O-OG 3.3Å; S360-D362 WeakPolarHBondContact CB-OD1 3.48Å; S360-D362 PolarHBondContact OG-N 2.77Å; S360-D362 VanDerWaalsContact OG-N 3.12Å; S360-D362 PolarHBondContact OG-OD1 2.91Å; S360-D362 PolarHBondContact OG-OD2 2.88Å; S360-D362 VanDerWaalsContact OG-OD2 3.11Å; S360-S364 PolarHBondContact N-O 2.81Å; S360-T386 PolarHBondContact O-N 3.3Å
361	L	98.4	Very high	97.4	Very high	56 Å²	56	30.8 Å²	30.8	29%	0.293	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-12	168.1	-178.9	59	0	0	0	112.2	N342 R343 Y345 T363 L385	N342-L361 HydrophobicContact CB-CB 4.11Å; R343-L361 HydrophobicContact CB-CB 4.42Å; R343-L361 PolarHBondContact O-N 3.39Å; Y345-L361 HydrophobicContact CD2-CB 4.14Å; Y345-L361 HydrophobicContact CE2-CB 3.95Å; Y345-L361 HydrophobicContact CE2-CD2 4.25Å; L361-T363 PolarHBondContact O-N 2.87Å; L361-L385 HydrophobicContact CD1-CB 3.81Å; L361-L385 HydrophobicContact CD1-CD1 3.99Å; L361-L385 HydrophobicContact CD1-CG 4.33Å
362	D	98.1	Very high	97.4	Very high	32 Å²	32	31.4 Å²	31.4	17%	0.171	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	12.7	173	67.1	21.2	0	0	0	114	H340 N341 N342 S360 S364	H340-D362 WeakPolarHBondContact CA-OD2 3.37Å; H340-D362 WeakPolarHBondContact CB-OD2 3.36Å; H340-D362 IonicContact CE1-OD1 3.16Å; H340-D362 IonicContact CG-OD2 3.33Å; H340-D362 IonicContact ND1-OD1 2.73Å; H340-D362 PolarHBondContact ND1-OD1 3.28Å; H340-D362 IonicContact ND1-OD2 3.95Å; H340-D362 PolarHBondContact ND1-OD2 3.37Å; N341-D362 HydrophobicContact CB-CB 4.37Å; N341-D362 PolarHBondContact N-OD2 2.58Å; N342-D362 HydrophobicContact CB-CB 3.79Å; S360-D362 WeakPolarHBondContact CB-OD1 3.48Å; S360-D362 PolarHBondContact OG-N 2.77Å; S360-D362 VanDerWaalsContact OG-N 3.12Å; S360-D362 PolarHBondContact OG-OD1 2.91Å; S360-D362 PolarHBondContact OG-OD2 2.88Å; S360-D362 VanDerWaalsContact OG-OD2 3.11Å; D362-S364 PolarHBondContact O-N 2.7Å; D362-S364 WeakPolarHBondContact OD1-CA 3.41Å; D362-S364 WeakPolarHBondContact OD1-CB 3.43Å; D362-S364 PolarHBondContact OD1-N 3.19Å; D362-S364 PolarHBondContact OD1-OG 3.19Å
363	T	98.2	Very high	97.4	Very high	46 Å²	46	27.8 Å²	27.8	28%	0.282	15%	0.15	S	C	.	.	S	Bend	trans	65.9	-3.7	-178.8	89.3	0	0	0	0	116.2	L361 H382 S384	L361-T363 PolarHBondContact O-N 2.87Å; T363-H382 VanDerWaalsContact CB-O 3.28Å; T363-H382 WeakPolarHBondContact CB-O 3.35Å; T363-H382 PolarHBondContact OG1-O 3.24Å; T363-S384 WeakPolarHBondContact CA-O 3.08Å
364	S	98.4	Very high	97.5	Very high	10 Å²	10	32.5 Å²	32.5	7%	0.07	17%	0.167	C	C	.	.			trans	-91.1	152.9	175.8	75.6	0	0	0	0	112.5	H340 S360 D362	H340-S364 PolarHBondContact CE1-OG 2.64Å; H340-S364 VanDerWaalsContact CE1-OG 3.29Å; H340-S364 PolarHBondContact ND1-OG 3.33Å; H340-S364 VanDerWaalsContact ND1-OG 3.15Å; S360-S364 PolarHBondContact N-O 2.81Å; D362-S364 PolarHBondContact O-N 2.7Å; D362-S364 WeakPolarHBondContact OD1-CA 3.41Å; D362-S364 WeakPolarHBondContact OD1-CB 3.43Å; D362-S364 PolarHBondContact OD1-N 3.19Å; D362-S364 PolarHBondContact OD1-OG 3.19Å
365	I	98.8	Very high	97.5	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.3	162.9	-61.3	165.5	0	0	0	107.2	I357 S358 T378 L379 T386 M389 L396 S398	I357-I365 HydrophobicContact CG2-CG2 3.43Å; I357-I365 VanDerWaalsContact CG2-CG2 3.43Å; S358-I365 CarbonylContact O-C 3.55Å; S358-I365 VanDerWaalsContact O-CA 3.22Å; S358-I365 WeakPolarHBondContact O-CA 3.24Å; I365-T378 CarbonylContact O-C 3.54Å; I365-L379 HydrophobicContact CB-CB 4.13Å; I365-L379 HydrophobicContact CB-CD1 4.28Å; I365-L379 HydrophobicContact CB-CG 4.48Å; I365-L379 HydrophobicContact CG2-CD1 4Å; I365-L379 PolarHBondContact N-O 2.95Å; I365-L379 PolarHBondContact O-N 3.34Å; I365-T386 HydrophobicContact CD1-CG2 3.92Å; I365-T386 HydrophobicContact CG1-CG2 4.11Å; I365-M389 HydrophobicContact CD1-SD 4.04Å; I365-M389 HydrophobicContact CG1-SD 4.13Å; I365-M389 HydrophobicContact CG2-SD 3.75Å; I365-L396 HydrophobicContact CG2-CD2 4.02Å; I365-S398 WeakPolarHBondContact CD1-OG 3.33Å
366	R	98.7	Very high	97.5	Very high	42 Å²	42	35.3 Å²	35.3	16%	0.158	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.3	-179.9	-70.5	178.1	174.6	-86.9	1.2	111	G339 I357 S358 W368 C375 F377 T378	G339-R366 VanDerWaalsContact C-NE 3.29Å; G339-R366 PolarHBondContact O-NE 3.08Å; G339-R366 PolarHBondContact O-NH2 3.12Å; I357-R366 CarbonylContact C-O 3.48Å; I357-R366 VanDerWaalsContact CA-O 3.27Å; I357-R366 WeakPolarHBondContact CA-O 3.28Å; S358-R366 PolarHBondContact N-O 3.41Å; S358-R366 PolarHBondContact O-N 3.42Å; R366-W368 HydrophobicContact CB-CD2 4.38Å; R366-W368 VanDerWaalsContact CB-CE2 3.48Å; R366-W368 HydrophobicContact CB-CH2 4.49Å; R366-W368 HydrophobicContact CB-CZ2 3.58Å; R366-W368 HydrophobicContact CG-CZ2 4.04Å; R366-W368 PolarHBondContact O-NE1 3.35Å; R366-C375 PolarHBondContact NH1-SG 3.13Å; R366-C375 VanDerWaalsContact NH1-SG 3.36Å; R366-F377 WeakPolarHBondContact CA-O 3.33Å; R366-T378 HydrophobicContact CG-CG2 4.23Å; R366-T378 PolarHBondContact NH1-OG1 2.63Å
367	V	98.4	Very high	97.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	124.7	173.1	-175.5	0	0	0	0	107.7	L355 V356 I357 C375 L376 F377 L379 V410	L355-V367 HydrophobicContact CD2-CG1 4.41Å; V356-V367 CarbonylContact O-C 3.49Å; V356-V367 WeakPolarHBondContact O-CA 3.28Å; I357-V367 HydrophobicContact CG1-CG1 4.4Å; I357-V367 HydrophobicContact CG1-CG2 4.19Å; V367-C375 CarbonylContact O-C 3.55Å; V367-L376 PolarHBondContact O-N 3.41Å; V367-F377 HydrophobicContact CB-CB 4.2Å; V367-F377 HydrophobicContact CB-CD2 4.33Å; V367-F377 HydrophobicContact CG2-CB 4.29Å; V367-F377 PolarHBondContact N-O 2.97Å; V367-F377 PolarHBondContact O-N 2.78Å; V367-L379 HydrophobicContact CG2-CD1 4.14Å; V367-L379 HydrophobicContact CG2-CG 4.34Å; V367-V410 HydrophobicContact CG2-CB 4.38Å; V367-V410 HydrophobicContact CG2-CG1 4.34Å
368	W	98.4	Very high	97.5	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.015	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	143.1	-174.4	-43.2	83.4	0	0	0	110.5	L337 I338 L355 V356 S358 R366 R374 C375	L337-W368 HydrophobicContact CB-CD2 3.97Å; L337-W368 HydrophobicContact CB-CE3 3.78Å; L337-W368 HydrophobicContact CB-CH2 4.17Å; L337-W368 HydrophobicContact CB-CZ2 4.32Å; L337-W368 HydrophobicContact CB-CZ3 3.9Å; L337-W368 HydrophobicContact CD1-CB 3.8Å; L337-W368 HydrophobicContact CD1-CD2 3.96Å; L337-W368 HydrophobicContact CD1-CE3 4.37Å; L337-W368 HydrophobicContact CD1-CG 3.72Å; L337-W368 HydrophobicContact CD2-CE3 4.33Å; L337-W368 HydrophobicContact CG-CD2 4.43Å; L337-W368 HydrophobicContact CG-CE3 4.38Å; I338-W368 WeakPolarHBondContact O-CH2 3.28Å; L355-W368 CarbonylContact C-O 3.48Å; L355-W368 VanDerWaalsContact CA-O 3.3Å; L355-W368 WeakPolarHBondContact CA-O 3.44Å; V356-W368 HydrophobicContact CB-CB 4.26Å; V356-W368 PolarHBondContact N-O 2.63Å; V356-W368 VanDerWaalsContact O-CD1 3.31Å; V356-W368 PolarHBondContact O-N 2.91Å; S358-W368 PolarHBondContact OG-NE1 2.85Å; R366-W368 HydrophobicContact CB-CD2 4.38Å; R366-W368 VanDerWaalsContact CB-CE2 3.48Å; R366-W368 HydrophobicContact CB-CH2 4.49Å; R366-W368 HydrophobicContact CB-CZ2 3.58Å; R366-W368 HydrophobicContact CG-CZ2 4.04Å; R366-W368 PolarHBondContact O-NE1 3.35Å; W368-R374 VanDerWaalsContact CA-O 3.32Å; W368-R374 WeakPolarHBondContact CA-O 3.47Å; W368-C375 HydrophobicContact CD2-CB 4.35Å; W368-C375 HydrophobicContact CE3-CB 3.61Å; W368-C375 HydrophobicContact CH2-CB 4.41Å; W368-C375 HydrophobicContact CZ3-CB 3.64Å
369	E	97.1	Very high	97.5	Very high	63 Å²	63	41.6 Å²	41.6	29%	0.294	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.1	168.5	-174.4	-177	-125.2	0	0	109.6	V371 T372 G373 R374 L376	E369-V371 HydrophobicContact CG-CB 4.29Å; E369-T372 WeakPolarHBondContact OE2-CB 3.2Å; E369-T372 WeakPolarHBondContact OE2-CG2 3.13Å; E369-T372 PolarHBondContact OE2-OG1 3.43Å; E369-G373 WeakPolarHBondContact O-CA 3.38Å; E369-G373 PolarHBondContact O-N 3.26Å; E369-R374 PolarHBondContact N-O 3.42Å; E369-L376 HydrophobicContact CB-CD1 4.1Å; E369-L376 HydrophobicContact CB-CD2 4.12Å; E369-L376 HydrophobicContact CB-CG 4.07Å
370	I	94.7	Very high	97.4	Very high	6 Å²	6	46.6 Å²	46.6	3%	0.031	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-36	-178.8	-67.9	174.5	0	0	0	111.5	V325 H335 F349 D354 V356 T372	V325-I370 HydrophobicContact CG1-CG2 3.99Å; V325-I370 HydrophobicContact CG2-CG1 4.45Å; H335-I370 PolarHBondContact CD2-O 2.8Å; H335-I370 PolarHBondContact NE2-O 3.47Å; F349-I370 HydrophobicContact CD2-CD1 3.81Å; F349-I370 HydrophobicContact CE2-CD1 3.17Å; F349-I370 HydrophobicContact CZ-CD1 3.87Å; D354-I370 HydrophobicContact CB-CB 4.16Å; D354-I370 WeakPolarHBondContact O-CB 3.36Å; D354-I370 WeakPolarHBondContact O-CG1 3.42Å; D354-I370 PolarHBondContact O-N 2.8Å; V356-I370 HydrophobicContact CG2-CD1 3.7Å; V356-I370 HydrophobicContact CG2-CG1 3.62Å; I370-T372 PolarHBondContact O-N 3.24Å
371	V	94.4	Very high	97.2	Very high	95 Å²	95	48.3 Å²	48.3	58%	0.576	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-50.6	-176	-179	0	0	0	0	110.4	H335 D354 E369	H335-V371 PolarHBondContact NE2-O 2.88Å; D354-V371 HydrophobicContact CB-CG2 4.06Å; D354-V371 WeakPolarHBondContact OD2-CG2 3.38Å; E369-V371 HydrophobicContact CG-CB 4.29Å
372	T	95.1	Very high	97.2	Very high	68 Å²	68	46 Å²	46	42%	0.417	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-18.3	-176.5	64.8	0	0	0	0	114	E369 I370 R374	E369-T372 WeakPolarHBondContact OE2-CB 3.2Å; E369-T372 WeakPolarHBondContact OE2-CG2 3.13Å; E369-T372 PolarHBondContact OE2-OG1 3.43Å; I370-T372 PolarHBondContact O-N 3.24Å; T372-R374 PolarHBondContact O-N 2.73Å; T372-R374 WeakPolarHBondContact OG1-CB 3.48Å; T372-R374 WeakPolarHBondContact OG1-CG 3.48Å; T372-R374 PolarHBondContact OG1-N 3.1Å
373	G	95.1	Very high	97.2	Very high	19 Å²	19	52.3 Å²	52.3	20%	0.196	28%	0.282	C	S	.	.			trans	74.3	9.6	-171.4	0	0	0	0	0	113.8	L337 E369	L337-G373 WeakPolarHBondContact CD2-O 3.41Å; E369-G373 WeakPolarHBondContact O-CA 3.38Å; E369-G373 PolarHBondContact O-N 3.26Å
374	R	97	Very high	97.1	Very high	177 Å²	177	52.2 Å²	52.2	67%	0.668	28%	0.283	S	S	*	.			trans	-82.1	144.1	-177.2	-64.4	178.2	76.3	167.7	3.9	111.4	W368 E369 T372 L376	W368-R374 VanDerWaalsContact CA-O 3.32Å; W368-R374 WeakPolarHBondContact CA-O 3.47Å; E369-R374 PolarHBondContact N-O 3.42Å; T372-R374 PolarHBondContact O-N 2.73Å; T372-R374 WeakPolarHBondContact OG1-CB 3.48Å; T372-R374 WeakPolarHBondContact OG1-CG 3.48Å; T372-R374 PolarHBondContact OG1-N 3.1Å; R374-L376 PolarHBondContact O-N 3Å
375	C	97.7	Very high	97.1	Very high	45 Å²	45	53.2 Å²	53.2	30%	0.304	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	116.1	165.2	-166.9	0	0	0	0	108.4	R366 V367 W368 F377	R366-C375 PolarHBondContact NH1-SG 3.13Å; R366-C375 VanDerWaalsContact NH1-SG 3.36Å; V367-C375 CarbonylContact O-C 3.55Å; W368-C375 HydrophobicContact CD2-CB 4.35Å; W368-C375 HydrophobicContact CE3-CB 3.61Å; W368-C375 HydrophobicContact CH2-CB 4.41Å; W368-C375 HydrophobicContact CZ3-CB 3.64Å; C375-F377 PolarHBondContact SG-O 3.22Å
376	L	97.4	Very high	97.1	Very high	77 Å²	77	53.1 Å²	53.1	40%	0.403	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-48.1	175.1	-61.6	-179.9	0	0	0	110.8	L355 V367 E369 R374	L355-L376 HydrophobicContact CD2-CD1 3.61Å; V367-L376 PolarHBondContact O-N 3.41Å; E369-L376 HydrophobicContact CB-CD1 4.1Å; E369-L376 HydrophobicContact CB-CD2 4.12Å; E369-L376 HydrophobicContact CB-CG 4.07Å; R374-L376 PolarHBondContact O-N 3Å
377	F	97.6	Very high	96.9	Very high	65 Å²	65	52.9 Å²	52.9	29%	0.285	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	145.1	-177.8	-58.8	-70.8	0	0	0	111.7	R366 V367 C375 L379 V410 T411 T412	R366-F377 WeakPolarHBondContact CA-O 3.33Å; V367-F377 HydrophobicContact CB-CB 4.2Å; V367-F377 HydrophobicContact CB-CD2 4.33Å; V367-F377 HydrophobicContact CG2-CB 4.29Å; V367-F377 PolarHBondContact N-O 2.97Å; V367-F377 PolarHBondContact O-N 2.78Å; C375-F377 PolarHBondContact SG-O 3.22Å; F377-L379 HydrophobicContact CB-CD2 3.88Å; F377-V410 WeakPolarHBondContact CD2-O 3.45Å; F377-V410 WeakPolarHBondContact CE2-O 3.47Å; F377-T411 WeakPolarHBondContact CE2-O 3.27Å; F377-T411 WeakPolarHBondContact CZ-O 3.42Å; F377-T412 WeakPolarHBondContact CE1-O 3.33Å
378	T	98.2	Very high	96.7	Very high	63 Å²	63	53.7 Å²	53.7	39%	0.387	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	103.7	164.2	-55.1	0	0	0	0	107.2	I365 R366 V380	I365-T378 CarbonylContact O-C 3.54Å; R366-T378 HydrophobicContact CG-CG2 4.23Å; R366-T378 PolarHBondContact NH1-OG1 2.63Å; T378-V380 HydrophobicContact CG2-CG2 3.98Å; T378-V380 PolarHBondContact O-N 3.41Å
379	L	98.1	Very high	96.7	Very high	5 Å²	5	53.8 Å²	53.8	3%	0.026	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	116.7	179.6	-43	179.6	0	0	0	108.2	I365 V367 F377 L396 W408	I365-L379 HydrophobicContact CB-CB 4.13Å; I365-L379 HydrophobicContact CB-CD1 4.28Å; I365-L379 HydrophobicContact CB-CG 4.48Å; I365-L379 HydrophobicContact CG2-CD1 4Å; I365-L379 PolarHBondContact N-O 2.95Å; I365-L379 PolarHBondContact O-N 3.34Å; V367-L379 HydrophobicContact CG2-CD1 4.14Å; V367-L379 HydrophobicContact CG2-CG 4.34Å; F377-L379 HydrophobicContact CB-CD2 3.88Å; L379-L396 HydrophobicContact CD1-CD2 3.94Å; L379-W408 HydrophobicContact CB-CD2 4.23Å; L379-W408 HydrophobicContact CB-CE3 3.85Å; L379-W408 HydrophobicContact CB-CH2 4.09Å; L379-W408 HydrophobicContact CB-CZ2 4.44Å; L379-W408 HydrophobicContact CB-CZ3 3.78Å; L379-W408 HydrophobicContact CD1-CB 4.09Å; L379-W408 HydrophobicContact CD1-CD2 3.96Å; L379-W408 HydrophobicContact CD1-CE3 4.18Å; L379-W408 HydrophobicContact CD1-CG 3.94Å; L379-W408 HydrophobicContact CD2-CE3 4.38Å; L379-W408 HydrophobicContact CG-CE3 4.36Å
380	V	97.1	Very high	96.8	Very high	105 Å²	105	53 Å²	53	64%	0.636	30%	0.298	S	S	*	.			trans	-118.7	141.5	-176.4	-178.2	0	0	0	0	109.1	T378	T378-V380 HydrophobicContact CG2-CG2 3.98Å; T378-V380 PolarHBondContact O-N 3.41Å
381	G	95.3	Very high	96.9	Very high	35 Å²	35	54.1 Å²	54.1	36%	0.361	30%	0.303	S	S	.	.			trans	152.5	-18.2	174.8	0	0	0	0	0	114.1	K406	G381-K406 VanDerWaalsContact C-CE 3.43Å; G381-K406 WeakPolarHBondContact O-CE 3.35Å
382	H	97.7	Very high	96.9	Very high	7 Å²	7	54.9 Å²	54.9	3%	0.032	30%	0.296	C	S	.	.			trans	-75.3	155.5	166.6	-80.9	-53.7	0	0	0	111.1	T363 S398 N400 D402 T404	T363-H382 VanDerWaalsContact CB-O 3.28Å; T363-H382 WeakPolarHBondContact CB-O 3.35Å; T363-H382 PolarHBondContact OG1-O 3.24Å; H382-S398 PolarHBondContact NE2-OG 3.15Å; H382-N400 HydrophobicContact CB-CB 4.44Å; H382-N400 VanDerWaalsContact CB-ND2 3.28Å; H382-N400 WeakPolarHBondContact CB-ND2 3.38Å; H382-N400 WeakPolarHBondContact CE1-CB 3.42Å; H382-N400 VanDerWaalsContact CG-ND2 3.3Å; H382-N400 WeakPolarHBondContact ND1-CB 3.09Å; H382-D402 VanDerWaalsContact CA-OD2 3.31Å; H382-D402 WeakPolarHBondContact CA-OD2 3.36Å; H382-D402 IonicContact CG-OD2 3.95Å; H382-D402 IonicContact ND1-OD1 2.81Å; H382-D402 IonicContact ND1-OD2 3.66Å; H382-D402 PolarHBondContact ND1-OD2 2.82Å; H382-D402 VanDerWaalsContact ND1-OD2 3.13Å; H382-T404 PolarHBondContact CE1-OG1 2.86Å; H382-T404 VanDerWaalsContact CE1-OG1 3.25Å; H382-T404 PolarHBondContact ND1-OG1 3.45Å; H382-T404 VanDerWaalsContact ND1-OG1 3.08Å
383	Q	97.3	Very high	96.8	Very high	166 Å²	166	54.1 Å²	54.1	78%	0.776	30%	0.301	S	S	*	.			trans	-114.5	-3.4	-175.6	-61.6	-176.3	-21	0	0	113.4	D402	Q383-D402 HydrophobicContact CB-CB 3.95Å; Q383-D402 PolarHBondContact N-OD2 2.95Å
384	S	97.8	Very high	96.7	Very high	44 Å²	44	56.4 Å²	56.4	31%	0.308	31%	0.309	S	S	.	.	S	Bend	trans	-148.2	-161.5	178.5	-164.2	0	0	0	0	111.4	T363 N400 A401	T363-S384 WeakPolarHBondContact CA-O 3.08Å; S384-N400 WeakPolarHBondContact CA-OD1 3.36Å; S384-N400 WeakPolarHBondContact CB-OD1 3.21Å; S384-N400 PolarHBondContact N-OD1 2.84Å; S384-N400 PolarHBondContact O-ND2 3.36Å; S384-N400 PolarHBondContact O-OD1 2.89Å; S384-A401 WeakPolarHBondContact OG-CB 3.25Å
385	L	97.6	Very high	96.8	Very high	30 Å²	30	50.1 Å²	50.1	16%	0.157	29%	0.288	C	S	.	.			trans	-63.9	128.8	-178.3	-178.4	153.1	0	0	0	112.2	Y345 L361 S387 N400 A401	Y345-L385 HydrophobicContact CD1-CD1 3.82Å; Y345-L385 HydrophobicContact CD2-CD1 3.51Å; Y345-L385 HydrophobicContact CD2-CG 4.08Å; Y345-L385 HydrophobicContact CE1-CD1 3.79Å; Y345-L385 HydrophobicContact CE2-CD1 3.46Å; Y345-L385 VanDerWaalsContact CE2-CD1 3.46Å; Y345-L385 HydrophobicContact CE2-CG 4.46Å; Y345-L385 HydrophobicContact CG-CD1 3.68Å; Y345-L385 HydrophobicContact CG-CD2 4.35Å; Y345-L385 HydrophobicContact CG-CG 4.12Å; L361-L385 HydrophobicContact CD1-CB 3.81Å; L361-L385 HydrophobicContact CD1-CD1 3.99Å; L361-L385 HydrophobicContact CD1-CG 4.33Å; L385-S387 VanDerWaalsContact CD2-CA 3.47Å; L385-S387 PolarHBondContact O-N 3.29Å; L385-N400 WeakPolarHBondContact O-CA 3.27Å; L385-N400 PolarHBondContact O-ND2 2.66Å; L385-N400 VanDerWaalsContact O-ND2 3.1Å; L385-N400 PolarHBondContact O-OD1 3.47Å; L385-A401 HydrophobicContact CB-CB 4.23Å; L385-A401 PolarHBondContact O-N 2.99Å
386	T	97.9	Very high	96.8	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	101.8	170.1	-59.9	0	0	0	0	110.4	S346 S360 I365 M389 N400	S346-T386 PolarHBondContact OG-O 2.75Å; S360-T386 PolarHBondContact O-N 3.3Å; I365-T386 HydrophobicContact CD1-CG2 3.92Å; I365-T386 HydrophobicContact CG1-CG2 4.11Å; T386-M389 HydrophobicContact CG2-CG 3.68Å; T386-M389 HydrophobicContact CG2-SD 4.06Å; T386-N400 WeakPolarHBondContact CA-ND2 3.31Å; T386-N400 PolarHBondContact N-ND2 3.29Å; T386-N400 PolarHBondContact OG1-ND2 3.19Å; T386-N400 VanDerWaalsContact OG1-ND2 3.17Å
387	S	94.4	Very high	96.8	Very high	36 Å²	36	44.3 Å²	44.3	25%	0.252	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-37.7	-167.9	60.9	0	0	0	0	112.6	L385 G399 V429	L385-S387 VanDerWaalsContact CD2-CA 3.47Å; L385-S387 PolarHBondContact O-N 3.29Å; S387-G399 PolarHBondContact N-O 2.81Å; S387-G399 PolarHBondContact OG-O 3.14Å; S387-V429 PolarHBondContact OG-O 2.9Å
388	G	95.3	Very high	96.9	Very high	18 Å²	18	41.2 Å²	41.2	19%	0.186	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	150.7	-178.1	0	0	0	0	0	111.5	G399 L432	G388-G399 PolarHBondContact O-N 3.25Å; G388-L432 WeakPolarHBondContact O-CD2 3.3Å
389	M	98.3	Very high	96.9	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.03	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.5	177.2	-64.3	-173.8	-64.3	0	0	109.6	S346 Q348 I357 G359 I365 T386 L396 V397	S346-M389 WeakPolarHBondContact O-CE 3.35Å; Q348-M389 HydrophobicContact CG-CB 3.92Å; Q348-M389 PolarHBondContact NE2-O 3.35Å; I357-M389 HydrophobicContact CG2-CE 4.05Å; I357-M389 HydrophobicContact CG2-SD 3.93Å; I357-M389 WeakPolarHBondContact O-CE 3.35Å; G359-M389 VanDerWaalsContact N-CE 3.28Å; I365-M389 HydrophobicContact CD1-SD 4.04Å; I365-M389 HydrophobicContact CG1-SD 4.13Å; I365-M389 HydrophobicContact CG2-SD 3.75Å; T386-M389 HydrophobicContact CG2-CG 3.68Å; T386-M389 HydrophobicContact CG2-SD 4.06Å; M389-L396 HydrophobicContact CB-CD1 4.11Å; M389-L396 HydrophobicContact SD-CD1 4.41Å; M389-L396 HydrophobicContact SD-CD2 4.36Å; M389-V397 CarbonylContact C-O 3.43Å; M389-V397 VanDerWaalsContact CA-O 3.25Å; M389-V397 WeakPolarHBondContact CA-O 3.16Å
390	Q	97.9	Very high	96.9	Very high	47 Å²	47	38 Å²	38	22%	0.22	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	133	171.7	-66.3	-68.5	-70.1	0	0	109.4	V397 L432 F434	Q390-V397 PolarHBondContact N-O 2.86Å; Q390-V397 PolarHBondContact O-N 3.23Å; Q390-L432 HydrophobicContact CB-CD1 3.73Å; Q390-L432 HydrophobicContact CG-CD1 3.36Å; Q390-L432 HydrophobicContact CG-CG 4.3Å; Q390-F434 HydrophobicContact CB-CB 3.74Å; Q390-F434 HydrophobicContact CG-CB 4.48Å
391	L	97.1	Very high	96.9	Very high	28 Å²	28	34.8 Å²	34.8	15%	0.147	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.2	178.8	-178	74.5	0	0	0	110.1	Q348 D350 I357 L396 V410	Q348-L391 HydrophobicContact CB-CB 4.3Å; Q348-L391 HydrophobicContact CG-CB 4.29Å; D350-L391 HydrophobicContact CB-CD2 3.84Å; I357-L391 HydrophobicContact CD1-CD2 3.82Å; L391-L396 HydrophobicContact CB-CD1 4.24Å; L391-L396 HydrophobicContact CD1-CB 4.07Å; L391-L396 HydrophobicContact CD1-CD1 4.26Å; L391-V410 HydrophobicContact CD1-CG1 3.97Å; L391-V410 HydrophobicContact CD1-CG2 4.06Å
392	R	94.6	Very high	97	Very high	112 Å²	112	34.3 Å²	34.3	42%	0.423	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	124	164.2	-64.1	-173.2	178.4	-90.2	-3	110.5	N394 I395 F434	R392-N394 PolarHBondContact O-N 3.29Å; R392-I395 PolarHBondContact N-O 3.32Å; R392-I395 PolarHBondContact O-N 3.36Å; R392-F434 HydrophobicContact CB-CD1 3.75Å; R392-F434 HydrophobicContact CB-CE1 3.6Å; R392-F434 HydrophobicContact CG-CD1 3.69Å; R392-F434 HydrophobicContact CG-CE1 4.06Å; R392-F434 HydrophobicContact CG-CG 4.41Å; R392-F434 PolarHBondContact NE-O 2.59Å; R392-F434 PolarHBondContact NH2-O 3.25Å; R392-F434 VanDerWaalsContact NH2-O 3.12Å
393	G	92.6	Very high	97	Very high	51 Å²	51	35 Å²	35	53%	0.526	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	-137	-170.4	0	0	0	0	0	109.7	R353 I395	R353-G393 PolarHBondContact NH1-O 2.96Å; R353-G393 PolarHBondContact NH2-O 3.45Å; G393-I395 PolarHBondContact O-N 2.97Å
394	N	94.6	Very high	97	Very high	68 Å²	68	28.2 Å²	28.2	36%	0.364	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-8	179	-59.6	-6.9	0	0	0	113.8	R353 R392 D409 V410 T411	R353-N394 PolarHBondContact NH1-OD1 2.78Å; R392-N394 PolarHBondContact O-N 3.29Å; N394-D409 WeakPolarHBondContact O-CA 3.25Å; N394-V410 WeakPolarHBondContact O-CG2 3.32Å; N394-V410 PolarHBondContact O-N 3.32Å; N394-T411 HydrophobicContact CB-CG2 4Å; N394-T411 VanDerWaalsContact CG-CG2 3.43Å
395	I	97.4	Very high	97	Very high	44 Å²	44	26.2 Å²	26.2	23%	0.226	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.4	-170.9	-55	-55.1	0	0	0	110.6	R392 G393 V397 V407 W408 L416 F434	R392-I395 PolarHBondContact N-O 3.32Å; R392-I395 PolarHBondContact O-N 3.36Å; G393-I395 PolarHBondContact O-N 2.97Å; I395-V397 HydrophobicContact CG2-CG2 4.43Å; I395-V407 HydrophobicContact CG2-CG1 3.49Å; I395-V407 VanDerWaalsContact CG2-CG1 3.49Å; I395-W408 WeakPolarHBondContact CA-O 3.37Å; I395-L416 HydrophobicContact CD1-CD1 3.47Å; I395-L416 VanDerWaalsContact CD1-CD1 3.47Å; I395-F434 HydrophobicContact CB-CE1 3.88Å; I395-F434 HydrophobicContact CB-CZ 4.19Å; I395-F434 HydrophobicContact CG2-CE1 3.78Å; I395-F434 HydrophobicContact CG2-CZ 3.9Å
396	L	98.2	Very high	97	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	134.2	170.4	179.1	78.1	0	0	0	109.5	Q348 I357 I365 L379 M389 L391 V407 W408 V410	Q348-L396 HydrophobicContact CG-CD1 4.4Å; I357-L396 HydrophobicContact CG2-CD1 4.09Å; I357-L396 HydrophobicContact CG2-CD2 3.7Å; I365-L396 HydrophobicContact CG2-CD2 4.02Å; L379-L396 HydrophobicContact CD1-CD2 3.94Å; M389-L396 HydrophobicContact CB-CD1 4.11Å; M389-L396 HydrophobicContact SD-CD1 4.41Å; M389-L396 HydrophobicContact SD-CD2 4.36Å; L391-L396 HydrophobicContact CB-CD1 4.24Å; L391-L396 HydrophobicContact CD1-CB 4.07Å; L391-L396 HydrophobicContact CD1-CD1 4.26Å; L396-V407 CarbonylContact O-C 3.57Å; L396-V407 WeakPolarHBondContact O-CA 3.4Å; L396-W408 HydrophobicContact CB-CB 4.32Å; L396-W408 HydrophobicContact CD2-CG 4.47Å; L396-W408 PolarHBondContact N-O 2.91Å; L396-W408 PolarHBondContact O-N 2.87Å; L396-V410 HydrophobicContact CB-CG1 3.56Å; L396-V410 HydrophobicContact CD2-CG1 4.25Å; L396-V410 HydrophobicContact CG-CG1 4.43Å
397	V	98.4	Very high	97.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.4	170.9	-175.7	0	0	0	0	108.7	M389 Q390 I395 I405 K406 V407 L432 F434 I440	M389-V397 CarbonylContact C-O 3.43Å; M389-V397 VanDerWaalsContact CA-O 3.25Å; M389-V397 WeakPolarHBondContact CA-O 3.16Å; Q390-V397 PolarHBondContact N-O 2.86Å; Q390-V397 PolarHBondContact O-N 3.23Å; I395-V397 HydrophobicContact CG2-CG2 4.43Å; V397-I405 HydrophobicContact CG1-CG2 3.55Å; V397-K406 WeakPolarHBondContact CA-O 3.43Å; V397-V407 HydrophobicContact CG2-CG2 4.42Å; V397-L432 HydrophobicContact CB-CD1 4.11Å; V397-L432 HydrophobicContact CG1-CD1 3.89Å; V397-L432 HydrophobicContact CG1-CD2 4.45Å; V397-F434 HydrophobicContact CG2-CB 4.25Å; V397-F434 HydrophobicContact CG2-CD1 3.98Å; V397-F434 HydrophobicContact CG2-CD2 4.23Å; V397-F434 HydrophobicContact CG2-CE1 4.36Å; V397-F434 HydrophobicContact CG2-CG 3.92Å; V397-I440 HydrophobicContact CB-CD1 4.39Å; V397-I440 HydrophobicContact CG1-CD1 3.8Å; V397-I440 HydrophobicContact CG1-CG1 4.19Å; V397-I440 HydrophobicContact CG1-CG2 3.89Å; V397-I440 HydrophobicContact CG2-CD1 3.64Å; V397-I440 HydrophobicContact CG2-CG1 3.98Å
398	S	98.6	Very high	97.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.6	-179.4	59.6	0	0	0	0	111.8	I365 H382 I405 K406 W408	I365-S398 WeakPolarHBondContact CD1-OG 3.33Å; H382-S398 PolarHBondContact NE2-OG 3.15Å; S398-I405 CarbonylContact O-C 3.59Å; S398-I405 WeakPolarHBondContact O-CA 3.48Å; S398-I405 WeakPolarHBondContact O-CG2 3.47Å; S398-K406 PolarHBondContact N-O 3.31Å; S398-K406 PolarHBondContact O-N 2.99Å; S398-W408 PolarHBondContact OG-NE1 2.98Å
399	G	98.1	Very high	97.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.5	174.6	0	0	0	0	0	110	S387 G388	S387-G399 PolarHBondContact N-O 2.81Å; S387-G399 PolarHBondContact OG-O 3.14Å; G388-G399 PolarHBondContact O-N 3.25Å
400	N	98.4	Very high	97.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	155.8	-168.8	-165.7	-76.4	0	0	0	113	H382 S384 L385 T386 D402 S403 T404 V429	H382-N400 HydrophobicContact CB-CB 4.44Å; H382-N400 VanDerWaalsContact CB-ND2 3.28Å; H382-N400 WeakPolarHBondContact CB-ND2 3.38Å; H382-N400 WeakPolarHBondContact CE1-CB 3.42Å; H382-N400 VanDerWaalsContact CG-ND2 3.3Å; H382-N400 WeakPolarHBondContact ND1-CB 3.09Å; S384-N400 WeakPolarHBondContact CA-OD1 3.36Å; S384-N400 WeakPolarHBondContact CB-OD1 3.21Å; S384-N400 PolarHBondContact N-OD1 2.84Å; S384-N400 PolarHBondContact O-ND2 3.36Å; S384-N400 PolarHBondContact O-OD1 2.89Å; L385-N400 WeakPolarHBondContact O-CA 3.27Å; L385-N400 PolarHBondContact O-ND2 2.66Å; L385-N400 VanDerWaalsContact O-ND2 3.1Å; L385-N400 PolarHBondContact O-OD1 3.47Å; T386-N400 WeakPolarHBondContact CA-ND2 3.31Å; T386-N400 PolarHBondContact N-ND2 3.29Å; T386-N400 PolarHBondContact OG1-ND2 3.19Å; T386-N400 VanDerWaalsContact OG1-ND2 3.17Å; N400-D402 WeakPolarHBondContact CB-OD1 3.22Å; N400-D402 PolarHBondContact O-N 2.59Å; N400-D402 WeakPolarHBondContact OD1-CB 3.41Å; N400-D402 PolarHBondContact OD1-N 2.84Å; N400-D402 PolarHBondContact OD1-OD1 3.24Å; N400-D402 PolarHBondContact OD1-OD2 2.92Å; N400-S403 PolarHBondContact O-N 3.08Å; N400-T404 PolarHBondContact N-O 3.31Å; N400-T404 VanDerWaalsContact N-O 3.15Å; N400-V429 PolarHBondContact O-N 2.88Å
401	A	97.8	Very high	97.1	Very high	38 Å²	38	25.6 Å²	25.6	31%	0.314	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.4	174.9	0	0	0	0	0	113.4	S384 L385 S403 A428	S384-A401 WeakPolarHBondContact OG-CB 3.25Å; L385-A401 HydrophobicContact CB-CB 4.23Å; L385-A401 PolarHBondContact O-N 2.99Å; A401-S403 PolarHBondContact O-N 2.82Å; A401-A428 HydrophobicContact CB-CB 4.14Å
402	D	97	Very high	97.1	Very high	25 Å²	25	27.8 Å²	27.8	13%	0.134	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	9.7	171.7	69.7	15.8	0	0	0	114.2	H382 Q383 N400 T404	H382-D402 VanDerWaalsContact CA-OD2 3.31Å; H382-D402 WeakPolarHBondContact CA-OD2 3.36Å; H382-D402 IonicContact CG-OD2 3.95Å; H382-D402 IonicContact ND1-OD1 2.81Å; H382-D402 IonicContact ND1-OD2 3.66Å; H382-D402 PolarHBondContact ND1-OD2 2.82Å; H382-D402 VanDerWaalsContact ND1-OD2 3.13Å; Q383-D402 HydrophobicContact CB-CB 3.95Å; Q383-D402 PolarHBondContact N-OD2 2.95Å; N400-D402 WeakPolarHBondContact CB-OD1 3.22Å; N400-D402 PolarHBondContact O-N 2.59Å; N400-D402 WeakPolarHBondContact OD1-CB 3.41Å; N400-D402 PolarHBondContact OD1-N 2.84Å; N400-D402 PolarHBondContact OD1-OD1 3.24Å; N400-D402 PolarHBondContact OD1-OD2 2.92Å; D402-T404 VanDerWaalsContact CG-OG1 3.28Å; D402-T404 PolarHBondContact O-N 2.72Å; D402-T404 WeakPolarHBondContact OD1-CA 3.47Å; D402-T404 VanDerWaalsContact OD1-CB 3.25Å; D402-T404 WeakPolarHBondContact OD1-CB 3.46Å; D402-T404 WeakPolarHBondContact OD1-CG2 3.43Å; D402-T404 PolarHBondContact OD1-N 3.36Å; D402-T404 PolarHBondContact OD1-OG1 2.89Å; D402-T404 PolarHBondContact OD2-OG1 2.98Å
403	S	96.9	Very high	97.2	Very high	22 Å²	22	23.5 Å²	23.5	15%	0.154	15%	0.154	C	C	.	.	S	Bend	trans	70.2	0.9	-176.3	75.7	0	0	0	0	116.4	N400 A401 H425 S427	N400-S403 PolarHBondContact O-N 3.08Å; A401-S403 PolarHBondContact O-N 2.82Å; S403-H425 WeakPolarHBondContact CB-O 3.42Å; S403-H425 PolarHBondContact OG-O 3.45Å; S403-S427 WeakPolarHBondContact CA-O 3.45Å; S403-S427 WeakPolarHBondContact CB-O 3.44Å
404	T	97.5	Very high	97.4	Very high	24 Å²	24	26.7 Å²	26.7	15%	0.147	16%	0.156	C	C	.	.			trans	-97.8	155.5	179.4	75	0	0	0	0	112.8	H382 N400 D402	H382-T404 PolarHBondContact CE1-OG1 2.86Å; H382-T404 VanDerWaalsContact CE1-OG1 3.25Å; H382-T404 PolarHBondContact ND1-OG1 3.45Å; H382-T404 VanDerWaalsContact ND1-OG1 3.08Å; N400-T404 PolarHBondContact N-O 3.31Å; N400-T404 VanDerWaalsContact N-O 3.15Å; D402-T404 VanDerWaalsContact CG-OG1 3.28Å; D402-T404 PolarHBondContact O-N 2.72Å; D402-T404 WeakPolarHBondContact OD1-CA 3.47Å; D402-T404 VanDerWaalsContact OD1-CB 3.25Å; D402-T404 WeakPolarHBondContact OD1-CB 3.46Å; D402-T404 WeakPolarHBondContact OD1-CG2 3.43Å; D402-T404 PolarHBondContact OD1-N 3.36Å; D402-T404 PolarHBondContact OD1-OG1 2.89Å; D402-T404 PolarHBondContact OD2-OG1 2.98Å
405	I	98.4	Very high	97.5	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	137.4	167.6	-55.4	157.4	0	0	0	107.1	V397 S398 T418 L419 V429 S442	V397-I405 HydrophobicContact CG1-CG2 3.55Å; S398-I405 CarbonylContact O-C 3.59Å; S398-I405 WeakPolarHBondContact O-CA 3.48Å; S398-I405 WeakPolarHBondContact O-CG2 3.47Å; I405-T418 CarbonylContact O-C 3.58Å; I405-L419 HydrophobicContact CB-CB 4.09Å; I405-L419 HydrophobicContact CB-CD1 4.05Å; I405-L419 HydrophobicContact CB-CG 4.26Å; I405-L419 HydrophobicContact CG2-CD1 3.73Å; I405-L419 HydrophobicContact CG2-CG 4.29Å; I405-L419 PolarHBondContact O-N 2.81Å; I405-V429 HydrophobicContact CD1-CG2 4.41Å; I405-V429 HydrophobicContact CG1-CG1 4.3Å; I405-V429 HydrophobicContact CG1-CG2 3.87Å; I405-S442 VanDerWaalsContact CD1-OG 3.26Å; I405-S442 WeakPolarHBondContact CD1-OG 3.37Å
406	K	98.5	Very high	97.5	Very high	20 Å²	20	26.4 Å²	26.4	9%	0.087	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144.8	177.6	-70.4	176	-178.1	-80.5	0	111	G381 V397 S398 W408 H417 T418	G381-K406 VanDerWaalsContact C-CE 3.43Å; G381-K406 WeakPolarHBondContact O-CE 3.35Å; V397-K406 WeakPolarHBondContact CA-O 3.43Å; S398-K406 PolarHBondContact N-O 3.31Å; S398-K406 PolarHBondContact O-N 2.99Å; K406-W408 HydrophobicContact CB-CD2 4.4Å; K406-W408 VanDerWaalsContact CB-CE2 3.47Å; K406-W408 HydrophobicContact CB-CH2 4.48Å; K406-W408 HydrophobicContact CB-CZ2 3.53Å; K406-W408 HydrophobicContact CD-CH2 3.68Å; K406-W408 HydrophobicContact CD-CZ2 3.3Å; K406-W408 HydrophobicContact CG-CZ2 4.04Å; K406-H417 WeakPolarHBondContact CA-O 3.39Å; K406-T418 HydrophobicContact CG-CG2 4.18Å; K406-T418 PolarHBondContact NZ-OG1 3.09Å
407	V	98.4	Very high	97.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.5	176.9	-173.4	0	0	0	0	107.2	I395 L396 V397 C415 L416 H417 L419 I440	I395-V407 HydrophobicContact CG2-CG1 3.49Å; I395-V407 VanDerWaalsContact CG2-CG1 3.49Å; L396-V407 CarbonylContact O-C 3.57Å; L396-V407 WeakPolarHBondContact O-CA 3.4Å; V397-V407 HydrophobicContact CG2-CG2 4.42Å; V407-C415 CarbonylContact O-C 3.53Å; V407-L416 HydrophobicContact CG1-CB 4.47Å; V407-L416 HydrophobicContact CG1-CD1 4.39Å; V407-L416 PolarHBondContact O-N 2.9Å; V407-H417 HydrophobicContact CB-CB 4.06Å; V407-H417 HydrophobicContact CG2-CB 4.16Å; V407-H417 PolarHBondContact N-O 3.19Å; V407-H417 PolarHBondContact O-N 2.86Å; V407-L419 HydrophobicContact CG2-CD1 4.13Å; V407-L419 HydrophobicContact CG2-CD2 4.06Å; V407-L419 HydrophobicContact CG2-CG 4.13Å; V407-I440 HydrophobicContact CG2-CD1 3.76Å
408	W	98.4	Very high	97.5	Very high	5 Å²	5	31.9 Å²	31.9	2%	0.019	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	148.4	-173.2	-42.6	82.2	0	0	0	110.5	L379 I395 L396 S398 K406 E414 C415	L379-W408 HydrophobicContact CB-CD2 4.23Å; L379-W408 HydrophobicContact CB-CE3 3.85Å; L379-W408 HydrophobicContact CB-CH2 4.09Å; L379-W408 HydrophobicContact CB-CZ2 4.44Å; L379-W408 HydrophobicContact CB-CZ3 3.78Å; L379-W408 HydrophobicContact CD1-CB 4.09Å; L379-W408 HydrophobicContact CD1-CD2 3.96Å; L379-W408 HydrophobicContact CD1-CE3 4.18Å; L379-W408 HydrophobicContact CD1-CG 3.94Å; L379-W408 HydrophobicContact CD2-CE3 4.38Å; L379-W408 HydrophobicContact CG-CE3 4.36Å; I395-W408 WeakPolarHBondContact CA-O 3.37Å; L396-W408 HydrophobicContact CB-CB 4.32Å; L396-W408 HydrophobicContact CD2-CG 4.47Å; L396-W408 PolarHBondContact N-O 2.91Å; L396-W408 PolarHBondContact O-N 2.87Å; S398-W408 PolarHBondContact OG-NE1 2.98Å; K406-W408 HydrophobicContact CB-CD2 4.4Å; K406-W408 VanDerWaalsContact CB-CE2 3.47Å; K406-W408 HydrophobicContact CB-CH2 4.48Å; K406-W408 HydrophobicContact CB-CZ2 3.53Å; K406-W408 HydrophobicContact CD-CH2 3.68Å; K406-W408 HydrophobicContact CD-CZ2 3.3Å; K406-W408 HydrophobicContact CG-CZ2 4.04Å; W408-E414 CarbonylContact C-O 3.54Å; W408-E414 VanDerWaalsContact CA-O 3.24Å; W408-E414 WeakPolarHBondContact CA-O 3.07Å; W408-C415 HydrophobicContact CD2-CB 4.4Å; W408-C415 HydrophobicContact CE3-CB 3.55Å; W408-C415 HydrophobicContact CH2-CB 4.3Å; W408-C415 HydrophobicContact CZ3-CB 3.5Å; W408-C415 VanDerWaalsContact CZ3-CB 3.5Å
409	D	97.4	Very high	97.3	Very high	27 Å²	27	32 Å²	32	14%	0.144	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	115.2	161.2	-171.4	-41.9	0	0	0	108.9	N394 T411 T412 G413 E414 L416	N394-D409 WeakPolarHBondContact O-CA 3.25Å; D409-T411 PolarHBondContact O-N 3.39Å; D409-T411 WeakPolarHBondContact OD1-CA 3.45Å; D409-T411 WeakPolarHBondContact OD1-CB 3.49Å; D409-T411 PolarHBondContact OD1-N 2.9Å; D409-T411 PolarHBondContact OD1-OG1 2.92Å; D409-T412 WeakPolarHBondContact CB-OG1 3.38Å; D409-T412 PolarHBondContact OD1-N 2.79Å; D409-G413 WeakPolarHBondContact O-CA 3.3Å; D409-G413 PolarHBondContact O-N 2.93Å; D409-E414 PolarHBondContact N-O 3.31Å; D409-L416 HydrophobicContact CB-CD1 4.22Å; D409-L416 HydrophobicContact CB-CD2 4.28Å; D409-L416 HydrophobicContact CB-CG 4.28Å
410	V	96.3	Very high	96.8	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.012	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.7	-177.9	-61.5	0	0	0	0	114	I357 V367 F377 L391 N394 L396	I357-V410 HydrophobicContact CG1-CG1 4.45Å; V367-V410 HydrophobicContact CG2-CB 4.38Å; V367-V410 HydrophobicContact CG2-CG1 4.34Å; F377-V410 WeakPolarHBondContact CD2-O 3.45Å; F377-V410 WeakPolarHBondContact CE2-O 3.47Å; L391-V410 HydrophobicContact CD1-CG1 3.97Å; L391-V410 HydrophobicContact CD1-CG2 4.06Å; N394-V410 WeakPolarHBondContact O-CG2 3.32Å; N394-V410 PolarHBondContact O-N 3.32Å; L396-V410 HydrophobicContact CB-CG1 3.56Å; L396-V410 HydrophobicContact CD2-CG1 4.25Å; L396-V410 HydrophobicContact CG-CG1 4.43Å
411	T	95.4	Very high	96.4	Very high	71 Å²	71	36 Å²	36	44%	0.436	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-29.1	177.5	67.2	0	0	0	0	112.5	F377 N394 D409	F377-T411 WeakPolarHBondContact CE2-O 3.27Å; F377-T411 WeakPolarHBondContact CZ-O 3.42Å; N394-T411 HydrophobicContact CB-CG2 4Å; N394-T411 VanDerWaalsContact CG-CG2 3.43Å; D409-T411 PolarHBondContact O-N 3.39Å; D409-T411 WeakPolarHBondContact OD1-CA 3.45Å; D409-T411 WeakPolarHBondContact OD1-CB 3.49Å; D409-T411 PolarHBondContact OD1-N 2.9Å; D409-T411 PolarHBondContact OD1-OG1 2.92Å
412	T	96.4	Very high	96.3	Very high	74 Å²	74	40.2 Å²	40.2	45%	0.454	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-21.9	176.7	67.4	0	0	0	0	113.1	F377 D409 E414	F377-T412 WeakPolarHBondContact CE1-O 3.33Å; D409-T412 WeakPolarHBondContact CB-OG1 3.38Å; D409-T412 PolarHBondContact OD1-N 2.79Å; T412-E414 VanDerWaalsContact OG1-CB 3.26Å; T412-E414 WeakPolarHBondContact OG1-CB 3.26Å; T412-E414 PolarHBondContact OG1-N 2.84Å
413	G	95.6	Very high	96.2	Very high	21 Å²	21	42.2 Å²	42.2	22%	0.216	26%	0.256	C	S	.	.			trans	78.4	5.5	-171	0	0	0	0	0	113.9	D409	D409-G413 WeakPolarHBondContact O-CA 3.3Å; D409-G413 PolarHBondContact O-N 2.93Å
414	E	97.3	Very high	96.1	Very high	119 Å²	119	46.9 Å²	46.9	56%	0.556	27%	0.271	S	S	*	.			trans	-75.1	137.8	-177.1	-171.8	179.3	177.2	0	0	112	W408 D409 T412 L416	W408-E414 CarbonylContact C-O 3.54Å; W408-E414 VanDerWaalsContact CA-O 3.24Å; W408-E414 WeakPolarHBondContact CA-O 3.07Å; D409-E414 PolarHBondContact N-O 3.31Å; T412-E414 VanDerWaalsContact OG1-CB 3.26Å; T412-E414 WeakPolarHBondContact OG1-CB 3.26Å; T412-E414 PolarHBondContact OG1-N 2.84Å; E414-L416 HydrophobicContact CG-CD2 4.37Å; E414-L416 PolarHBondContact O-N 3.17Å
415	C	97.8	Very high	96.1	Very high	48 Å²	48	45.9 Å²	45.9	32%	0.324	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	95	166.6	-175.9	0	0	0	0	109.1	V407 W408	V407-C415 CarbonylContact O-C 3.53Å; W408-C415 HydrophobicContact CD2-CB 4.4Å; W408-C415 HydrophobicContact CE3-CB 3.55Å; W408-C415 HydrophobicContact CH2-CB 4.3Å; W408-C415 HydrophobicContact CZ3-CB 3.5Å; W408-C415 VanDerWaalsContact CZ3-CB 3.5Å
416	L	97.7	Very high	96	Very high	58 Å²	58	52.2 Å²	52.2	30%	0.304	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	-45.7	179.7	-58.3	178.7	0	0	0	112	I395 V407 D409 E414	I395-L416 HydrophobicContact CD1-CD1 3.47Å; I395-L416 VanDerWaalsContact CD1-CD1 3.47Å; V407-L416 HydrophobicContact CG1-CB 4.47Å; V407-L416 HydrophobicContact CG1-CD1 4.39Å; V407-L416 PolarHBondContact O-N 2.9Å; D409-L416 HydrophobicContact CB-CD1 4.22Å; D409-L416 HydrophobicContact CB-CD2 4.28Å; D409-L416 HydrophobicContact CB-CG 4.28Å; E414-L416 HydrophobicContact CG-CD2 4.37Å; E414-L416 PolarHBondContact O-N 3.17Å
417	H	97.5	Very high	95.9	Very high	51 Å²	51	53.5 Å²	53.5	24%	0.236	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	146.9	-177.8	-60.6	-66.4	0	0	0	112.1	K406 V407 L419 A454 I455 G457	K406-H417 WeakPolarHBondContact CA-O 3.39Å; V407-H417 HydrophobicContact CB-CB 4.06Å; V407-H417 HydrophobicContact CG2-CB 4.16Å; V407-H417 PolarHBondContact N-O 3.19Å; V407-H417 PolarHBondContact O-N 2.86Å; H417-L419 HydrophobicContact CB-CD2 3.91Å; H417-A454 PolarHBondContact CD2-O 2.91Å; H417-A454 VanDerWaalsContact CD2-O 3.3Å; H417-I455 PolarHBondContact NE2-O 2.81Å; H417-G457 VanDerWaalsContact CG-CA 3.49Å
418	T	97.4	Very high	95.9	Very high	63 Å²	63	54.6 Å²	54.6	39%	0.387	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	107.5	160.6	-61.7	0	0	0	0	107.6	I405 K406 S420	I405-T418 CarbonylContact O-C 3.58Å; K406-T418 HydrophobicContact CG-CG2 4.18Å; K406-T418 PolarHBondContact NZ-OG1 3.09Å; T418-S420 PolarHBondContact O-N 2.9Å
419	L	95.8	Very high	95.8	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	97.6	-179.2	-42.5	-178.3	0	0	0	108.2	I405 V407 H417 I440 W452	I405-L419 HydrophobicContact CB-CB 4.09Å; I405-L419 HydrophobicContact CB-CD1 4.05Å; I405-L419 HydrophobicContact CB-CG 4.26Å; I405-L419 HydrophobicContact CG2-CD1 3.73Å; I405-L419 HydrophobicContact CG2-CG 4.29Å; I405-L419 PolarHBondContact O-N 2.81Å; V407-L419 HydrophobicContact CG2-CD1 4.13Å; V407-L419 HydrophobicContact CG2-CD2 4.06Å; V407-L419 HydrophobicContact CG2-CG 4.13Å; H417-L419 HydrophobicContact CB-CD2 3.91Å; L419-I440 HydrophobicContact CD1-CD1 3.68Å; L419-I440 HydrophobicContact CD1-CG2 4.46Å; L419-W452 HydrophobicContact CB-CD2 4.02Å; L419-W452 HydrophobicContact CB-CE3 3.7Å; L419-W452 HydrophobicContact CB-CZ3 3.97Å; L419-W452 HydrophobicContact CD1-CB 3.79Å; L419-W452 HydrophobicContact CD1-CD2 4.13Å; L419-W452 HydrophobicContact CD1-CE3 4.45Å; L419-W452 HydrophobicContact CD1-CG 3.82Å
420	S	87.5	Confident	95.8	Very high	49 Å²	49	54.7 Å²	54.7	34%	0.343	32%	0.316	S	S	.	.			trans	-146.5	-148.8	-175.5	-175.9	0	0	0	0	108.4	T418	T418-S420 PolarHBondContact O-N 2.9Å
421	G	90.6	Very high	95.9	Very high	35 Å²	35	55.2 Å²	55.2	36%	0.361	32%	0.32	S	S	.	.	S	Bend	trans	94	-162.5	-179.7	0	0	0	0	0	112.9	N423 R424	G421-N423 PolarHBondContact O-N 2.79Å; G421-N423 VanDerWaalsContact O-N 3.14Å; G421-R424 WeakPolarHBondContact O-CB 3.41Å; G421-R424 WeakPolarHBondContact O-CG 3.5Å; G421-R424 PolarHBondContact O-N 3.43Å; G421-R424 VanDerWaalsContact O-N 3.14Å
422	P	94	Very high	96	Very high	127 Å²	127	52.1 Å²	52.1	83%	0.825	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.4	-174.4	-25.1	34.4	0	0	0	114.1
423	N	95.2	Very high	96.1	Very high	67 Å²	67	49.6 Å²	49.6	36%	0.358	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	17	-177.2	-62.1	-59.6	0	0	0	113.3	G421 K450 F459	G421-N423 PolarHBondContact O-N 2.79Å; G421-N423 VanDerWaalsContact O-N 3.14Å; N423-K450 WeakPolarHBondContact O-CD 3.35Å; N423-K450 WeakPolarHBondContact O-CE 3.13Å; N423-K450 PolarHBondContact O-NZ 2.9Å; N423-F459 HydrophobicContact CB-CB 4.18Å; N423-F459 HydrophobicContact CB-CD1 3.52Å; N423-F459 HydrophobicContact CB-CD2 3.69Å; N423-F459 HydrophobicContact CB-CE1 3.64Å; N423-F459 HydrophobicContact CB-CE2 3.81Å; N423-F459 HydrophobicContact CB-CG 3.51Å; N423-F459 HydrophobicContact CB-CZ 3.75Å; N423-F459 VanDerWaalsContact CG-CE1 3.44Å; N423-F459 VanDerWaalsContact ND2-CD1 3.26Å; N423-F459 WeakPolarHBondContact ND2-CD1 3.22Å
424	R	95.6	Very high	96.1	Very high	121 Å²	121	49.2 Å²	49.2	46%	0.457	28%	0.276	S	S	.	.			trans	-56.3	160.8	178.1	69.1	173.6	-164.5	-125.3	2.9	112.3	G421 H426	G421-R424 WeakPolarHBondContact O-CB 3.41Å; G421-R424 WeakPolarHBondContact O-CG 3.5Å; G421-R424 PolarHBondContact O-N 3.43Å; G421-R424 VanDerWaalsContact O-N 3.14Å; R424-H426 PolarHBondContact O-CE1 3.19Å; R424-H426 PolarHBondContact O-ND1 2.95Å
425	H	97.4	Very high	96	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.009	25%	0.25	C	S	.	.			trans	-65.5	148.5	164.5	-78.2	-65.5	0	0	0	110.1	S403 S442 S444 D446	S403-H425 WeakPolarHBondContact CB-O 3.42Å; S403-H425 PolarHBondContact OG-O 3.45Å; H425-S442 PolarHBondContact NE2-OG 3.35Å; H425-S444 VanDerWaalsContact CE1-CB 3.49Å; H425-S444 WeakPolarHBondContact CE1-CB 3.28Å; H425-S444 WeakPolarHBondContact ND1-CB 3.49Å; H425-D446 VanDerWaalsContact CA-OD2 3.23Å; H425-D446 WeakPolarHBondContact CA-OD2 3.49Å; H425-D446 IonicContact CE1-OD1 3.9Å; H425-D446 IonicContact CG-OD2 3.84Å; H425-D446 IonicContact ND1-OD1 2.63Å; H425-D446 PolarHBondContact ND1-OD1 2.8Å; H425-D446 IonicContact ND1-OD2 2.78Å; H425-D446 PolarHBondContact ND1-OD2 3.25Å
426	H	95.9	Very high	95.5	Very high	134 Å²	134	45 Å²	45	62%	0.62	26%	0.259	S	S	*	.	S	Bend	trans	-101.7	-4.4	-179.2	-60.9	86.6	0	0	0	112.8	R424 D446	R424-H426 PolarHBondContact O-CE1 3.19Å; R424-H426 PolarHBondContact O-ND1 2.95Å; H426-D446 HydrophobicContact CB-CB 4.16Å; H426-D446 PolarHBondContact N-OD2 2.93Å; H426-D446 IonicContact ND1-OD2 3.58Å
427	S	96.5	Very high	95	Very high	48 Å²	48	43.7 Å²	43.7	34%	0.336	25%	0.251	S	S	.	.	S	Bend	trans	-144	-175.6	178	-164.8	0	0	0	0	110.2	S403 V429 S444	S403-S427 WeakPolarHBondContact CA-O 3.45Å; S403-S427 WeakPolarHBondContact CB-O 3.44Å; S427-V429 PolarHBondContact O-N 3.22Å; S427-S444 PolarHBondContact O-OG 2.79Å; S427-S444 VanDerWaalsContact O-OG 3.1Å
428	A	97.4	Very high	94.7	Very high	22 Å²	22	41.6 Å²	41.6	18%	0.182	24%	0.244	C	C	.	.			trans	-54	137	-179.1	0	0	0	0	0	112.2	A401 T430 S444 D445	A401-A428 HydrophobicContact CB-CB 4.14Å; A428-T430 PolarHBondContact O-N 2.95Å; A428-S444 VanDerWaalsContact O-CA 3.23Å; A428-S444 WeakPolarHBondContact O-CA 3.42Å; A428-S444 VanDerWaalsContact O-CB 3.25Å; A428-S444 WeakPolarHBondContact O-CB 3.35Å; A428-S444 PolarHBondContact O-OG 2.93Å; A428-D445 PolarHBondContact O-N 3.22Å
429	V	98	Very high	94.6	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	117.4	169.7	-179.2	0	0	0	0	107.9	S387 N400 I405 S427 S443	S387-V429 PolarHBondContact OG-O 2.9Å; N400-V429 PolarHBondContact O-N 2.88Å; I405-V429 HydrophobicContact CD1-CG2 4.41Å; I405-V429 HydrophobicContact CG1-CG1 4.3Å; I405-V429 HydrophobicContact CG1-CG2 3.87Å; S427-V429 PolarHBondContact O-N 3.22Å; V429-S443 CarbonylContact C-O 3.59Å; V429-S443 WeakPolarHBondContact CA-O 3.49Å; V429-S443 WeakPolarHBondContact CG1-O 3.25Å
430	T	97.7	Very high	94.7	Very high	34 Å²	34	38.5 Å²	38.5	21%	0.209	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-33.3	-173	55.9	0	0	0	0	112.2	A428 S443 D445 I475 W476	A428-T430 PolarHBondContact O-N 2.95Å; T430-S443 PolarHBondContact N-O 3.23Å; T430-S443 PolarHBondContact OG1-O 2.97Å; T430-S443 PolarHBondContact OG1-OG 3.38Å; T430-D445 HydrophobicContact CG2-CB 4.49Å; T430-D445 WeakPolarHBondContact CG2-OD1 3.22Å; T430-I475 WeakPolarHBondContact CB-O 3.36Å; T430-I475 PolarHBondContact OG1-O 3.29Å; T430-W476 WeakPolarHBondContact CB-O 3.31Å; T430-W476 PolarHBondContact OG1-O 2.75Å
431	S	97.7	Very high	95.2	Very high	13 Å²	13	36.2 Å²	36.2	9%	0.091	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	156.6	-179.1	-158.8	0	0	0	0	111.4	S442 S443 L478	S431-S442 WeakPolarHBondContact O-CA 3.49Å; S431-S443 VanDerWaalsContact CB-OG 3.22Å; S431-S443 WeakPolarHBondContact CB-OG 3.37Å; S431-S443 PolarHBondContact N-OG 2.8Å; S431-S443 PolarHBondContact O-N 3.28Å; S431-S443 PolarHBondContact O-OG 3.17Å; S431-L478 PolarHBondContact OG-N 3.42Å
432	L	97.5	Very high	95.6	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.026	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.7	175.3	72.1	96.6	0	0	0	111.4	G388 Q390 V397 V441	G388-L432 WeakPolarHBondContact O-CD2 3.3Å; Q390-L432 HydrophobicContact CB-CD1 3.73Å; Q390-L432 HydrophobicContact CG-CD1 3.36Å; Q390-L432 HydrophobicContact CG-CG 4.3Å; V397-L432 HydrophobicContact CB-CD1 4.11Å; V397-L432 HydrophobicContact CG1-CD1 3.89Å; V397-L432 HydrophobicContact CG1-CD2 4.45Å; L432-V441 CarbonylContact C-O 3.59Å; L432-V441 WeakPolarHBondContact CA-O 3.35Å
433	Q	97.8	Very high	95.8	Very high	21 Å²	21	28.5 Å²	28.5	10%	0.098	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.6	170.2	-68.7	-68.6	-75.6	0	0	108.9	I440 V441 L478 A480	Q433-I440 WeakPolarHBondContact O-CA 3.45Å; Q433-V441 PolarHBondContact N-O 3.46Å; Q433-V441 PolarHBondContact O-N 3.1Å; Q433-L478 HydrophobicContact CB-CD1 3.99Å; Q433-L478 HydrophobicContact CG-CD1 3.34Å; Q433-A480 HydrophobicContact CB-CB 3.97Å; Q433-A480 HydrophobicContact CG-CB 4.12Å
434	F	96.9	Very high	95.9	Very high	14 Å²	14	25.3 Å²	25.3	6%	0.061	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	117.4	171	-177	-154	0	0	0	107.5	Q390 R392 I395 V397 I440 A454	Q390-F434 HydrophobicContact CB-CB 3.74Å; Q390-F434 HydrophobicContact CG-CB 4.48Å; R392-F434 HydrophobicContact CB-CD1 3.75Å; R392-F434 HydrophobicContact CB-CE1 3.6Å; R392-F434 HydrophobicContact CG-CD1 3.69Å; R392-F434 HydrophobicContact CG-CE1 4.06Å; R392-F434 HydrophobicContact CG-CG 4.41Å; R392-F434 PolarHBondContact NE-O 2.59Å; R392-F434 PolarHBondContact NH2-O 3.25Å; R392-F434 VanDerWaalsContact NH2-O 3.12Å; I395-F434 HydrophobicContact CB-CE1 3.88Å; I395-F434 HydrophobicContact CB-CZ 4.19Å; I395-F434 HydrophobicContact CG2-CE1 3.78Å; I395-F434 HydrophobicContact CG2-CZ 3.9Å; V397-F434 HydrophobicContact CG2-CB 4.25Å; V397-F434 HydrophobicContact CG2-CD1 3.98Å; V397-F434 HydrophobicContact CG2-CD2 4.23Å; V397-F434 HydrophobicContact CG2-CE1 4.36Å; V397-F434 HydrophobicContact CG2-CG 3.92Å; F434-I440 HydrophobicContact CD2-CG1 3.86Å; F434-I440 HydrophobicContact CE2-CG1 4.34Å; F434-A454 HydrophobicContact CD2-CB 4.44Å; F434-A454 HydrophobicContact CE2-CB 3.58Å; F434-A454 HydrophobicContact CZ-CB 4.07Å
435	L	93.7	Very high	96	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.01	13%	0.13	C	C	.	.			trans	-90.8	150.8	-175.1	-68.8	-176.7	0	0	0	111.3	W163 N437 G438 L439 V441 A480 T481 M482	W163-L435 HydrophobicContact CH2-CD1 4.11Å; W163-L435 HydrophobicContact CZ2-CD1 4.06Å; W163-L435 HydrophobicContact CZ3-CD1 4.46Å; L435-N437 VanDerWaalsContact CB-OD1 3.27Å; L435-N437 WeakPolarHBondContact CB-OD1 3.22Å; L435-N437 PolarHBondContact O-N 3.43Å; L435-N437 VanDerWaalsContact O-N 3.1Å; L435-G438 PolarHBondContact O-N 2.87Å; L435-L439 HydrophobicContact CB-CB 4.31Å; L435-L439 WeakPolarHBondContact CB-O 3.42Å; L435-L439 HydrophobicContact CD1-CB 4.23Å; L435-L439 PolarHBondContact N-O 3.42Å; L435-V441 HydrophobicContact CD1-CG2 4.13Å; L435-A480 HydrophobicContact CD2-CB 3.79Å; L435-A480 HydrophobicContact CG-CB 4.47Å; L435-T481 WeakPolarHBondContact CD2-O 3.28Å; L435-M482 HydrophobicContact CB-CE 3.62Å; L435-M482 HydrophobicContact CD1-CE 3.96Å; L435-M482 HydrophobicContact CD2-CE 4.13Å; L435-M482 HydrophobicContact CG-CE 4.12Å
436	P	88.8	Confident	95.9	Very high	77 Å²	77	23.5 Å²	23.5	50%	0.5	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-27.4	179.5	-25.4	30.2	0	0	0	115.5	G438 M482	P436-G438 PolarHBondContact O-N 3.28Å; P436-M482 HydrophobicContact CB-SD 3.8Å; P436-M482 VanDerWaalsContact CD-SD 3.55Å; P436-M482 HydrophobicContact CG-CE 4.38Å; P436-M482 HydrophobicContact CG-CG 4.31Å; P436-M482 HydrophobicContact CG-SD 3.61Å
437	N	86.3	Confident	96	Very high	29 Å²	29	17.1 Å²	17.1	16%	0.155	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	7.6	179.4	65.4	-3.8	0	0	0	114	L435 L439 M482	L435-N437 VanDerWaalsContact CB-OD1 3.27Å; L435-N437 WeakPolarHBondContact CB-OD1 3.22Å; L435-N437 PolarHBondContact O-N 3.43Å; L435-N437 VanDerWaalsContact O-N 3.1Å; N437-L439 WeakPolarHBondContact ND2-CD1 3.06Å; N437-L439 WeakPolarHBondContact OD1-CB 3.35Å; N437-L439 WeakPolarHBondContact OD1-CG 3.44Å; N437-L439 PolarHBondContact OD1-N 3.46Å; N437-M482 HydrophobicContact CB-CE 4.25Å
438	G	91.8	Very high	96	Very high	8 Å²	8	15.2 Å²	15.2	8%	0.082	9%	0.092	C	C	.	.	S	Bend	trans	87.9	0	179.6	0	0	0	0	0	114.5	L435 P436 A454	L435-G438 PolarHBondContact O-N 2.87Å; P436-G438 PolarHBondContact O-N 3.28Å; G438-A454 WeakPolarHBondContact O-CB 3.37Å; G438-A454 PolarHBondContact O-N 2.91Å
439	L	95.6	Very high	96.1	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	141	176.7	-63.6	178.5	0	0	0	111.6	W163 R164 L435 N437 L451 W452 I460	W163-L439 HydrophobicContact CB-CD1 3.79Å; W163-L439 HydrophobicContact CG-CD1 4.17Å; R164-L439 HydrophobicContact CG-CD2 4.3Å; L435-L439 HydrophobicContact CB-CB 4.31Å; L435-L439 WeakPolarHBondContact CB-O 3.42Å; L435-L439 HydrophobicContact CD1-CB 4.23Å; L435-L439 PolarHBondContact N-O 3.42Å; N437-L439 WeakPolarHBondContact ND2-CD1 3.06Å; N437-L439 WeakPolarHBondContact OD1-CB 3.35Å; N437-L439 WeakPolarHBondContact OD1-CG 3.44Å; N437-L439 PolarHBondContact OD1-N 3.46Å; L439-L451 HydrophobicContact CB-CD1 4Å; L439-L451 HydrophobicContact CD1-CD1 4.19Å; L439-L451 HydrophobicContact CD1-CD2 4.4Å; L439-L451 HydrophobicContact CD2-CD1 4.41Å; L439-L451 HydrophobicContact CD2-CD2 4.49Å; L439-L451 HydrophobicContact CD2-CG 4.44Å; L439-L451 HydrophobicContact CG-CD1 4.43Å; L439-W452 WeakPolarHBondContact CA-O 3.39Å; L439-I460 HydrophobicContact CD2-CD1 3.42Å; L439-I460 VanDerWaalsContact CD2-CD1 3.42Å
440	I	97.8	Very high	96.1	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	126.1	172.1	-61	164.1	0	0	0	107.7	V397 V407 L419 Q433 F434 L451 W452 A454	V397-I440 HydrophobicContact CB-CD1 4.39Å; V397-I440 HydrophobicContact CG1-CD1 3.8Å; V397-I440 HydrophobicContact CG1-CG1 4.19Å; V397-I440 HydrophobicContact CG1-CG2 3.89Å; V397-I440 HydrophobicContact CG2-CD1 3.64Å; V397-I440 HydrophobicContact CG2-CG1 3.98Å; V407-I440 HydrophobicContact CG2-CD1 3.76Å; L419-I440 HydrophobicContact CD1-CD1 3.68Å; L419-I440 HydrophobicContact CD1-CG2 4.46Å; Q433-I440 WeakPolarHBondContact O-CA 3.45Å; F434-I440 HydrophobicContact CD2-CG1 3.86Å; F434-I440 HydrophobicContact CE2-CG1 4.34Å; I440-L451 WeakPolarHBondContact O-CA 3.3Å; I440-W452 HydrophobicContact CB-CB 4.2Å; I440-W452 PolarHBondContact N-O 3.3Å; I440-W452 PolarHBondContact O-N 2.75Å; I440-A454 HydrophobicContact CD1-CB 3.59Å; I440-A454 HydrophobicContact CG1-CB 3.95Å
441	V	97.9	Very high	96.1	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.5	172.7	-168.1	0	0	0	0	108	W163 L432 Q433 L435 V449 K450 L451 L463 L478 A480 L485	W163-V441 HydrophobicContact CH2-CG2 4.2Å; W163-V441 HydrophobicContact CZ3-CG2 3.77Å; L432-V441 CarbonylContact C-O 3.59Å; L432-V441 WeakPolarHBondContact CA-O 3.35Å; Q433-V441 PolarHBondContact N-O 3.46Å; Q433-V441 PolarHBondContact O-N 3.1Å; L435-V441 HydrophobicContact CD1-CG2 4.13Å; V441-V449 HydrophobicContact CG1-CG1 3.52Å; V441-K450 WeakPolarHBondContact CA-O 3.24Å; V441-L451 HydrophobicContact CG2-CD1 3.85Å; V441-L463 HydrophobicContact CG1-CD1 4.11Å; V441-L478 HydrophobicContact CB-CD2 4.43Å; V441-L478 HydrophobicContact CG1-CD2 3.68Å; V441-A480 HydrophobicContact CG2-CB 4.39Å; V441-L485 HydrophobicContact CG1-CD1 3.93Å; V441-L485 HydrophobicContact CG1-CD2 3.99Å
442	S	98.3	Very high	96.1	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.6	-179.2	61.9	0	0	0	0	112.1	I405 H425 S431 V449 K450 W452	I405-S442 VanDerWaalsContact CD1-OG 3.26Å; I405-S442 WeakPolarHBondContact CD1-OG 3.37Å; H425-S442 PolarHBondContact NE2-OG 3.35Å; S431-S442 WeakPolarHBondContact O-CA 3.49Å; S442-V449 CarbonylContact O-C 3.57Å; S442-V449 WeakPolarHBondContact O-CA 3.36Å; S442-V449 WeakPolarHBondContact O-CG1 3.38Å; S442-K450 PolarHBondContact N-O 3.18Å; S442-K450 PolarHBondContact O-N 2.9Å; S442-W452 PolarHBondContact OG-NE1 2.61Å
443	S	98.1	Very high	96	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	153.5	173.1	60	0	0	0	0	111.3	V429 T430 S431 I475	V429-S443 CarbonylContact C-O 3.59Å; V429-S443 WeakPolarHBondContact CA-O 3.49Å; V429-S443 WeakPolarHBondContact CG1-O 3.25Å; T430-S443 PolarHBondContact N-O 3.23Å; T430-S443 PolarHBondContact OG1-O 2.97Å; T430-S443 PolarHBondContact OG1-OG 3.38Å; S431-S443 VanDerWaalsContact CB-OG 3.22Å; S431-S443 WeakPolarHBondContact CB-OG 3.37Å; S431-S443 PolarHBondContact N-OG 2.8Å; S431-S443 PolarHBondContact O-N 3.28Å; S431-S443 PolarHBondContact O-OG 3.17Å; S443-I475 VanDerWaalsContact CB-CG2 3.41Å
444	S	97.7	Very high	95.9	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	164.1	177.8	175.9	0	0	0	0	112.4	H425 S427 A428 D446 G447 C448 I475	H425-S444 VanDerWaalsContact CE1-CB 3.49Å; H425-S444 WeakPolarHBondContact CE1-CB 3.28Å; H425-S444 WeakPolarHBondContact ND1-CB 3.49Å; S427-S444 PolarHBondContact O-OG 2.79Å; S427-S444 VanDerWaalsContact O-OG 3.1Å; A428-S444 VanDerWaalsContact O-CA 3.23Å; A428-S444 WeakPolarHBondContact O-CA 3.42Å; A428-S444 VanDerWaalsContact O-CB 3.25Å; A428-S444 WeakPolarHBondContact O-CB 3.35Å; A428-S444 PolarHBondContact O-OG 2.93Å; S444-D446 VanDerWaalsContact CB-OD1 3.27Å; S444-D446 WeakPolarHBondContact CB-OD1 3.5Å; S444-D446 PolarHBondContact O-N 3.13Å; S444-D446 PolarHBondContact OG-N 3.32Å; S444-G447 PolarHBondContact O-N 2.95Å; S444-C448 PolarHBondContact N-O 3.47Å; S444-I475 PolarHBondContact O-N 2.97Å
445	D	96.7	Very high	95.6	Very high	65 Å²	65	17.8 Å²	17.8	35%	0.348	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-9.2	168.7	-68.3	-33.9	0	0	0	113	A428 T430 G447 C474	A428-D445 PolarHBondContact O-N 3.22Å; T430-D445 HydrophobicContact CG2-CB 4.49Å; T430-D445 WeakPolarHBondContact CG2-OD1 3.22Å; D445-G447 PolarHBondContact O-N 3.28Å; D445-C474 HydrophobicContact CB-CB 4.49Å
446	D	96.6	Very high	95.6	Very high	20 Å²	20	20.8 Å²	20.8	11%	0.107	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	6	170.9	71	7.4	0	0	0	114.1	H425 H426 S444 C448 G469	H425-D446 VanDerWaalsContact CA-OD2 3.23Å; H425-D446 WeakPolarHBondContact CA-OD2 3.49Å; H425-D446 IonicContact CE1-OD1 3.9Å; H425-D446 IonicContact CG-OD2 3.84Å; H425-D446 IonicContact ND1-OD1 2.63Å; H425-D446 PolarHBondContact ND1-OD1 2.8Å; H425-D446 IonicContact ND1-OD2 2.78Å; H425-D446 PolarHBondContact ND1-OD2 3.25Å; H426-D446 HydrophobicContact CB-CB 4.16Å; H426-D446 PolarHBondContact N-OD2 2.93Å; H426-D446 IonicContact ND1-OD2 3.58Å; S444-D446 VanDerWaalsContact CB-OD1 3.27Å; S444-D446 WeakPolarHBondContact CB-OD1 3.5Å; S444-D446 PolarHBondContact O-N 3.13Å; S444-D446 PolarHBondContact OG-N 3.32Å; D446-C448 PolarHBondContact O-N 3.11Å; D446-C448 WeakPolarHBondContact OD1-CA 3.31Å; D446-C448 WeakPolarHBondContact OD1-CB 3.48Å; D446-C448 PolarHBondContact OD1-N 3.31Å; D446-G469 WeakPolarHBondContact O-CA 3.39Å
447	G	97.1	Very high	95.9	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	72.2	12	-179.2	0	0	0	0	0	114.4	S444 D445 L466	S444-G447 PolarHBondContact O-N 2.95Å; D445-G447 PolarHBondContact O-N 3.28Å; G447-L466 WeakPolarHBondContact O-CG 3.21Å; G447-L466 PolarHBondContact O-N 2.84Å
448	C	97.8	Very high	96.4	Very high	8 Å²	8	20.4 Å²	20.4	5%	0.054	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	147.8	179.1	-59.5	0	0	0	0	112.7	S444 D446 K450 I464	S444-C448 PolarHBondContact N-O 3.47Å; D446-C448 PolarHBondContact O-N 3.11Å; D446-C448 WeakPolarHBondContact OD1-CA 3.31Å; D446-C448 WeakPolarHBondContact OD1-CB 3.48Å; D446-C448 PolarHBondContact OD1-N 3.31Å; C448-K450 HydrophobicContact CB-CG 4.29Å; C448-I464 CarbonylContact C-O 3.54Å; C448-I464 VanDerWaalsContact CA-O 3.24Å; C448-I464 WeakPolarHBondContact CA-O 3.32Å
449	V	98	Very high	96.7	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.7	159.3	-178.2	0	0	0	0	108.3	V441 S442 L463 I464 I475 L478 L485	V441-V449 HydrophobicContact CG1-CG1 3.52Å; S442-V449 CarbonylContact O-C 3.57Å; S442-V449 WeakPolarHBondContact O-CA 3.36Å; S442-V449 WeakPolarHBondContact O-CG1 3.38Å; V449-L463 HydrophobicContact CB-CB 4.47Å; V449-L463 HydrophobicContact CG1-CB 4.34Å; V449-L463 HydrophobicContact CG1-CD1 4.41Å; V449-L463 PolarHBondContact O-N 3.49Å; V449-I464 HydrophobicContact CB-CB 3.92Å; V449-I464 HydrophobicContact CB-CD1 4.31Å; V449-I464 HydrophobicContact CB-CG1 4.05Å; V449-I464 HydrophobicContact CG2-CB 3.98Å; V449-I464 HydrophobicContact CG2-CD1 3.86Å; V449-I464 HydrophobicContact CG2-CG1 4.1Å; V449-I464 PolarHBondContact N-O 2.78Å; V449-I464 PolarHBondContact O-N 3.04Å; V449-I475 HydrophobicContact CG2-CB 4.35Å; V449-I475 HydrophobicContact CG2-CD1 4.31Å; V449-I475 HydrophobicContact CG2-CG1 3.92Å; V449-I475 HydrophobicContact CG2-CG2 3.88Å; V449-L478 HydrophobicContact CG1-CD2 3.81Å; V449-L485 HydrophobicContact CG1-CD2 3.77Å
450	K	97.8	Very high	96.7	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.009	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	146	-173.4	-62.8	-176	177.4	-78.3	0	111.2	N423 V441 S442 C448 W452 F459 D462	N423-K450 WeakPolarHBondContact O-CD 3.35Å; N423-K450 WeakPolarHBondContact O-CE 3.13Å; N423-K450 PolarHBondContact O-NZ 2.9Å; V441-K450 WeakPolarHBondContact CA-O 3.24Å; S442-K450 PolarHBondContact N-O 3.18Å; S442-K450 PolarHBondContact O-N 2.9Å; C448-K450 HydrophobicContact CB-CG 4.29Å; K450-W452 HydrophobicContact CB-CZ2 3.88Å; K450-W452 HydrophobicContact CD-CH2 4.32Å; K450-W452 HydrophobicContact CD-CZ2 3.6Å; K450-W452 HydrophobicContact CG-CZ2 4.37Å; K450-F459 HydrophobicContact CB-CE2 4.2Å; K450-F459 HydrophobicContact CD-CE2 4.17Å; K450-F459 HydrophobicContact CG-CE2 4.18Å; K450-D462 WeakPolarHBondContact CG-OD1 3.42Å; K450-D462 IonicContact NZ-OD1 3.19Å; K450-D462 PolarHBondContact NZ-OD1 3.03Å; K450-D462 IonicContact NZ-OD2 3.3Å
451	L	97.8	Very high	96.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.1	175.9	-170.4	69.9	0	0	0	110.2	W163 L439 I440 V441 I460 R461 L463	W163-L451 HydrophobicContact CB-CD2 4.4Å; W163-L451 HydrophobicContact CE3-CD1 4.07Å; W163-L451 HydrophobicContact CZ3-CD1 4.42Å; W163-L451 WeakPolarHBondContact O-CD2 3.39Å; L439-L451 HydrophobicContact CB-CD1 4Å; L439-L451 HydrophobicContact CD1-CD1 4.19Å; L439-L451 HydrophobicContact CD1-CD2 4.4Å; L439-L451 HydrophobicContact CD2-CD1 4.41Å; L439-L451 HydrophobicContact CD2-CD2 4.49Å; L439-L451 HydrophobicContact CD2-CG 4.44Å; L439-L451 HydrophobicContact CG-CD1 4.43Å; I440-L451 WeakPolarHBondContact O-CA 3.3Å; V441-L451 HydrophobicContact CG2-CD1 3.85Å; L451-I460 HydrophobicContact CB-CB 4.36Å; L451-I460 HydrophobicContact CD2-CB 4.24Å; L451-I460 HydrophobicContact CD2-CD1 4.06Å; L451-I460 HydrophobicContact CD2-CG2 4.09Å; L451-I460 HydrophobicContact CG-CB 4.28Å; L451-I460 HydrophobicContact CG-CD1 3.96Å; L451-I460 WeakPolarHBondContact O-CB 3.49Å; L451-I460 PolarHBondContact O-N 3.23Å; L451-R461 HydrophobicContact CB-CG 4.23Å; L451-R461 HydrophobicContact CD2-CG 4.42Å; L451-R461 PolarHBondContact N-O 2.87Å; L451-R461 PolarHBondContact O-N 3.35Å; L451-L463 HydrophobicContact CB-CD1 4.08Å; L451-L463 HydrophobicContact CB-CD2 4.46Å; L451-L463 HydrophobicContact CB-CG 4.06Å; L451-L463 HydrophobicContact CD1-CD1 4.26Å; L451-L463 HydrophobicContact CD2-CD2 4.48Å
452	W	98	Very high	96.6	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.008	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.4	-178.7	-41.6	79.5	0	0	0	110.7	L419 L439 I440 S442 K450 V458 F459	L419-W452 HydrophobicContact CB-CD2 4.02Å; L419-W452 HydrophobicContact CB-CE3 3.7Å; L419-W452 HydrophobicContact CB-CZ3 3.97Å; L419-W452 HydrophobicContact CD1-CB 3.79Å; L419-W452 HydrophobicContact CD1-CD2 4.13Å; L419-W452 HydrophobicContact CD1-CE3 4.45Å; L419-W452 HydrophobicContact CD1-CG 3.82Å; L439-W452 WeakPolarHBondContact CA-O 3.39Å; I440-W452 HydrophobicContact CB-CB 4.2Å; I440-W452 PolarHBondContact N-O 3.3Å; I440-W452 PolarHBondContact O-N 2.75Å; S442-W452 PolarHBondContact OG-NE1 2.61Å; K450-W452 HydrophobicContact CB-CZ2 3.88Å; K450-W452 HydrophobicContact CD-CH2 4.32Å; K450-W452 HydrophobicContact CD-CZ2 3.6Å; K450-W452 HydrophobicContact CG-CZ2 4.37Å; W452-V458 WeakPolarHBondContact CA-O 3.39Å; W452-F459 HydrophobicContact CD2-CD2 4.34Å; W452-F459 VanDerWaalsContact CE3-CA 3.48Å; W452-F459 HydrophobicContact CE3-CB 3.7Å; W452-F459 HydrophobicContact CE3-CD2 4.13Å; W452-F459 HydrophobicContact CE3-CG 4.43Å; W452-F459 HydrophobicContact CH2-CB 4.34Å; W452-F459 AromaticContact CH2-CD2 3.94Å; W452-F459 HydrophobicContact CH2-CD2 3.94Å; W452-F459 HydrophobicContact CZ2-CD2 4.18Å; W452-F459 HydrophobicContact CZ3-CB 3.56Å; W452-F459 AromaticContact CZ3-CD2 3.94Å; W452-F459 HydrophobicContact CZ3-CD2 3.94Å; W452-F459 HydrophobicContact CZ3-CG 4.22Å
453	D	95.6	Very high	96.5	Very high	18 Å²	18	30.3 Å²	30.3	10%	0.096	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.2	171.1	-165.9	-83.8	0	0	0	109.8	R164 I455 S456 G457 V458 I460	R164-D453 IonicContact CZ-OD2 2.65Å; R164-D453 IonicContact NH2-OD2 2.79Å; R164-D453 PolarHBondContact NH2-OD2 3.01Å; D453-I455 VanDerWaalsContact C-N 3.27Å; D453-I455 PolarHBondContact O-N 3.24Å; D453-I455 WeakPolarHBondContact OD1-CA 3.21Å; D453-I455 WeakPolarHBondContact OD1-CB 3.27Å; D453-I455 PolarHBondContact OD1-N 3.4Å; D453-S456 PolarHBondContact OD1-N 3.39Å; D453-G457 VanDerWaalsContact O-CA 3.3Å; D453-G457 WeakPolarHBondContact O-CA 3.39Å; D453-G457 PolarHBondContact O-N 3.45Å; D453-V458 PolarHBondContact N-O 3.27Å; D453-I460 HydrophobicContact CB-CD1 4Å; D453-I460 HydrophobicContact CB-CG1 4.37Å
454	A	94.8	Very high	96.4	Very high	9 Å²	9	31.1 Å²	31.1	7%	0.074	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-25.8	-178.4	0	0	0	0	0	113.1	H417 F434 G438 I440	H417-A454 PolarHBondContact CD2-O 2.91Å; H417-A454 VanDerWaalsContact CD2-O 3.3Å; F434-A454 HydrophobicContact CD2-CB 4.44Å; F434-A454 HydrophobicContact CE2-CB 3.58Å; F434-A454 HydrophobicContact CZ-CB 4.07Å; G438-A454 WeakPolarHBondContact O-CB 3.37Å; G438-A454 PolarHBondContact O-N 2.91Å; I440-A454 HydrophobicContact CD1-CB 3.59Å; I440-A454 HydrophobicContact CG1-CB 3.95Å
455	I	92	Very high	96.3	Very high	134 Å²	134	39 Å²	39	69%	0.687	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-49.6	-176.2	-60.3	170.4	0	0	0	109.1	H417 D453	H417-I455 PolarHBondContact NE2-O 2.81Å; D453-I455 VanDerWaalsContact C-N 3.27Å; D453-I455 PolarHBondContact O-N 3.24Å; D453-I455 WeakPolarHBondContact OD1-CA 3.21Å; D453-I455 WeakPolarHBondContact OD1-CB 3.27Å; D453-I455 PolarHBondContact OD1-N 3.4Å
456	S	94	Very high	96.3	Very high	64 Å²	64	36.7 Å²	36.7	45%	0.448	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-16.6	-178.8	78.8	0	0	0	0	113.9	D453 V458	D453-S456 PolarHBondContact OD1-N 3.39Å; S456-V458 VanDerWaalsContact C-N 3.27Å; S456-V458 PolarHBondContact O-N 3.38Å; S456-V458 WeakPolarHBondContact OG-CB 3.22Å; S456-V458 WeakPolarHBondContact OG-CG2 3.45Å; S456-V458 PolarHBondContact OG-N 3.14Å
457	G	95.2	Very high	96.3	Very high	17 Å²	17	42.1 Å²	42.1	18%	0.175	22%	0.224	C	C	.	.			trans	72.2	18	-176.8	0	0	0	0	0	114.2	H417 D453	H417-G457 VanDerWaalsContact CG-CA 3.49Å; D453-G457 VanDerWaalsContact O-CA 3.3Å; D453-G457 WeakPolarHBondContact O-CA 3.39Å; D453-G457 PolarHBondContact O-N 3.45Å
458	V	95.6	Very high	96.2	Very high	82 Å²	82	42.5 Å²	42.5	50%	0.497	23%	0.227	S	C	.	.			trans	-103.9	141.4	-170.4	177.7	0	0	0	0	111.1	W452 D453 S456	W452-V458 WeakPolarHBondContact CA-O 3.39Å; D453-V458 PolarHBondContact N-O 3.27Å; S456-V458 VanDerWaalsContact C-N 3.27Å; S456-V458 PolarHBondContact O-N 3.38Å; S456-V458 WeakPolarHBondContact OG-CB 3.22Å; S456-V458 WeakPolarHBondContact OG-CG2 3.45Å; S456-V458 PolarHBondContact OG-N 3.14Å
459	F	97.7	Very high	96	Very high	42 Å²	42	42.7 Å²	42.7	18%	0.184	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	128.7	166.8	173	-100.8	0	0	0	110.8	N423 K450 W452 R461 D462	N423-F459 HydrophobicContact CB-CB 4.18Å; N423-F459 HydrophobicContact CB-CD1 3.52Å; N423-F459 HydrophobicContact CB-CD2 3.69Å; N423-F459 HydrophobicContact CB-CE1 3.64Å; N423-F459 HydrophobicContact CB-CE2 3.81Å; N423-F459 HydrophobicContact CB-CG 3.51Å; N423-F459 HydrophobicContact CB-CZ 3.75Å; N423-F459 VanDerWaalsContact CG-CE1 3.44Å; N423-F459 VanDerWaalsContact ND2-CD1 3.26Å; N423-F459 WeakPolarHBondContact ND2-CD1 3.22Å; K450-F459 HydrophobicContact CB-CE2 4.2Å; K450-F459 HydrophobicContact CD-CE2 4.17Å; K450-F459 HydrophobicContact CG-CE2 4.18Å; W452-F459 HydrophobicContact CD2-CD2 4.34Å; W452-F459 VanDerWaalsContact CE3-CA 3.48Å; W452-F459 HydrophobicContact CE3-CB 3.7Å; W452-F459 HydrophobicContact CE3-CD2 4.13Å; W452-F459 HydrophobicContact CE3-CG 4.43Å; W452-F459 HydrophobicContact CH2-CB 4.34Å; W452-F459 AromaticContact CH2-CD2 3.94Å; W452-F459 HydrophobicContact CH2-CD2 3.94Å; W452-F459 HydrophobicContact CZ2-CD2 4.18Å; W452-F459 HydrophobicContact CZ3-CB 3.56Å; W452-F459 AromaticContact CZ3-CD2 3.94Å; W452-F459 HydrophobicContact CZ3-CD2 3.94Å; W452-F459 HydrophobicContact CZ3-CG 4.22Å; F459-R461 VanDerWaalsContact CE2-C 3.4Å; F459-R461 WeakPolarHBondContact CE2-O 3.37Å; F459-D462 WeakPolarHBondContact CE2-OD1 3.36Å; F459-D462 WeakPolarHBondContact CZ-OD1 3.38Å
460	I	96.6	Very high	95.7	Very high	47 Å²	47	46.9 Å²	46.9	24%	0.241	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-58.6	177.7	-61.5	165.8	0	0	0	110.1	R164 L439 L451 D453	R164-I460 HydrophobicContact CB-CG2 4.24Å; R164-I460 HydrophobicContact CG-CD1 4.3Å; R164-I460 HydrophobicContact CG-CG2 4.46Å; R164-I460 VanDerWaalsContact O-CG2 3.28Å; R164-I460 WeakPolarHBondContact O-CG2 3.43Å; L439-I460 HydrophobicContact CD2-CD1 3.42Å; L439-I460 VanDerWaalsContact CD2-CD1 3.42Å; L451-I460 HydrophobicContact CB-CB 4.36Å; L451-I460 HydrophobicContact CD2-CB 4.24Å; L451-I460 HydrophobicContact CD2-CD1 4.06Å; L451-I460 HydrophobicContact CD2-CG2 4.09Å; L451-I460 HydrophobicContact CG-CB 4.28Å; L451-I460 HydrophobicContact CG-CD1 3.96Å; L451-I460 WeakPolarHBondContact O-CB 3.49Å; L451-I460 PolarHBondContact O-N 3.23Å; D453-I460 HydrophobicContact CB-CD1 4Å; D453-I460 HydrophobicContact CB-CG1 4.37Å
461	R	96.3	Very high	95.5	Very high	68 Å²	68	49.8 Å²	49.8	26%	0.257	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	166	-177.9	65.3	-177.6	-67.2	169.3	-5.5	112.3	R165 G166 L451 F459 L463	R165-R461 VanDerWaalsContact C-NH1 3.32Å; R165-R461 PolarHBondContact O-NH1 2.75Å; G166-R461 PolarHBondContact O-NH1 2.73Å; L451-R461 HydrophobicContact CB-CG 4.23Å; L451-R461 HydrophobicContact CD2-CG 4.42Å; L451-R461 PolarHBondContact N-O 2.87Å; L451-R461 PolarHBondContact O-N 3.35Å; F459-R461 VanDerWaalsContact CE2-C 3.4Å; F459-R461 WeakPolarHBondContact CE2-O 3.37Å; R461-L463 HydrophobicContact CG-CD2 4.14Å
462	D	96.1	Very high	95.3	Very high	33 Å²	33	51.3 Å²	51.3	18%	0.176	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	132	159.4	-65	-20.8	0	0	0	108.6	K450 F459 R465	K450-D462 WeakPolarHBondContact CG-OD1 3.42Å; K450-D462 IonicContact NZ-OD1 3.19Å; K450-D462 PolarHBondContact NZ-OD1 3.03Å; K450-D462 IonicContact NZ-OD2 3.3Å; F459-D462 WeakPolarHBondContact CE2-OD1 3.36Å; F459-D462 WeakPolarHBondContact CZ-OD1 3.38Å; D462-R465 IonicContact OD2-CZ 3.96Å; D462-R465 IonicContact OD2-NE 2.62Å; D462-R465 PolarHBondContact OD2-NE 3.45Å; D462-R465 IonicContact OD2-NH2 3.63Å; D462-R465 PolarHBondContact OD2-NH2 2.79Å
463	L	96.5	Very high	95.2	Very high	25 Å²	25	51.2 Å²	51.2	13%	0.131	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-38.5	170.9	-65.2	175.8	0	0	0	110.9	W163 V441 V449 L451 R461 L485 M503 F505	W163-L463 HydrophobicContact CE3-CD1 4.02Å; W163-L463 HydrophobicContact CZ3-CD1 3.7Å; V441-L463 HydrophobicContact CG1-CD1 4.11Å; V449-L463 HydrophobicContact CB-CB 4.47Å; V449-L463 HydrophobicContact CG1-CB 4.34Å; V449-L463 HydrophobicContact CG1-CD1 4.41Å; V449-L463 PolarHBondContact O-N 3.49Å; L451-L463 HydrophobicContact CB-CD1 4.08Å; L451-L463 HydrophobicContact CB-CD2 4.46Å; L451-L463 HydrophobicContact CB-CG 4.06Å; L451-L463 HydrophobicContact CD1-CD1 4.26Å; L451-L463 HydrophobicContact CD2-CD2 4.48Å; R461-L463 HydrophobicContact CG-CD2 4.14Å; L463-L485 HydrophobicContact CB-CD2 4.25Å; L463-L485 HydrophobicContact CD1-CD2 3.59Å; L463-M503 HydrophobicContact CB-CE 4.28Å; L463-F505 HydrophobicContact CD2-CE1 4.41Å; L463-F505 HydrophobicContact CD2-CZ 4.12Å
464	I	96.3	Very high	95.2	Very high	17 Å²	17	50.8 Å²	50.8	9%	0.087	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	139.4	174.5	-53.6	-178	0	0	0	107.7	C448 V449 L466 I475 C487 L501 M503	C448-I464 CarbonylContact C-O 3.54Å; C448-I464 VanDerWaalsContact CA-O 3.24Å; C448-I464 WeakPolarHBondContact CA-O 3.32Å; V449-I464 HydrophobicContact CB-CB 3.92Å; V449-I464 HydrophobicContact CB-CD1 4.31Å; V449-I464 HydrophobicContact CB-CG1 4.05Å; V449-I464 HydrophobicContact CG2-CB 3.98Å; V449-I464 HydrophobicContact CG2-CD1 3.86Å; V449-I464 HydrophobicContact CG2-CG1 4.1Å; V449-I464 PolarHBondContact N-O 2.78Å; V449-I464 PolarHBondContact O-N 3.04Å; I464-L466 HydrophobicContact CG2-CD2 4.08Å; I464-L466 HydrophobicContact CG2-CG 4.34Å; I464-I475 HydrophobicContact CG2-CD1 4.39Å; I464-C487 HydrophobicContact CD1-CB 4.08Å; I464-L501 HydrophobicContact CD1-CB 4.5Å; I464-L501 HydrophobicContact CD1-CD1 3.95Å; I464-L501 HydrophobicContact CG2-CD1 4.39Å; I464-M503 HydrophobicContact CD1-CE 3.61Å; I464-M503 HydrophobicContact CD1-SD 4.46Å; I464-M503 HydrophobicContact CG1-CE 3.53Å; I464-M503 HydrophobicContact CG1-SD 4.08Å
465	R	96.4	Very high	95.4	Very high	167 Å²	167	50.4 Å²	50.4	63%	0.63	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	103.9	165.2	-179.2	-179.3	-70.2	-151.1	0.1	108	D462	D462-R465 IonicContact OD2-CZ 3.96Å; D462-R465 IonicContact OD2-NE 2.62Å; D462-R465 PolarHBondContact OD2-NE 3.45Å; D462-R465 IonicContact OD2-NH2 3.63Å; D462-R465 PolarHBondContact OD2-NH2 2.79Å
466	L	96.6	Very high	95.6	Very high	15 Å²	15	45.1 Å²	45.1	8%	0.079	28%	0.276	C	S	.	.			trans	-67.7	132.8	178.1	-63.1	177	0	0	0	110	G447 I464 S468 G469 I475 V489 E496	G447-L466 WeakPolarHBondContact O-CG 3.21Å; G447-L466 PolarHBondContact O-N 2.84Å; I464-L466 HydrophobicContact CG2-CD2 4.08Å; I464-L466 HydrophobicContact CG2-CG 4.34Å; L466-S468 PolarHBondContact O-N 2.73Å; L466-G469 PolarHBondContact O-N 3.45Å; L466-I475 HydrophobicContact CD1-CD1 3.71Å; L466-I475 HydrophobicContact CD1-CG1 4.34Å; L466-I475 HydrophobicContact CD2-CD1 4.41Å; L466-I475 HydrophobicContact CG-CD1 4.05Å; L466-V489 HydrophobicContact CD1-CG1 3.57Å; L466-V489 HydrophobicContact CD2-CG1 4.04Å; L466-V489 HydrophobicContact CG-CG1 4.43Å; L466-E496 HydrophobicContact CD1-CG 4.35Å
467	P	95.6	Very high	95.8	Very high	134 Å²	134	45.3 Å²	45.3	87%	0.87	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-30	171.1	-24.9	34.9	0	0	0	112.8
468	S	95.5	Very high	95.9	Very high	8 Å²	8	44.5 Å²	44.5	6%	0.056	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	3.9	178.9	57.5	0	0	0	0	114.7	L466 G470 S471 G472 G473 E496	L466-S468 PolarHBondContact O-N 2.73Å; S468-G470 PolarHBondContact O-N 2.73Å; S468-G470 VanDerWaalsContact O-N 3.12Å; S468-S471 WeakPolarHBondContact CA-OG 3.31Å; S468-S471 CarbonylContact O-C 3.55Å; S468-S471 PolarHBondContact O-N 2.82Å; S468-S471 PolarHBondContact O-OG 3.32Å; S468-S471 VanDerWaalsContact O-OG 3.13Å; S468-G472 PolarHBondContact O-N 3.47Å; S468-G472 VanDerWaalsContact O-N 3.14Å; S468-G473 PolarHBondContact O-N 2.92Å; S468-G473 WeakPolarHBondContact OG-CA 3.32Å; S468-E496 VanDerWaalsContact CB-OE2 3.28Å; S468-E496 WeakPolarHBondContact CB-OE2 3.17Å; S468-E496 VanDerWaalsContact OG-CD 3.28Å; S468-E496 PolarHBondContact OG-OE2 3.29Å
469	G	93.3	Very high	96	Very high	12 Å²	12	42.8 Å²	42.8	12%	0.124	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.2	-175.2	0	0	0	0	0	114.8	D446 L466 G473	D446-G469 WeakPolarHBondContact O-CA 3.39Å; L466-G469 PolarHBondContact O-N 3.45Å; G469-G473 WeakPolarHBondContact CA-O 3.22Å
470	G	91.6	Very high	95.8	Very high	89 Å²	89	41.5 Å²	41.5	92%	0.918	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-6.8	175.4	0	0	0	0	0	115	S468	S468-G470 PolarHBondContact O-N 2.73Å; S468-G470 VanDerWaalsContact O-N 3.12Å
471	S	94.2	Very high	95.6	Very high	63 Å²	63	41.5 Å²	41.5	44%	0.441	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.6	10.9	-174.8	60.3	0	0	0	0	113.6	S468 N493 T495	S468-S471 WeakPolarHBondContact CA-OG 3.31Å; S468-S471 CarbonylContact O-C 3.55Å; S468-S471 PolarHBondContact O-N 2.82Å; S468-S471 PolarHBondContact O-OG 3.32Å; S468-S471 VanDerWaalsContact O-OG 3.13Å; S471-N493 PolarHBondContact O-ND2 3.24Å; S471-T495 WeakPolarHBondContact O-CG2 3.48Å; S471-T495 PolarHBondContact O-OG1 3.36Å
472	G	93.7	Very high	95.2	Very high	31 Å²	31	40.9 Å²	40.9	32%	0.32	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	121.2	-11.3	172.3	0	0	0	0	0	114.9	S468 C474 S491	S468-G472 PolarHBondContact O-N 3.47Å; S468-G472 VanDerWaalsContact O-N 3.14Å; G472-C474 PolarHBondContact O-N 3.2Å; G472-S491 WeakPolarHBondContact O-CB 3.46Å
473	G	95.9	Very high	94.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.243	C	C	.	.			trans	-64	124	172.2	0	0	0	0	0	111	S468 G469	S468-G473 PolarHBondContact O-N 2.92Å; S468-G473 WeakPolarHBondContact OG-CA 3.32Å; G469-G473 WeakPolarHBondContact CA-O 3.22Å
474	C	95.9	Very high	94.7	Very high	10 Å²	10	39.5 Å²	39.5	7%	0.068	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	153.5	-173	57.5	0	0	0	0	111.2	D445 G472 W476 V489 G490	D445-C474 HydrophobicContact CB-CB 4.49Å; G472-C474 PolarHBondContact O-N 3.2Å; C474-W476 VanDerWaalsContact SG-CD1 3.52Å; C474-W476 PolarHBondContact SG-NE1 2.92Å; C474-V489 WeakPolarHBondContact O-CA 3.42Å; C474-G490 PolarHBondContact N-O 3.12Å; C474-G490 PolarHBondContact O-N 3.16Å; C474-G490 VanDerWaalsContact O-N 3.15Å; C474-G490 PolarHBondContact SG-O 3.2Å
475	I	97.6	Very high	94.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	101.8	173	-50.2	-68.5	0	0	0	106.7	T430 S443 S444 V449 I464 L466 C487 A488 V489	T430-I475 WeakPolarHBondContact CB-O 3.36Å; T430-I475 PolarHBondContact OG1-O 3.29Å; S443-I475 VanDerWaalsContact CB-CG2 3.41Å; S444-I475 PolarHBondContact O-N 2.97Å; V449-I475 HydrophobicContact CG2-CB 4.35Å; V449-I475 HydrophobicContact CG2-CD1 4.31Å; V449-I475 HydrophobicContact CG2-CG1 3.92Å; V449-I475 HydrophobicContact CG2-CG2 3.88Å; I464-I475 HydrophobicContact CG2-CD1 4.39Å; L466-I475 HydrophobicContact CD1-CD1 3.71Å; L466-I475 HydrophobicContact CD1-CG1 4.34Å; L466-I475 HydrophobicContact CD2-CD1 4.41Å; L466-I475 HydrophobicContact CG-CD1 4.05Å; I475-C487 HydrophobicContact CG2-CB 4.09Å; I475-A488 CarbonylContact C-O 3.51Å; I475-V489 HydrophobicContact CD1-CB 4.22Å; I475-V489 HydrophobicContact CD1-CG1 4.01Å; I475-V489 HydrophobicContact CD1-CG2 3.4Å
476	W	97.4	Very high	94.8	Very high	24 Å²	24	30.9 Å²	30.9	9%	0.091	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-44	-173.6	-61.2	-51.4	0	0	0	112.6	V181 I182 T430 C474 A488 V489 G490 T498	V181-W476 HydrophobicContact CB-CH2 4.47Å; V181-W476 HydrophobicContact CB-CZ2 4.35Å; V181-W476 HydrophobicContact CG1-CD2 3.87Å; V181-W476 HydrophobicContact CG1-CE3 4.22Å; V181-W476 HydrophobicContact CG1-CG 4.26Å; V181-W476 HydrophobicContact CG1-CH2 4.49Å; V181-W476 HydrophobicContact CG1-CZ2 4.2Å; V181-W476 HydrophobicContact CG2-CH2 4.47Å; V181-W476 HydrophobicContact CG2-CZ2 4.02Å; I182-W476 HydrophobicContact CB-CE3 3.97Å; I182-W476 HydrophobicContact CB-CZ3 4.08Å; I182-W476 HydrophobicContact CG1-CZ3 4.16Å; I182-W476 VanDerWaalsContact N-CZ3 3.33Å; T430-W476 WeakPolarHBondContact CB-O 3.31Å; T430-W476 PolarHBondContact OG1-O 2.75Å; C474-W476 VanDerWaalsContact SG-CD1 3.52Å; C474-W476 PolarHBondContact SG-NE1 2.92Å; W476-A488 HydrophobicContact CE3-CB 4.45Å; W476-A488 PolarHBondContact N-O 2.89Å; W476-V489 WeakPolarHBondContact CZ3-O 3.23Å; W476-G490 VanDerWaalsContact CH2-CA 3.43Å; W476-T498 HydrophobicContact CH2-CG2 4.07Å; W476-T498 HydrophobicContact CZ3-CG2 3.84Å
477	R	97.2	Very high	94.8	Very high	67 Å²	67	30.1 Å²	30.1	25%	0.253	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	151.2	-174	-58.4	-170.7	67.3	173.8	-5.1	111.1	T183 A488	T183-R477 VanDerWaalsContact O-CD 3.23Å; T183-R477 WeakPolarHBondContact O-CD 2.86Å; T183-R477 PolarHBondContact O-NH1 3.15Å; R477-A488 PolarHBondContact O-N 2.94Å
478	L	97.6	Very high	95	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	158.7	171.5	57.7	66.3	0	0	0	113.1	S431 Q433 V441 V449 L485 I486	S431-L478 PolarHBondContact OG-N 3.42Å; Q433-L478 HydrophobicContact CB-CD1 3.99Å; Q433-L478 HydrophobicContact CG-CD1 3.34Å; V441-L478 HydrophobicContact CB-CD2 4.43Å; V441-L478 HydrophobicContact CG1-CD2 3.68Å; V449-L478 HydrophobicContact CG1-CD2 3.81Å; L478-L485 HydrophobicContact CB-CD1 4.13Å; L478-L485 HydrophobicContact CD2-CD1 4.21Å; L478-I486 CarbonylContact C-O 3.53Å; L478-I486 VanDerWaalsContact CA-O 3.22Å; L478-I486 WeakPolarHBondContact CA-O 3.46Å; L478-I486 WeakPolarHBondContact CB-O 3.38Å
479	R	97.5	Very high	95.1	Very high	46 Å²	46	23.4 Å²	23.4	17%	0.174	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	139.6	169.3	-73.1	-71	-176.5	-111.8	11.3	107.3	L185 V187 I486	L185-R479 HydrophobicContact CB-CG 4.48Å; L185-R479 HydrophobicContact CD2-CB 4.28Å; L185-R479 HydrophobicContact CD2-CG 3.96Å; L185-R479 HydrophobicContact CG-CG 4Å; L185-R479 PolarHBondContact O-NE 3.33Å; L185-R479 PolarHBondContact O-NH2 3.47Å; V187-R479 HydrophobicContact CB-CB 4.48Å; V187-R479 HydrophobicContact CG2-CB 3.57Å; V187-R479 HydrophobicContact CG2-CG 3.97Å; R479-I486 HydrophobicContact CB-CB 4.41Å; R479-I486 PolarHBondContact N-O 3.31Å; R479-I486 PolarHBondContact O-N 2.86Å
480	A	95	Very high	95.3	Very high	15 Å²	15	22.8 Å²	22.8	12%	0.124	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131.6	178.4	0	0	0	0	0	108.6	W163 Q433 L435 V441 A484 L485	W163-A480 HydrophobicContact CH2-CB 4.18Å; Q433-A480 HydrophobicContact CB-CB 3.97Å; Q433-A480 HydrophobicContact CG-CB 4.12Å; L435-A480 HydrophobicContact CD2-CB 3.79Å; L435-A480 HydrophobicContact CG-CB 4.47Å; V441-A480 HydrophobicContact CG2-CB 4.39Å; A480-A484 CarbonylContact C-O 3.45Å; A480-A484 VanDerWaalsContact CA-O 3.27Å; A480-A484 WeakPolarHBondContact CA-O 3.42Å; A480-L485 HydrophobicContact CB-CD1 4.22Å
481	T	90.8	Very high	95.5	Very high	48 Å²	48	18.9 Å²	18.9	29%	0.294	11%	0.108	S	C	.	.			trans	-97.1	-174.1	165.2	70.9	0	0	0	0	108.1	V187 L435 T483 A484	V187-T481 HydrophobicContact CG1-CG2 4.24Å; L435-T481 WeakPolarHBondContact CD2-O 3.28Å; T481-T483 PolarHBondContact O-N 3.3Å; T481-T483 PolarHBondContact OG1-N 3.48Å; T481-T483 PolarHBondContact OG1-OG1 3.37Å; T481-A484 PolarHBondContact N-O 3.46Å; T481-A484 PolarHBondContact OG1-N 3.28Å
482	M	88	Confident	95.5	Very high	55 Å²	55	26.6 Å²	26.6	27%	0.271	13%	0.127	S	C	.	.	S	Bend	trans	-68.2	-21.4	172.6	-67.4	-85.9	58.3	0	0	113.2	V159 W163 L435 P436 N437	V159-M482 WeakPolarHBondContact CG1-O 3.3Å; W163-M482 PolarHBondContact NE1-O 2.76Å; L435-M482 HydrophobicContact CB-CE 3.62Å; L435-M482 HydrophobicContact CD1-CE 3.96Å; L435-M482 HydrophobicContact CD2-CE 4.13Å; L435-M482 HydrophobicContact CG-CE 4.12Å; P436-M482 HydrophobicContact CB-SD 3.8Å; P436-M482 VanDerWaalsContact CD-SD 3.55Å; P436-M482 HydrophobicContact CG-CE 4.38Å; P436-M482 HydrophobicContact CG-CG 4.31Å; P436-M482 HydrophobicContact CG-SD 3.61Å; N437-M482 HydrophobicContact CB-CE 4.25Å
483	T	89.3	Confident	95.5	Very high	27 Å²	27	29.7 Å²	29.7	17%	0.166	14%	0.137	C	C	.	.	S	Bend	trans	-116.7	-16.4	-171.5	53.5	0	0	0	0	113.2	V159 T481 F505 D506	V159-T483 HydrophobicContact CG1-CG2 4.42Å; T481-T483 PolarHBondContact O-N 3.3Å; T481-T483 PolarHBondContact OG1-N 3.48Å; T481-T483 PolarHBondContact OG1-OG1 3.37Å; T483-F505 WeakPolarHBondContact O-CA 3.27Å; T483-F505 WeakPolarHBondContact O-CB 3.42Å; T483-F505 PolarHBondContact O-N 3.02Å; T483-D506 HydrophobicContact CG2-CB 3.74Å; T483-D506 VanDerWaalsContact CG2-OD2 3.23Å; T483-D506 WeakPolarHBondContact CG2-OD2 3.23Å
484	A	93	Very high	95.3	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.008	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	156.4	-178	0	0	0	0	0	114.2	A480 T481 I486 M503 L510	A480-A484 CarbonylContact C-O 3.45Å; A480-A484 VanDerWaalsContact CA-O 3.27Å; A480-A484 WeakPolarHBondContact CA-O 3.42Å; T481-A484 PolarHBondContact N-O 3.46Å; T481-A484 PolarHBondContact OG1-N 3.28Å; A484-I486 HydrophobicContact CB-CD1 4.1Å; A484-M503 CarbonylContact C-O 3.59Å; A484-M503 WeakPolarHBondContact CA-O 3.08Å; A484-M503 WeakPolarHBondContact CB-O 3.49Å; A484-L510 HydrophobicContact CB-CD1 4.37Å; A484-L510 HydrophobicContact CB-CD2 3.5Å; A484-L510 VanDerWaalsContact CB-CD2 3.5Å
485	L	96.6	Very high	95.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.9	169.9	175.6	54.4	0	0	0	109.4	W163 V441 V449 L463 L478 A480 V502 M503 F505	W163-L485 HydrophobicContact CH2-CB 3.75Å; W163-L485 HydrophobicContact CZ3-CB 4.25Å; W163-L485 HydrophobicContact CZ3-CD2 4.41Å; V441-L485 HydrophobicContact CG1-CD1 3.93Å; V441-L485 HydrophobicContact CG1-CD2 3.99Å; V449-L485 HydrophobicContact CG1-CD2 3.77Å; L463-L485 HydrophobicContact CB-CD2 4.25Å; L463-L485 HydrophobicContact CD1-CD2 3.59Å; L478-L485 HydrophobicContact CB-CD1 4.13Å; L478-L485 HydrophobicContact CD2-CD1 4.21Å; A480-L485 HydrophobicContact CB-CD1 4.22Å; L485-V502 CarbonylContact O-C 3.55Å; L485-V502 WeakPolarHBondContact O-CA 3.39Å; L485-M503 HydrophobicContact CB-CB 4.38Å; L485-M503 HydrophobicContact CB-CE 3.97Å; L485-M503 HydrophobicContact CD2-CE 3.19Å; L485-M503 HydrophobicContact CG-CE 3.69Å; L485-M503 PolarHBondContact N-O 2.87Å; L485-M503 PolarHBondContact O-N 3.24Å; L485-F505 HydrophobicContact CB-CE2 3.99Å
486	I	97.8	Very high	95.2	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.015	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	122.8	178.1	-56.1	79.3	0	0	0	107.9	L185 V187 I192 L478 R479 A484 I500 L501 V502	L185-I486 HydrophobicContact CD1-CG2 4.26Å; L185-I486 HydrophobicContact CD2-CG2 4.01Å; V187-I486 HydrophobicContact CG1-CD1 4.38Å; V187-I486 HydrophobicContact CG2-CB 4.32Å; V187-I486 HydrophobicContact CG2-CD1 3.94Å; V187-I486 HydrophobicContact CG2-CG1 4.04Å; I192-I486 HydrophobicContact CD1-CG1 3.87Å; I192-I486 HydrophobicContact CD1-CG2 3.86Å; I192-I486 HydrophobicContact CG1-CG1 4.23Å; I192-I486 HydrophobicContact CG1-CG2 4.29Å; I192-I486 HydrophobicContact CG2-CG2 4.14Å; L478-I486 CarbonylContact C-O 3.53Å; L478-I486 VanDerWaalsContact CA-O 3.22Å; L478-I486 WeakPolarHBondContact CA-O 3.46Å; L478-I486 WeakPolarHBondContact CB-O 3.38Å; R479-I486 HydrophobicContact CB-CB 4.41Å; R479-I486 PolarHBondContact N-O 3.31Å; R479-I486 PolarHBondContact O-N 2.86Å; A484-I486 HydrophobicContact CB-CD1 4.1Å; I486-I500 HydrophobicContact CG2-CG2 3.37Å; I486-L501 CarbonylContact C-O 3.6Å; I486-L501 WeakPolarHBondContact CA-O 3.49Å; I486-V502 HydrophobicContact CG1-CG1 4.43Å; I486-V502 HydrophobicContact CG1-CG2 4.24Å; I486-V502 HydrophobicContact CG2-CG2 4.23Å
487	C	98.3	Very high	95.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.6	-176.3	-64.8	0	0	0	0	110.9	I464 I475 V489 I500 L501	I464-C487 HydrophobicContact CD1-CB 4.08Å; I475-C487 HydrophobicContact CG2-CB 4.09Å; C487-V489 HydrophobicContact CB-CG2 4.17Å; C487-I500 CarbonylContact O-C 3.58Å; C487-I500 VanDerWaalsContact O-CA 3.26Å; C487-I500 WeakPolarHBondContact O-CA 3.34Å; C487-L501 HydrophobicContact CB-CB 4.42Å; C487-L501 PolarHBondContact N-O 3.45Å; C487-L501 PolarHBondContact O-N 3.2Å
488	A	98.4	Very high	95.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	122.6	169.3	0	0	0	0	0	109.5	I182 L185 I475 W476 R477	I182-A488 HydrophobicContact CB-CB 3.85Å; I182-A488 HydrophobicContact CD1-CB 4.02Å; I182-A488 HydrophobicContact CG2-CB 3.67Å; L185-A488 HydrophobicContact CD2-CB 4.41Å; I475-A488 CarbonylContact C-O 3.51Å; W476-A488 HydrophobicContact CE3-CB 4.45Å; W476-A488 PolarHBondContact N-O 2.89Å; R477-A488 PolarHBondContact O-N 2.94Å
489	V	98.2	Very high	95.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	147.2	-168	-176.3	0	0	0	0	110	L466 C474 I475 W476 C487 E496 T498 K499 L501	L466-V489 HydrophobicContact CD1-CG1 3.57Å; L466-V489 HydrophobicContact CD2-CG1 4.04Å; L466-V489 HydrophobicContact CG-CG1 4.43Å; C474-V489 WeakPolarHBondContact O-CA 3.42Å; I475-V489 HydrophobicContact CD1-CB 4.22Å; I475-V489 HydrophobicContact CD1-CG1 4.01Å; I475-V489 HydrophobicContact CD1-CG2 3.4Å; W476-V489 WeakPolarHBondContact CZ3-O 3.23Å; C487-V489 HydrophobicContact CB-CG2 4.17Å; V489-E496 HydrophobicContact CG1-CG 3.92Å; V489-T498 CarbonylContact O-C 3.5Å; V489-T498 VanDerWaalsContact O-CA 3.3Å; V489-T498 WeakPolarHBondContact O-CA 3.1Å; V489-K499 HydrophobicContact CB-CG 4.16Å; V489-K499 PolarHBondContact N-O 2.88Å; V489-K499 PolarHBondContact O-N 3.46Å; V489-K499 VanDerWaalsContact O-O 3.12Å; V489-L501 HydrophobicContact CG2-CD1 3.86Å; V489-L501 HydrophobicContact CG2-CG 4Å
490	G	97.4	Very high	95.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.4	-163.8	166	0	0	0	0	0	111.1	C474 W476 E496	C474-G490 PolarHBondContact N-O 3.12Å; C474-G490 PolarHBondContact O-N 3.16Å; C474-G490 VanDerWaalsContact O-N 3.15Å; C474-G490 PolarHBondContact SG-O 3.2Å; W476-G490 VanDerWaalsContact CH2-CA 3.43Å; G490-E496 CarbonylContact C-O 3.53Å; G490-E496 WeakPolarHBondContact CA-O 3.32Å
491	S	96.7	Very high	95.4	Very high	7 Å²	7	33.2 Å²	33.2	5%	0.049	17%	0.173	C	C	.	.			trans	-142.8	163.1	172.1	73.6	0	0	0	0	111.6	G472 N493 G494 T495 E496	G472-S491 WeakPolarHBondContact O-CB 3.46Å; S491-N493 VanDerWaalsContact C-N 3.34Å; S491-N493 WeakPolarHBondContact CB-OD1 3.32Å; S491-N493 PolarHBondContact OG-OD1 3.11Å; S491-G494 PolarHBondContact OG-N 3.1Å; S491-T495 PolarHBondContact OG-N 2.91Å; S491-T495 PolarHBondContact OG-OG1 2.95Å; S491-E496 PolarHBondContact N-O 3.09Å; S491-E496 PolarHBondContact OG-N 3.49Å; S491-E496 PolarHBondContact OG-O 3.35Å
492	R	92.3	Very high	95.7	Very high	224 Å²	224	31 Å²	31	85%	0.845	16%	0.159	S	C	*	.	S	Bend	trans	-88.1	-5.8	175.7	-64.1	-177.1	-176	164.6	5.3	113.4
493	N	93.8	Very high	96	Very high	97 Å²	97	28.5 Å²	28.5	52%	0.519	15%	0.147	S	C	.	.	S	Bend	trans	-125.3	13.4	-171.5	64.8	-8.7	0	0	0	112.6	S471 S491 T495	S471-N493 PolarHBondContact O-ND2 3.24Å; S491-N493 VanDerWaalsContact C-N 3.34Å; S491-N493 WeakPolarHBondContact CB-OD1 3.32Å; S491-N493 PolarHBondContact OG-OD1 3.11Å; N493-T495 VanDerWaalsContact C-N 3.26Å; N493-T495 PolarHBondContact O-N 3.22Å; N493-T495 PolarHBondContact OD1-N 2.63Å; N493-T495 PolarHBondContact OD1-OG1 3.32Å
494	G	93.2	Very high	96.1	Very high	38 Å²	38	27.4 Å²	27.4	39%	0.392	14%	0.14	S	C	.	.	S	Bend	trans	74.7	2.6	176.9	0	0	0	0	0	115.6	S491 E496	S491-G494 PolarHBondContact OG-N 3.1Å; G494-E496 PolarHBondContact O-N 3.07Å
495	T	95.6	Very high	96.1	Very high	60 Å²	60	27.4 Å²	27.4	37%	0.368	14%	0.14	S	C	.	.	S	Bend	trans	-70.2	-15.7	176.5	56.9	0	0	0	0	114.5	S471 S491 N493	S471-T495 WeakPolarHBondContact O-CG2 3.48Å; S471-T495 PolarHBondContact O-OG1 3.36Å; S491-T495 PolarHBondContact OG-N 2.91Å; S491-T495 PolarHBondContact OG-OG1 2.95Å; N493-T495 VanDerWaalsContact C-N 3.26Å; N493-T495 PolarHBondContact O-N 3.22Å; N493-T495 PolarHBondContact OD1-N 2.63Å; N493-T495 PolarHBondContact OD1-OG1 3.32Å
496	E	96.1	Very high	95.6	Very high	32 Å²	32	28 Å²	28	15%	0.15	14%	0.143	C	C	.	.	S	Bend	trans	-145.9	113.8	-179.2	-168.9	70	-157.3	0	0	108.9	L466 S468 V489 G490 S491 G494 T498 K499	L466-E496 HydrophobicContact CD1-CG 4.35Å; S468-E496 VanDerWaalsContact CB-OE2 3.28Å; S468-E496 WeakPolarHBondContact CB-OE2 3.17Å; S468-E496 VanDerWaalsContact OG-CD 3.28Å; S468-E496 PolarHBondContact OG-OE2 3.29Å; V489-E496 HydrophobicContact CG1-CG 3.92Å; G490-E496 CarbonylContact C-O 3.53Å; G490-E496 WeakPolarHBondContact CA-O 3.32Å; S491-E496 PolarHBondContact N-O 3.09Å; S491-E496 PolarHBondContact OG-N 3.49Å; S491-E496 PolarHBondContact OG-O 3.35Å; G494-E496 PolarHBondContact O-N 3.07Å; E496-T498 PolarHBondContact O-N 2.82Å; E496-K499 VanDerWaalsContact OE1-CE 3.28Å; E496-K499 WeakPolarHBondContact OE1-CE 3.44Å; E496-K499 IonicContact OE1-NZ 2.75Å; E496-K499 PolarHBondContact OE1-NZ 2.87Å
497	D	96.6	Very high	94.1	Very high	80 Å²	80	34.1 Å²	34.1	43%	0.428	18%	0.176	S	C	.	.			trans	-56.6	141	177.7	-57.4	-25.9	0	0	0	111.3	R175 K499	R175-D497 IonicContact CZ-OD2 3.67Å; R175-D497 IonicContact NH1-OD2 2.79Å; R175-D497 PolarHBondContact NH1-OD2 3.35Å; R175-D497 IonicContact NH2-OD2 3.79Å; D497-K499 PolarHBondContact O-N 2.58Å; D497-K499 PolarHBondContact O-NZ 3.15Å
498	T	97.9	Very high	92.3	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.018	19%	0.187	C	C	.	.			trans	-64.3	125.2	171.6	-61.3	0	0	0	0	111.1	G176 H177 H180 I182 W476 V489 E496	G176-T498 WeakPolarHBondContact O-CG2 3.32Å; H177-T498 HydrophobicContact CB-CG2 3.93Å; H177-T498 WeakPolarHBondContact O-CB 3.33Å; H177-T498 WeakPolarHBondContact O-CG2 3.36Å; H177-T498 PolarHBondContact O-OG1 3.48Å; H180-T498 WeakPolarHBondContact O-CB 3.41Å; H180-T498 VanDerWaalsContact O-CG2 3.27Å; H180-T498 WeakPolarHBondContact O-CG2 3.19Å; H180-T498 PolarHBondContact O-OG1 3.33Å; I182-T498 HydrophobicContact CD1-CG2 3.85Å; I182-T498 HydrophobicContact CG1-CG2 3.81Å; W476-T498 HydrophobicContact CH2-CG2 4.07Å; W476-T498 HydrophobicContact CZ3-CG2 3.84Å; V489-T498 CarbonylContact O-C 3.5Å; V489-T498 VanDerWaalsContact O-CA 3.3Å; V489-T498 WeakPolarHBondContact O-CA 3.1Å; E496-T498 PolarHBondContact O-N 2.82Å
499	K	97.8	Very high	89.9	Confident	12 Å²	12	39.9 Å²	39.9	5%	0.052	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	167.3	-178.2	60.1	-171	164	-75.7	0	111.8	L173 L174 V489 E496 D497 L501	L173-K499 HydrophobicContact CD1-CD 3.68Å; L173-K499 HydrophobicContact CD2-CB 4.26Å; L173-K499 HydrophobicContact CD2-CD 3.95Å; L173-K499 HydrophobicContact CG-CD 3.74Å; L174-K499 CarbonylContact O-C 3.51Å; L174-K499 VanDerWaalsContact O-CA 3.32Å; L174-K499 WeakPolarHBondContact O-CA 3.32Å; L174-K499 WeakPolarHBondContact O-CB 3.2Å; V489-K499 HydrophobicContact CB-CG 4.16Å; V489-K499 PolarHBondContact N-O 2.88Å; V489-K499 PolarHBondContact O-N 3.46Å; V489-K499 VanDerWaalsContact O-O 3.12Å; E496-K499 VanDerWaalsContact OE1-CE 3.28Å; E496-K499 WeakPolarHBondContact OE1-CE 3.44Å; E496-K499 IonicContact OE1-NZ 2.75Å; E496-K499 PolarHBondContact OE1-NZ 2.87Å; D497-K499 PolarHBondContact O-N 2.58Å; D497-K499 PolarHBondContact O-NZ 3.15Å; K499-L501 HydrophobicContact CD-CD2 4.23Å
500	I	98.2	Very high	87.2	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.1	166.1	-54.7	167.9	0	0	0	108.3	L174 I182 L185 I192 W204 I486 C487 V502	L174-I500 HydrophobicContact CB-CB 4.07Å; L174-I500 HydrophobicContact CD2-CB 4.43Å; L174-I500 PolarHBondContact N-O 3.28Å; L174-I500 PolarHBondContact O-N 3.27Å; I182-I500 HydrophobicContact CD1-CD1 4.41Å; I182-I500 HydrophobicContact CD1-CG1 3.74Å; L185-I500 HydrophobicContact CD1-CD1 4.28Å; I192-I500 HydrophobicContact CG2-CD1 4.15Å; W204-I500 HydrophobicContact CZ2-CD1 4.38Å; I486-I500 HydrophobicContact CG2-CG2 3.37Å; C487-I500 CarbonylContact O-C 3.58Å; C487-I500 VanDerWaalsContact O-CA 3.26Å; C487-I500 WeakPolarHBondContact O-CA 3.34Å; I500-V502 HydrophobicContact CG2-CG2 4.19Å
501	L	97.5	Very high	86.7	Confident	9 Å²	9	45.4 Å²	45.4	5%	0.047	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.2	169.2	-61.5	177.2	0	0	0	108.7	L173 I464 I486 C487 V489 K499	L173-L501 HydrophobicContact CB-CD2 4.34Å; L173-L501 HydrophobicContact CD1-CD2 4.21Å; L173-L501 HydrophobicContact CG-CD2 4.06Å; I464-L501 HydrophobicContact CD1-CB 4.5Å; I464-L501 HydrophobicContact CD1-CD1 3.95Å; I464-L501 HydrophobicContact CG2-CD1 4.39Å; I486-L501 CarbonylContact C-O 3.6Å; I486-L501 WeakPolarHBondContact CA-O 3.49Å; C487-L501 HydrophobicContact CB-CB 4.42Å; C487-L501 PolarHBondContact N-O 3.45Å; C487-L501 PolarHBondContact O-N 3.2Å; V489-L501 HydrophobicContact CG2-CD1 3.86Å; V489-L501 HydrophobicContact CG2-CG 4Å; K499-L501 HydrophobicContact CD-CD2 4.23Å
502	V	96.7	Very high	86.2	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	119.7	175.6	179.2	0	0	0	0	108.2	E171 L172 L174 I192 L485 I486 I500	E171-V502 CarbonylContact C-O 3.49Å; E171-V502 VanDerWaalsContact CA-O 3.28Å; E171-V502 WeakPolarHBondContact CA-O 3.24Å; L172-V502 HydrophobicContact CB-CB 4.27Å; L172-V502 PolarHBondContact N-O 3.26Å; L172-V502 PolarHBondContact O-N 3.33Å; L174-V502 HydrophobicContact CD1-CB 4.23Å; L174-V502 HydrophobicContact CD1-CG2 3.58Å; L174-V502 HydrophobicContact CD2-CG2 4.2Å; I192-V502 HydrophobicContact CD1-CG2 3.47Å; I192-V502 VanDerWaalsContact CD1-CG2 3.47Å; L485-V502 CarbonylContact O-C 3.55Å; L485-V502 WeakPolarHBondContact O-CA 3.39Å; I486-V502 HydrophobicContact CG1-CG1 4.43Å; I486-V502 HydrophobicContact CG1-CG2 4.24Å; I486-V502 HydrophobicContact CG2-CG2 4.23Å; I500-V502 HydrophobicContact CG2-CG2 4.19Å
503	M	94.9	Very high	85.9	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.015	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.9	174.4	-71.6	-179.7	-63.7	0	0	109.4	P168 R170 E171 L463 I464 A484 L485 F505	P168-M503 HydrophobicContact CB-CB 3.94Å; P168-M503 HydrophobicContact CB-CG 4.12Å; P168-M503 HydrophobicContact CG-CB 4Å; P168-M503 HydrophobicContact CG-CG 3.87Å; P168-M503 HydrophobicContact CG-SD 3.67Å; R170-M503 WeakPolarHBondContact O-CA 3.48Å; E171-M503 HydrophobicContact CG-CG 4.16Å; L463-M503 HydrophobicContact CB-CE 4.28Å; I464-M503 HydrophobicContact CD1-CE 3.61Å; I464-M503 HydrophobicContact CD1-SD 4.46Å; I464-M503 HydrophobicContact CG1-CE 3.53Å; I464-M503 HydrophobicContact CG1-SD 4.08Å; A484-M503 CarbonylContact C-O 3.59Å; A484-M503 WeakPolarHBondContact CA-O 3.08Å; A484-M503 WeakPolarHBondContact CB-O 3.49Å; L485-M503 HydrophobicContact CB-CB 4.38Å; L485-M503 HydrophobicContact CB-CE 3.97Å; L485-M503 HydrophobicContact CD2-CE 3.19Å; L485-M503 HydrophobicContact CG-CE 3.69Å; L485-M503 PolarHBondContact N-O 2.87Å; L485-M503 PolarHBondContact O-N 3.24Å; M503-F505 HydrophobicContact CB-CE2 4.11Å; M503-F505 HydrophobicContact CB-CZ 4.33Å
504	D	92.3	Very high	85.4	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	129.2	178.2	-160.4	-17.2	0	0	0	109.9	P168 L169 R170 D506	P168-D504 CarbonylContact C-O 3.53Å; P168-D504 WeakPolarHBondContact CA-O 3.45Å; L169-D504 PolarHBondContact N-O 2.82Å; R170-D504 HydrophobicContact CB-CB 4.07Å; R170-D504 IonicContact CZ-OD2 3.07Å; R170-D504 IonicContact NE-OD2 2.66Å; R170-D504 IonicContact NH2-OD2 2.7Å; R170-D504 PolarHBondContact NH2-OD2 2.79Å; R170-D504 PolarHBondContact O-N 3.29Å; D504-D506 PolarHBondContact OD1-N 3.11Å
505	F	91.1	Very high	84.9	Confident	1 Å²	1	33.9 Å²	33.9	0%	0.004	20%	0.196	C	C	.	.			trans	-107.6	4.3	179.4	-63.1	-84	0	0	0	112.2	V159 N162 W163 P168 L463 T483 L485 M503	V159-F505 HydrophobicContact CG1-CB 4.31Å; N162-F505 HydrophobicContact CB-CB 4.16Å; N162-F505 HydrophobicContact CB-CD1 4.11Å; N162-F505 PolarHBondContact ND2-O 2.73Å; W163-F505 AromaticContact CD1-CG 3.95Å; W163-F505 HydrophobicContact CD2-CD1 4.25Å; W163-F505 AromaticContact CD2-CD2 3.72Å; W163-F505 HydrophobicContact CD2-CD2 3.72Å; W163-F505 HydrophobicContact CD2-CE1 4.33Å; W163-F505 AromaticContact CD2-CE2 3.81Å; W163-F505 HydrophobicContact CD2-CE2 3.81Å; W163-F505 AromaticContact CD2-CG 3.94Å; W163-F505 HydrophobicContact CD2-CG 3.94Å; W163-F505 HydrophobicContact CD2-CZ 4.13Å; W163-F505 AromaticContact CE2-CD2 3.35Å; W163-F505 AromaticContact CE2-CE2 3.76Å; W163-F505 AromaticContact CE2-CG 3.82Å; W163-F505 HydrophobicContact CE3-CD2 4.14Å; W163-F505 HydrophobicContact CE3-CE1 4.34Å; W163-F505 AromaticContact CE3-CE2 3.73Å; W163-F505 HydrophobicContact CE3-CE2 3.73Å; W163-F505 AromaticContact CE3-CZ 3.85Å; W163-F505 HydrophobicContact CE3-CZ 3.85Å; W163-F505 HydrophobicContact CG-CB 4.42Å; W163-F505 HydrophobicContact CG-CD1 4.2Å; W163-F505 HydrophobicContact CG-CD2 4.31Å; W163-F505 HydrophobicContact CG-CG 4.05Å; W163-F505 AromaticContact CH2-CD2 3.99Å; W163-F505 HydrophobicContact CH2-CD2 3.99Å; W163-F505 AromaticContact CH2-CE2 3.64Å; W163-F505 HydrophobicContact CH2-CE2 3.64Å; W163-F505 HydrophobicContact CH2-CZ 4.48Å; W163-F505 AromaticContact CZ2-CD2 3.51Å; W163-F505 HydrophobicContact CZ2-CD2 3.51Å; W163-F505 AromaticContact CZ2-CE2 3.68Å; W163-F505 HydrophobicContact CZ2-CE2 3.68Å; W163-F505 HydrophobicContact CZ2-CG 4.41Å; W163-F505 HydrophobicContact CZ3-CD2 4.27Å; W163-F505 AromaticContact CZ3-CE2 3.65Å; W163-F505 HydrophobicContact CZ3-CE2 3.65Å; W163-F505 HydrophobicContact CZ3-CZ 4.04Å; W163-F505 AromaticContact NE1-CD2 3.73Å; W163-F505 AromaticContact NE1-CG 3.79Å; P168-F505 HydrophobicContact CG-CE1 4.13Å; P168-F505 HydrophobicContact CG-CZ 4.28Å; L463-F505 HydrophobicContact CD2-CE1 4.41Å; L463-F505 HydrophobicContact CD2-CZ 4.12Å; T483-F505 WeakPolarHBondContact O-CA 3.27Å; T483-F505 WeakPolarHBondContact O-CB 3.42Å; T483-F505 PolarHBondContact O-N 3.02Å; L485-F505 HydrophobicContact CB-CE2 3.99Å; M503-F505 HydrophobicContact CB-CE2 4.11Å; M503-F505 HydrophobicContact CB-CZ 4.33Å
506	D	86.5	Confident	84.2	Confident	13 Å²	13	32.1 Å²	32.1	7%	0.07	19%	0.185	C	C	.	.			trans	-120.4	148.1	178.2	-155.3	-17.3	0	0	0	112.3	R155 V159 L169 T483 D504 A508	R155-D506 IonicContact CZ-OD1 3.19Å; R155-D506 IonicContact CZ-OD2 2.75Å; R155-D506 VanDerWaalsContact NE-CG 3.32Å; R155-D506 IonicContact NE-OD1 3.71Å; R155-D506 PolarHBondContact NE-OD1 3.04Å; R155-D506 IonicContact NE-OD2 3.57Å; R155-D506 PolarHBondContact NE-OD2 3.36Å; R155-D506 IonicContact NH2-OD1 3.96Å; R155-D506 IonicContact NH2-OD2 3.11Å; R155-D506 PolarHBondContact NH2-OD2 3.21Å; V159-D506 HydrophobicContact CG2-CB 3.77Å; V159-D506 VanDerWaalsContact CG2-CG 3.45Å; L169-D506 WeakPolarHBondContact CD1-O 3.28Å; T483-D506 HydrophobicContact CG2-CB 3.74Å; T483-D506 VanDerWaalsContact CG2-OD2 3.23Å; T483-D506 WeakPolarHBondContact CG2-OD2 3.23Å; D504-D506 PolarHBondContact OD1-N 3.11Å; D506-A508 PolarHBondContact OD1-N 2.86Å
507	N	67.6	Low	83.4	Confident	130 Å²	130	32.1 Å²	32.1	70%	0.695	19%	0.187	S	C	*	.	S	Bend	trans	-86.3	-22.6	178.8	-91.8	-28.9	0	0	0	112	L169	L169-N507 HydrophobicContact CD1-CB 4.2Å; L169-N507 WeakPolarHBondContact CD1-OD1 3.46Å
508	A	60.1	Low	82.4	Confident	29 Å²	29	28.5 Å²	28.5	24%	0.24	17%	0.169	C	C	.	.	S	Bend	trans	-84.7	117.5	172	0	0	0	0	0	107.6	D506 L510	D506-A508 PolarHBondContact OD1-N 2.86Å; A508-L510 PolarHBondContact O-N 3.15Å
509	S	47.9	Very low	81.1	Confident	93 Å²	93	30.6 Å²	30.6	65%	0.65	18%	0.182	S	C	*	.			trans	-39.2	133.5	178.9	54	0	0	0	0	112.3
510	L	42.3	Very low	79.5	Confident	70 Å²	70	32.3 Å²	32.3	37%	0.366	19%	0.193	S	C	.	.			trans	-35.5	0	178.5	-75	163.3	0	0	0	115.9	A206 A484 A508	A206-L510 HydrophobicContact CB-CD1 3.79Å; A484-L510 HydrophobicContact CB-CD1 4.37Å; A484-L510 HydrophobicContact CB-CD2 3.5Å; A484-L510 VanDerWaalsContact CB-CD2 3.5Å; A508-L510 PolarHBondContact O-N 3.15Å

Retrieved 510 of 510 residues in 1478.2 ms (Link to these results)

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